smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCN1C[C@@H]2C[NH+](CC[C@@H](C)CC(C)(C)C)C[C@H]2C1 ZINC001208667082 1117904817 /nfs/dbraw/zinc/90/48/17/1117904817.db2.gz XLJKIWQPRSBJLZ-BRWVUGGUSA-N 1 3 280.500 3.722 20 0 CHADHO CCC[NH+]1C[C@@H]2CN(CC[C@@H](C)CC(C)(C)C)C[C@H]2C1 ZINC001208667082 1117904822 /nfs/dbraw/zinc/90/48/22/1117904822.db2.gz XLJKIWQPRSBJLZ-BRWVUGGUSA-N 1 3 280.500 3.722 20 0 CHADHO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(C2CCCC2)C1 ZINC000245690005 1117983303 /nfs/dbraw/zinc/98/33/03/1117983303.db2.gz VVGVLJFAHWKENS-JKSUJKDBSA-N 1 3 264.457 3.515 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+]C2CCCCCCC2)C1 ZINC000715510629 1118308567 /nfs/dbraw/zinc/30/85/67/1118308567.db2.gz QSKXSZGJZLJWIV-JKSUJKDBSA-N 1 3 252.446 3.562 20 0 CHADHO C[C@@H](NCc1ccc(C[NH+]2CCCC2)cc1)c1cccnc1 ZINC000112518294 1125486210 /nfs/dbraw/zinc/48/62/10/1125486210.db2.gz UKSPYZHTWJQHQC-MRXNPFEDSA-N 1 3 295.430 3.528 20 0 CHADHO CC(C)[N@H+](C)Cc1ccccc1CN[C@H](C)c1cccnc1 ZINC000112527196 1125486718 /nfs/dbraw/zinc/48/67/18/1125486718.db2.gz NKLDKZPDNBUMFG-MRXNPFEDSA-N 1 3 297.446 3.773 20 0 CHADHO CC(C)[N@@H+](C)Cc1ccccc1CN[C@H](C)c1cccnc1 ZINC000112527196 1125486722 /nfs/dbraw/zinc/48/67/22/1125486722.db2.gz NKLDKZPDNBUMFG-MRXNPFEDSA-N 1 3 297.446 3.773 20 0 CHADHO C[C@H](C[C@H]1CCCCC[NH2+]1)NC[C@@H]1CCCCC1(F)F ZINC000390598681 1120574965 /nfs/dbraw/zinc/57/49/65/1120574965.db2.gz UBYCTOZYOIAHBP-QLFBSQMISA-N 1 3 288.426 3.712 20 0 CHADHO CCCCCC[N@@H+]1CCCC[C@@H]1C[C@@H]1CCCN1C ZINC001201754152 1123146249 /nfs/dbraw/zinc/14/62/49/1123146249.db2.gz OQXUEUNKCCJUTP-DLBZAZTESA-N 1 3 266.473 3.906 20 0 CHADHO CCCCCC[N@H+]1CCCC[C@@H]1C[C@@H]1CCCN1C ZINC001201754152 1123146250 /nfs/dbraw/zinc/14/62/50/1123146250.db2.gz OQXUEUNKCCJUTP-DLBZAZTESA-N 1 3 266.473 3.906 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN(CCC2=CCCCC2)C1 ZINC000450464175 1125035040 /nfs/dbraw/zinc/03/50/40/1125035040.db2.gz WNEDQDLTTKYXKC-QGZVFWFLSA-N 1 3 264.457 3.541 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN(CCC2=CCCCC2)C1 ZINC000450464175 1125035048 /nfs/dbraw/zinc/03/50/48/1125035048.db2.gz WNEDQDLTTKYXKC-QGZVFWFLSA-N 1 3 264.457 3.541 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+](CCC2=CCCCC2)C1 ZINC000450464175 1125035056 /nfs/dbraw/zinc/03/50/56/1125035056.db2.gz WNEDQDLTTKYXKC-QGZVFWFLSA-N 1 3 264.457 3.541 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+](CCC2=CCCCC2)C1 ZINC000450464175 1125035061 /nfs/dbraw/zinc/03/50/61/1125035061.db2.gz WNEDQDLTTKYXKC-QGZVFWFLSA-N 1 3 264.457 3.541 20 0 CHADHO CSc1ccc([C@@H](C)[NH2+]CC(C)(C)CN(C)C)cc1F ZINC000532188474 1125238079 /nfs/dbraw/zinc/23/80/79/1125238079.db2.gz CQTFRNYEENKDET-GFCCVEGCSA-N 1 3 298.471 3.786 20 0 CHADHO CC(C)[N@H+]([C@H]1CC[C@@H](C)[C@@H](C)C1)[C@@H]1CCCNCC1 ZINC001246595924 1131710102 /nfs/dbraw/zinc/71/01/02/1131710102.db2.gz UFKAVLUQOMPHCP-TWMKSMIVSA-N 1 3 266.473 3.664 20 0 CHADHO CC(C)[N@@H+]([C@H]1CC[C@@H](C)[C@@H](C)C1)[C@@H]1CCCNCC1 ZINC001246595924 1131710105 /nfs/dbraw/zinc/71/01/05/1131710105.db2.gz UFKAVLUQOMPHCP-TWMKSMIVSA-N 1 3 266.473 3.664 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CC[C@H](C)[C@@H](CN)C1 ZINC001205295747 1133556266 /nfs/dbraw/zinc/55/62/66/1133556266.db2.gz BOAJNTJZHARPFS-FEFZKZJHSA-N 1 3 266.473 3.820 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CC[C@H](C)[C@@H](CN)C1 ZINC001205295747 1133556269 /nfs/dbraw/zinc/55/62/69/1133556269.db2.gz BOAJNTJZHARPFS-FEFZKZJHSA-N 1 3 266.473 3.820 20 0 CHADHO CSc1cc(C)ccc1C[NH2+][C@H]1C[C@H](C)N(C)C[C@@H]1C ZINC000119274301 1125530546 /nfs/dbraw/zinc/53/05/46/1125530546.db2.gz LLDZLMIAFUHIBP-DZKIICNBSA-N 1 3 292.492 3.535 20 0 CHADHO CCN1CC[C@H]([N@H+](C)Cc2ccc([C@@H]3C[C@H]3C)o2)[C@H](C)C1 ZINC000245771695 1125594170 /nfs/dbraw/zinc/59/41/70/1125594170.db2.gz RZASARWNGFBHJO-SRABZTEZSA-N 1 3 290.451 3.565 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)Cc2ccc([C@@H]3C[C@H]3C)o2)[C@H](C)C1 ZINC000245771695 1125594174 /nfs/dbraw/zinc/59/41/74/1125594174.db2.gz RZASARWNGFBHJO-SRABZTEZSA-N 1 3 290.451 3.565 20 0 CHADHO CC[C@H]1c2ccsc2CC[N@H+]1CC[C@H]1CCCN1C ZINC000247329622 1125656423 /nfs/dbraw/zinc/65/64/23/1125656423.db2.gz USKOMTPNBBBKMI-HIFRSBDPSA-N 1 3 278.465 3.542 20 0 CHADHO CC[C@H]1c2ccsc2CC[N@@H+]1CC[C@H]1CCCN1C ZINC000247329622 1125656426 /nfs/dbraw/zinc/65/64/26/1125656426.db2.gz USKOMTPNBBBKMI-HIFRSBDPSA-N 1 3 278.465 3.542 20 0 CHADHO C[C@@]1(C[NH3+])CCN(Cc2ccc(-c3ccccc3)s2)C1 ZINC000261739359 1125741191 /nfs/dbraw/zinc/74/11/91/1125741191.db2.gz PBNIVVVHSJCDQJ-KRWDZBQOSA-N 1 3 286.444 3.586 20 0 CHADHO CC(C)[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000482353524 1126752188 /nfs/dbraw/zinc/75/21/88/1126752188.db2.gz QMUMSUFWNFFEKN-OKZBNKHCSA-N 1 3 280.500 3.911 20 0 CHADHO CCC[C@H](C)[C@H](CC)[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000482361598 1126752483 /nfs/dbraw/zinc/75/24/83/1126752483.db2.gz REESDXCTJWRJCZ-BBWFWOEESA-N 1 3 268.489 3.911 20 0 CHADHO C[C@H]([NH2+][C@@H](CCN(C)C)C(C)(C)C)c1cc(F)cc(F)c1 ZINC000483194618 1126772278 /nfs/dbraw/zinc/77/22/78/1126772278.db2.gz JGECGJIVYOJEFB-LRDDRELGSA-N 1 3 298.421 3.982 20 0 CHADHO COc1ccc([C@@H](C)N[C@H](CC[NH+](C)C)C(C)(C)C)cc1 ZINC000483200953 1126772433 /nfs/dbraw/zinc/77/24/33/1126772433.db2.gz OBUSFUKKKBVYDA-RHSMWYFYSA-N 1 3 292.467 3.712 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000747100247 1130517152 /nfs/dbraw/zinc/51/71/52/1130517152.db2.gz GOLGBLFDMXMCSM-ZBFHGGJFSA-N 1 3 264.457 3.562 20 0 CHADHO Cc1cc(C)cc([C@H](C)[NH2+][C@H]2CCC[C@@H](N(C)C)C2)c1 ZINC000484480876 1126820820 /nfs/dbraw/zinc/82/08/20/1126820820.db2.gz ANTGERDCBCNOAS-RYQLBKOJSA-N 1 3 274.452 3.827 20 0 CHADHO C[C@H]([NH2+][C@H](CCN(C)C)C(C)(C)C)c1ccc(Cl)nc1 ZINC000179127672 1126823988 /nfs/dbraw/zinc/82/39/88/1126823988.db2.gz AVTQNUMXYZSXLP-GXTWGEPZSA-N 1 3 297.874 3.752 20 0 CHADHO Cc1ccccc1[C@@H](C)N1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000485430883 1126913004 /nfs/dbraw/zinc/91/30/04/1126913004.db2.gz AXILODQDHMJTAA-QZTJIDSGSA-N 1 3 286.463 3.864 20 0 CHADHO Cc1ccccc1[C@@H](C)[N@@H+]1CC[C@H](CN2CCCCC2)C1 ZINC000485430883 1126913008 /nfs/dbraw/zinc/91/30/08/1126913008.db2.gz AXILODQDHMJTAA-QZTJIDSGSA-N 1 3 286.463 3.864 20 0 CHADHO Cc1ccccc1[C@@H](C)[N@H+]1CC[C@H](CN2CCCCC2)C1 ZINC000485430883 1126913010 /nfs/dbraw/zinc/91/30/10/1126913010.db2.gz AXILODQDHMJTAA-QZTJIDSGSA-N 1 3 286.463 3.864 20 0 CHADHO Cc1ccccc1[C@@H](C)N1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000485430880 1126913345 /nfs/dbraw/zinc/91/33/45/1126913345.db2.gz AXILODQDHMJTAA-MSOLQXFVSA-N 1 3 286.463 3.864 20 0 CHADHO Cc1ccccc1[C@@H](C)[N@@H+]1CC[C@@H](CN2CCCCC2)C1 ZINC000485430880 1126913346 /nfs/dbraw/zinc/91/33/46/1126913346.db2.gz AXILODQDHMJTAA-MSOLQXFVSA-N 1 3 286.463 3.864 20 0 CHADHO Cc1ccccc1[C@@H](C)[N@H+]1CC[C@@H](CN2CCCCC2)C1 ZINC000485430880 1126913347 /nfs/dbraw/zinc/91/33/47/1126913347.db2.gz AXILODQDHMJTAA-MSOLQXFVSA-N 1 3 286.463 3.864 20 0 CHADHO Cc1ccc2cc(C[NH2+][C@@H]3CCC[C@H](N(C)C)C3)ccc2n1 ZINC000189373306 1126931272 /nfs/dbraw/zinc/93/12/72/1126931272.db2.gz BSDJLENSWBAMGC-MSOLQXFVSA-N 1 3 297.446 3.506 20 0 CHADHO Cc1cccnc1[C@@H]([NH2+]CC[C@@H]1CCCCN1C)C(C)C ZINC000268098215 1127011713 /nfs/dbraw/zinc/01/17/13/1127011713.db2.gz KDRVOOSMYALLOP-IRXDYDNUSA-N 1 3 289.467 3.551 20 0 CHADHO CCC(CC)[N@@H+](CCCNC)[C@H](C)c1ccccc1 ZINC001236860576 1131026093 /nfs/dbraw/zinc/02/60/93/1131026093.db2.gz RJFSYXFBJASXFW-OAHLLOKOSA-N 1 3 262.441 3.848 20 0 CHADHO CSCC[C@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000151061769 1127121225 /nfs/dbraw/zinc/12/12/25/1127121225.db2.gz OSUIFSOGUKFCHR-AWEZNQCLSA-N 1 3 284.513 3.515 20 0 CHADHO CC(C)C(CN1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1)C(C)C ZINC000572489929 1127201788 /nfs/dbraw/zinc/20/17/88/1127201788.db2.gz JUHCEHRWOYNVDA-APWZRJJASA-N 1 3 292.511 3.863 20 0 CHADHO CC(C)C(CN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)C(C)C ZINC000572489929 1127201791 /nfs/dbraw/zinc/20/17/91/1127201791.db2.gz JUHCEHRWOYNVDA-APWZRJJASA-N 1 3 292.511 3.863 20 0 CHADHO CSCCNC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000590643520 1127266447 /nfs/dbraw/zinc/26/64/47/1127266447.db2.gz ZDNCOFVXKDNNTE-UHFFFAOYSA-N 1 3 286.529 3.618 20 0 CHADHO Cc1ccccc1C[C@H](C)N[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000157401076 1127308930 /nfs/dbraw/zinc/30/89/30/1127308930.db2.gz MYRORJRFFBDDPQ-JVPBZIDWSA-N 1 3 280.415 3.660 20 0 CHADHO CC(C)CN1CCC([NH2+]Cc2ccc(C3CC3)cc2)CC1 ZINC000357788541 1127394393 /nfs/dbraw/zinc/39/43/93/1127394393.db2.gz MDIPPRIHUMXHNV-UHFFFAOYSA-N 1 3 286.463 3.774 20 0 CHADHO CC[C@@H]([NH2+][C@H](C)CCN(C)C)c1cc(Cl)ccc1OC ZINC000360858990 1127515763 /nfs/dbraw/zinc/51/57/63/1127515763.db2.gz MNQJOUWNOCSTFO-IUODEOHRSA-N 1 3 298.858 3.730 20 0 CHADHO CC[C@H](c1ccc(F)cc1F)N1CCC(C[NH+](C)C)CC1 ZINC000606432846 1127762138 /nfs/dbraw/zinc/76/21/38/1127762138.db2.gz FNZSAXXIQNZHOT-QGZVFWFLSA-N 1 3 296.405 3.690 20 0 CHADHO CN1CCC[C@@H]1CC[N@H+](C)CCc1cccc2ccccc21 ZINC000535472852 1127916694 /nfs/dbraw/zinc/91/66/94/1127916694.db2.gz UUGVKRMLISZRQT-LJQANCHMSA-N 1 3 296.458 3.798 20 0 CHADHO CN1CCC[C@@H]1CC[N@@H+](C)CCc1cccc2ccccc21 ZINC000535472852 1127916695 /nfs/dbraw/zinc/91/66/95/1127916695.db2.gz UUGVKRMLISZRQT-LJQANCHMSA-N 1 3 296.458 3.798 20 0 CHADHO C[C@H]1C[C@H](NCc2ccc(C3CCCC3)cc2)CC[N@@H+]1C ZINC000462780436 1127954657 /nfs/dbraw/zinc/95/46/57/1127954657.db2.gz WJYPSCOHQAUVGD-HNAYVOBHSA-N 1 3 286.463 3.917 20 0 CHADHO C[C@H]1C[C@H](NCc2ccc(C3CCCC3)cc2)CC[N@H+]1C ZINC000462780436 1127954659 /nfs/dbraw/zinc/95/46/59/1127954659.db2.gz WJYPSCOHQAUVGD-HNAYVOBHSA-N 1 3 286.463 3.917 20 0 CHADHO CC(C)c1ccc(CCN(C)C[C@H]2CCC[N@H+](C)C2)cc1 ZINC000468950724 1128029428 /nfs/dbraw/zinc/02/94/28/1128029428.db2.gz KAKFWOSEBWMMGD-SFHVURJKSA-N 1 3 288.479 3.626 20 0 CHADHO CC(C)c1ccc(CCN(C)C[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000468950724 1128029432 /nfs/dbraw/zinc/02/94/32/1128029432.db2.gz KAKFWOSEBWMMGD-SFHVURJKSA-N 1 3 288.479 3.626 20 0 CHADHO CN(Cc1ccccc1-c1ccccc1)C[C@@H]1CCC[NH2+]C1 ZINC000469874482 1128057309 /nfs/dbraw/zinc/05/73/09/1128057309.db2.gz IEQCFFDEBSSECW-QGZVFWFLSA-N 1 3 294.442 3.785 20 0 CHADHO CC(C)CCN1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000303511189 1128070506 /nfs/dbraw/zinc/07/05/06/1128070506.db2.gz BLMMMZXKTCHWJA-SJORKVTESA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)CCN1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000303511189 1128070509 /nfs/dbraw/zinc/07/05/09/1128070509.db2.gz BLMMMZXKTCHWJA-SJORKVTESA-N 1 3 266.473 3.619 20 0 CHADHO CC[NH+](CC)C[C@@H]1CCN([C@@H]2CCCc3ccccc32)C1 ZINC000174211644 1128098660 /nfs/dbraw/zinc/09/86/60/1128098660.db2.gz NMNAUPQUMMLZGH-QFBILLFUSA-N 1 3 286.463 3.728 20 0 CHADHO CCCOc1ccc([C@H](C)N[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000222929363 1128179742 /nfs/dbraw/zinc/17/97/42/1128179742.db2.gz IEQWRASUGHPXSM-ZOBUZTSGSA-N 1 3 290.451 3.609 20 0 CHADHO CCCOc1ccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000222929363 1128179745 /nfs/dbraw/zinc/17/97/45/1128179745.db2.gz IEQWRASUGHPXSM-ZOBUZTSGSA-N 1 3 290.451 3.609 20 0 CHADHO Cc1cccc([C@H](C)[NH2+]CC[C@@H](C)N2CCCCC2)c1 ZINC000542487347 1128180072 /nfs/dbraw/zinc/18/00/72/1128180072.db2.gz UXMHZXPGVHCHLM-SJORKVTESA-N 1 3 274.452 3.910 20 0 CHADHO CC(C)CCN1CCC([NH2+]C[C@H](C)CC(F)(F)F)CC1 ZINC000926586423 1128182506 /nfs/dbraw/zinc/18/25/06/1128182506.db2.gz WZIMKKSAVFYNGG-CYBMUJFWSA-N 1 3 294.405 3.675 20 0 CHADHO CCC[C@@H](C)N1CCC([NH3+])(c2ccc(Cl)cc2)CC1 ZINC001257314628 1128231132 /nfs/dbraw/zinc/23/11/32/1128231132.db2.gz WZFRHHYEPCEFPP-CYBMUJFWSA-N 1 3 280.843 3.778 20 0 CHADHO CC(C)=CCC[C@H](C)CN1CCCC[C@]12CCC[NH2+]C2 ZINC001235174181 1128312177 /nfs/dbraw/zinc/31/21/77/1128312177.db2.gz SJCMMJHHGIEZIN-ZWKOTPCHSA-N 1 3 278.484 3.977 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@@H+]1CCCC[C@]12CCCNC2 ZINC001235174181 1128312182 /nfs/dbraw/zinc/31/21/82/1128312182.db2.gz SJCMMJHHGIEZIN-ZWKOTPCHSA-N 1 3 278.484 3.977 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@H+]1CCCC[C@]12CCCNC2 ZINC001235174181 1128312185 /nfs/dbraw/zinc/31/21/85/1128312185.db2.gz SJCMMJHHGIEZIN-ZWKOTPCHSA-N 1 3 278.484 3.977 20 0 CHADHO CC(C)=CCC[C@@H](C)CN1CCCC[C@@]12CCC[NH2+]C2 ZINC001235174159 1128312619 /nfs/dbraw/zinc/31/26/19/1128312619.db2.gz SJCMMJHHGIEZIN-MSOLQXFVSA-N 1 3 278.484 3.977 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@@H+]1CCCC[C@@]12CCCNC2 ZINC001235174159 1128312624 /nfs/dbraw/zinc/31/26/24/1128312624.db2.gz SJCMMJHHGIEZIN-MSOLQXFVSA-N 1 3 278.484 3.977 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@H+]1CCCC[C@@]12CCCNC2 ZINC001235174159 1128312627 /nfs/dbraw/zinc/31/26/27/1128312627.db2.gz SJCMMJHHGIEZIN-MSOLQXFVSA-N 1 3 278.484 3.977 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H]2C[C@@H](C(C)C)c3ccccc32)C1 ZINC000562592604 1128412572 /nfs/dbraw/zinc/41/25/72/1128412572.db2.gz MPCOGOKXUXGMCB-MNEFBYGVSA-N 1 3 286.463 3.802 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H]2C[C@@H](C(C)C)c3ccccc32)C1 ZINC000562592604 1128412573 /nfs/dbraw/zinc/41/25/73/1128412573.db2.gz MPCOGOKXUXGMCB-MNEFBYGVSA-N 1 3 286.463 3.802 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H]2C[C@@H](C(C)C)c3ccccc32)C1 ZINC000562592604 1128412576 /nfs/dbraw/zinc/41/25/76/1128412576.db2.gz MPCOGOKXUXGMCB-MNEFBYGVSA-N 1 3 286.463 3.802 20 0 CHADHO C[C@H](Cc1cccc(Cl)c1)[NH2+][C@@H]1CCC[C@H](N(C)C)C1 ZINC000715276149 1128359933 /nfs/dbraw/zinc/35/99/33/1128359933.db2.gz JNFCANDPLGOWJO-XYPHTWIQSA-N 1 3 294.870 3.733 20 0 CHADHO C[C@H](Cc1ccccc1Cl)[NH2+][C@@H]1CCC[C@H](N(C)C)C1 ZINC000715278259 1128360185 /nfs/dbraw/zinc/36/01/85/1128360185.db2.gz PTBADRMSGITFFY-BMFZPTHFSA-N 1 3 294.870 3.733 20 0 CHADHO C[C@H](CN[C@H](c1ccc(F)cc1)C1CC1)C[NH+]1CCCC1 ZINC000062078868 1128436987 /nfs/dbraw/zinc/43/69/87/1128436987.db2.gz SPELMIRFKKXAJV-KDOFPFPSSA-N 1 3 290.426 3.598 20 0 CHADHO Cc1ccccc1[C@H](C)[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000125905902 1128456585 /nfs/dbraw/zinc/45/65/85/1128456585.db2.gz HXEYEQFSRPCCOP-DLBZAZTESA-N 1 3 274.452 3.766 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCN(C(C)C)C2)cc1 ZINC000125976949 1128459478 /nfs/dbraw/zinc/45/94/78/1128459478.db2.gz UGKFDVBTXZFJEY-IRXDYDNUSA-N 1 3 274.452 3.766 20 0 CHADHO C[NH+](C)Cc1cccc(CNCc2ccc3[nH]ccc3c2)c1 ZINC000565222072 1128521843 /nfs/dbraw/zinc/52/18/43/1128521843.db2.gz QJYSQHFYIHOQOE-UHFFFAOYSA-N 1 3 293.414 3.519 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000129436162 1128541204 /nfs/dbraw/zinc/54/12/04/1128541204.db2.gz IFNYFGRWWCXWPU-MPGHIAIKSA-N 1 3 274.452 3.943 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000129436162 1128541206 /nfs/dbraw/zinc/54/12/06/1128541206.db2.gz IFNYFGRWWCXWPU-MPGHIAIKSA-N 1 3 274.452 3.943 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H]2CCCC23CCCC3)C1 ZINC000556076218 1128544880 /nfs/dbraw/zinc/54/48/80/1128544880.db2.gz LIYRRDRCNBCCML-IRXDYDNUSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@H](CN[C@H](CC1CC1)c1ccccc1)C[NH+]1CCCC1 ZINC000566772589 1128551320 /nfs/dbraw/zinc/55/13/20/1128551320.db2.gz OQOSQFKUPZQLNB-VQIMIIECSA-N 1 3 286.463 3.849 20 0 CHADHO CCCCN1CCC([NH2+][C@H]2CCc3cc(F)ccc32)CC1 ZINC000130015971 1128561992 /nfs/dbraw/zinc/56/19/92/1128561992.db2.gz CWCRHFXARJYXLH-SFHVURJKSA-N 1 3 290.426 3.667 20 0 CHADHO C[C@@H]1C[C@@H](N)CC[N@@H+]1CC1CCC(c2ccccc2)CC1 ZINC000569706870 1128607508 /nfs/dbraw/zinc/60/75/08/1128607508.db2.gz UPIRSMBHBUIMQS-JVDULTGUSA-N 1 3 286.463 3.772 20 0 CHADHO C[C@@H]1C[C@@H](N)CC[N@H+]1CC1CCC(c2ccccc2)CC1 ZINC000569706870 1128607510 /nfs/dbraw/zinc/60/75/10/1128607510.db2.gz UPIRSMBHBUIMQS-JVDULTGUSA-N 1 3 286.463 3.772 20 0 CHADHO Cc1cccc([C@@H](C)[NH2+]C2CCN(CC(C)C)CC2)c1 ZINC000131233248 1128610197 /nfs/dbraw/zinc/61/01/97/1128610197.db2.gz IKMKWPPZTSIYQL-MRXNPFEDSA-N 1 3 274.452 3.766 20 0 CHADHO CC1=CC[C@H]([NH2+][C@H](C)[C@@H]2CCCN(C3CCC3)C2)CC1 ZINC000556833708 1128628462 /nfs/dbraw/zinc/62/84/62/1128628462.db2.gz JRNOJEPRZFYQFA-ZACQAIPSSA-N 1 3 276.468 3.728 20 0 CHADHO COc1ccc([C@@H](C)[NH2+]CC(C)(C)CN(C)C)cc1Cl ZINC000132123004 1128643965 /nfs/dbraw/zinc/64/39/65/1128643965.db2.gz XVQNOZUVZGSXFV-GFCCVEGCSA-N 1 3 298.858 3.587 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](C[C@H]2CC(C)=C[C@H](C)C2)C1 ZINC000577945713 1128700035 /nfs/dbraw/zinc/70/00/35/1128700035.db2.gz VIUOUIDQQSPSOW-RYQLBKOJSA-N 1 3 278.484 3.643 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](C[C@H]2CC(C)=C[C@H](C)C2)C1 ZINC000577945713 1128700039 /nfs/dbraw/zinc/70/00/39/1128700039.db2.gz VIUOUIDQQSPSOW-RYQLBKOJSA-N 1 3 278.484 3.643 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[NH2+][C@H]1CCC[C@H](N(C)C)C1 ZINC001258060605 1128719385 /nfs/dbraw/zinc/71/93/85/1128719385.db2.gz HSQJYYDFMASWGP-QAETUUGQSA-N 1 3 268.489 3.910 20 0 CHADHO Cc1cc(NCC[N@H+]2CCC[C@@H](C)C2)c2ccccc2n1 ZINC000195667322 1128734978 /nfs/dbraw/zinc/73/49/78/1128734978.db2.gz NHBODNUGPUTQRC-CQSZACIVSA-N 1 3 283.419 3.687 20 0 CHADHO Cc1cc(NCC[N@@H+]2CCC[C@@H](C)C2)c2ccccc2n1 ZINC000195667322 1128734980 /nfs/dbraw/zinc/73/49/80/1128734980.db2.gz NHBODNUGPUTQRC-CQSZACIVSA-N 1 3 283.419 3.687 20 0 CHADHO Cc1ncc([C@@H](C)N[C@@H](CCC[NH3+])c2ccccc2)s1 ZINC000643543760 1117782359 /nfs/dbraw/zinc/78/23/59/1117782359.db2.gz OHIZYYBMYCOOSH-DOMZBBRYSA-N 1 3 289.448 3.582 20 0 CHADHO c1ccc([C@@H]2CCCC[C@H]2[NH2+][C@@H]2CCNC3(CCC3)C2)cc1 ZINC000643546565 1117792530 /nfs/dbraw/zinc/79/25/30/1117792530.db2.gz REJSAGALPUPEIA-CEXWTWQISA-N 1 3 298.474 3.977 20 0 CHADHO C[N@@H+]1CC[C@H](N[C@H]2CCCc3ccccc32)CC1(C)C ZINC000623336396 1117834464 /nfs/dbraw/zinc/83/44/64/1117834464.db2.gz MIFLLFKFLWGURT-RDJZCZTQSA-N 1 3 272.436 3.526 20 0 CHADHO C[N@H+]1CC[C@H](N[C@H]2CCCc3ccccc32)CC1(C)C ZINC000623336396 1117834473 /nfs/dbraw/zinc/83/44/73/1117834473.db2.gz MIFLLFKFLWGURT-RDJZCZTQSA-N 1 3 272.436 3.526 20 0 CHADHO CCC[C@H](N[C@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1 ZINC000623339895 1117839052 /nfs/dbraw/zinc/83/90/52/1117839052.db2.gz OMLBFYYSRKPLRI-IRXDYDNUSA-N 1 3 274.452 3.990 20 0 CHADHO CCC[C@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1 ZINC000623339895 1117839061 /nfs/dbraw/zinc/83/90/61/1117839061.db2.gz OMLBFYYSRKPLRI-IRXDYDNUSA-N 1 3 274.452 3.990 20 0 CHADHO C[N@@H+]1CC[C@H](NC2(c3ccccc3)CCC2)CC1(C)C ZINC000623386036 1117847307 /nfs/dbraw/zinc/84/73/07/1117847307.db2.gz IBMWWSAXCWXZTL-INIZCTEOSA-N 1 3 272.436 3.528 20 0 CHADHO C[N@H+]1CC[C@H](NC2(c3ccccc3)CCC2)CC1(C)C ZINC000623386036 1117847313 /nfs/dbraw/zinc/84/73/13/1117847313.db2.gz IBMWWSAXCWXZTL-INIZCTEOSA-N 1 3 272.436 3.528 20 0 CHADHO C[N@@H+]1CC[C@@H](N[C@H](CC2CC2)c2ccccc2)CC1(C)C ZINC000623431732 1117855903 /nfs/dbraw/zinc/85/59/03/1117855903.db2.gz OJMAKBIYVSJLLZ-QZTJIDSGSA-N 1 3 286.463 3.990 20 0 CHADHO C[N@H+]1CC[C@@H](N[C@H](CC2CC2)c2ccccc2)CC1(C)C ZINC000623431732 1117855909 /nfs/dbraw/zinc/85/59/09/1117855909.db2.gz OJMAKBIYVSJLLZ-QZTJIDSGSA-N 1 3 286.463 3.990 20 0 CHADHO C[C@H](CCc1ccccc1)C[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000623657465 1117883158 /nfs/dbraw/zinc/88/31/58/1117883158.db2.gz RFWLRXFRSMGWEM-MJGOQNOKSA-N 1 3 288.479 3.577 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N[C@@H](C)c1nc(C)cs1 ZINC000623849135 1117943427 /nfs/dbraw/zinc/94/34/27/1117943427.db2.gz WUMBXTKHOIIKID-OCCSQVGLSA-N 1 3 283.485 3.613 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N[C@H](C)c1nc(C)cs1 ZINC000623849133 1117943522 /nfs/dbraw/zinc/94/35/22/1117943522.db2.gz WUMBXTKHOIIKID-GXTWGEPZSA-N 1 3 283.485 3.613 20 0 CHADHO CCCN1CCC([NH2+]Cc2oc3ccccc3c2C)CC1 ZINC000119964500 1117971564 /nfs/dbraw/zinc/97/15/64/1117971564.db2.gz NVALBBQORUAUAJ-UHFFFAOYSA-N 1 3 286.419 3.705 20 0 CHADHO C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(C2CCCC2)C1 ZINC000245690005 1117983300 /nfs/dbraw/zinc/98/33/00/1117983300.db2.gz VVGVLJFAHWKENS-JKSUJKDBSA-N 1 3 264.457 3.515 20 0 CHADHO C[C@@H]1[C@H]([NH2+]C[C@H]2CCCCN(C)C2)C[C@@H]1c1ccccc1 ZINC000624122312 1117984569 /nfs/dbraw/zinc/98/45/69/1117984569.db2.gz OCFFNVKPZWAHKS-OGWHTMIXSA-N 1 3 286.463 3.500 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)[C@@H](C)c1ccccc1 ZINC000624121179 1117985065 /nfs/dbraw/zinc/98/50/65/1117985065.db2.gz PPARYTJDHMEOBO-IKGGRYGDSA-N 1 3 274.452 3.500 20 0 CHADHO CC(C)CC[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)C1CC1 ZINC000624123105 1117985933 /nfs/dbraw/zinc/98/59/33/1117985933.db2.gz FYUIYBBVKRODKJ-NVXWUHKLSA-N 1 3 266.473 3.523 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCCN(C)C2)cc1C ZINC000624120428 1117985922 /nfs/dbraw/zinc/98/59/22/1117985922.db2.gz YWRSRYUBFZLOQS-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000624122973 1117986368 /nfs/dbraw/zinc/98/63/68/1117986368.db2.gz BZLRAUUJNHHDNX-NEPXVJNWSA-N 1 3 286.463 3.500 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCCN(C)C1)C1CCC(F)(F)CC1 ZINC000624123193 1117986643 /nfs/dbraw/zinc/98/66/43/1117986643.db2.gz HRHIOWWRYNSXON-UONOGXRCSA-N 1 3 288.426 3.522 20 0 CHADHO CCN1CC[C@H](C[NH2+]C2CC(c3cccc(Cl)c3)C2)C1 ZINC000037644385 1118033741 /nfs/dbraw/zinc/03/37/41/1118033741.db2.gz QJZWUJXVZKNPHF-BZOOQXSSSA-N 1 3 292.854 3.517 20 0 CHADHO C[C@H](CC[NH2+][C@H]1CCC[C@@H]1c1ccc(Cl)cc1)N(C)C ZINC001206827737 1118039515 /nfs/dbraw/zinc/03/95/15/1118039515.db2.gz RFEREIJOZDQEIE-XYPHTWIQSA-N 1 3 294.870 3.906 20 0 CHADHO C[C@@H](CCc1ccco1)NCCC[N@H+](C)C1CCCCC1 ZINC000037901169 1118045916 /nfs/dbraw/zinc/04/59/16/1118045916.db2.gz SBRQTHNNBGYQJN-INIZCTEOSA-N 1 3 292.467 3.845 20 0 CHADHO C[C@@H](CCc1ccco1)NCCC[N@@H+](C)C1CCCCC1 ZINC000037901169 1118045922 /nfs/dbraw/zinc/04/59/22/1118045922.db2.gz SBRQTHNNBGYQJN-INIZCTEOSA-N 1 3 292.467 3.845 20 0 CHADHO C[N@H+](CCCN1CCCCC1)CCc1ccc(Cl)cc1 ZINC001209451369 1118063279 /nfs/dbraw/zinc/06/32/79/1118063279.db2.gz VXBDRELEZFSMPY-UHFFFAOYSA-N 1 3 294.870 3.690 20 0 CHADHO C[N@@H+](CCCN1CCCCC1)CCc1ccc(Cl)cc1 ZINC001209451369 1118063284 /nfs/dbraw/zinc/06/32/84/1118063284.db2.gz VXBDRELEZFSMPY-UHFFFAOYSA-N 1 3 294.870 3.690 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@H]2CCC(C)(C)C[C@H]2C)C1 ZINC000155912581 1118159593 /nfs/dbraw/zinc/15/95/93/1118159593.db2.gz KJYLCIXIBPTWOC-PMPSAXMXSA-N 1 3 266.473 3.521 20 0 CHADHO Cc1cc2c(c(C)c1)[C@@H](NC1C[C@H]3CC[C@@H](C1)[N@H+]3C)CC2 ZINC000655773045 1118207154 /nfs/dbraw/zinc/20/71/54/1118207154.db2.gz WQLGAQRVBQAROR-FBVQUNGASA-N 1 3 284.447 3.506 20 0 CHADHO Cc1cc2c(c(C)c1)[C@@H](NC1C[C@H]3CC[C@@H](C1)[N@@H+]3C)CC2 ZINC000655773045 1118207158 /nfs/dbraw/zinc/20/71/58/1118207158.db2.gz WQLGAQRVBQAROR-FBVQUNGASA-N 1 3 284.447 3.506 20 0 CHADHO C[C@@H](CC[NH2+][C@H]1CC(C)(C)C[C@H]1C)N1CCCCC1 ZINC001650935109 1118219840 /nfs/dbraw/zinc/21/98/40/1118219840.db2.gz AAABEPCGDZCIAR-PMPSAXMXSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@H](Cc1ccc(Cl)cc1)[NH2+][C@H]1CCC[C@@H](N(C)C)C1 ZINC000715491961 1118280716 /nfs/dbraw/zinc/28/07/16/1118280716.db2.gz RPVDTCRILOPBHK-XOKHGSTOSA-N 1 3 294.870 3.733 20 0 CHADHO CC(C)c1cccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)c1 ZINC000683691480 1118287447 /nfs/dbraw/zinc/28/74/47/1118287447.db2.gz DYJATUOVYYCGES-AYHJJNSGSA-N 1 3 272.436 3.525 20 0 CHADHO CCCCOCCC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000132009241 1118301493 /nfs/dbraw/zinc/30/14/93/1118301493.db2.gz UKHMEWHAFYPHKZ-UHFFFAOYSA-N 1 3 296.499 3.580 20 0 CHADHO CCCN1CCC([N@H+](C)C/C=C\c2ccccc2)CC1 ZINC000255331807 1118414911 /nfs/dbraw/zinc/41/49/11/1118414911.db2.gz OCUCYTXDRCFIOH-YFHOEESVSA-N 1 3 272.436 3.506 20 0 CHADHO CCCN1CCC([N@@H+](C)C/C=C\c2ccccc2)CC1 ZINC000255331807 1118414913 /nfs/dbraw/zinc/41/49/13/1118414913.db2.gz OCUCYTXDRCFIOH-YFHOEESVSA-N 1 3 272.436 3.506 20 0 CHADHO C(=C\c1ccccc1)\CN1CCC(C[NH+]2CCCC2)CC1 ZINC000255592132 1118478349 /nfs/dbraw/zinc/47/83/49/1118478349.db2.gz CQALNYYYLXDLMJ-TWGQIWQCSA-N 1 3 284.447 3.508 20 0 CHADHO C[C@@H]1c2ccsc2CCN1Cc1cccc2c1CC[NH2+]C2 ZINC000123945782 1118577649 /nfs/dbraw/zinc/57/76/49/1118577649.db2.gz OUPDMDOBIXFJPY-CYBMUJFWSA-N 1 3 298.455 3.513 20 0 CHADHO CC(C)C1CCC([NH2+]C[C@H](C)CN2CCCCC2)CC1 ZINC000109920301 1118588018 /nfs/dbraw/zinc/58/80/18/1118588018.db2.gz NZMUFMIJLLCXRG-AOCRQIFASA-N 1 3 280.500 3.913 20 0 CHADHO CC[C@@H]([NH2+]CC[C@@H]1CCCN1C)c1ccc(Cl)cc1 ZINC000341215231 1118624285 /nfs/dbraw/zinc/62/42/85/1118624285.db2.gz DVAHKMPLQIFBPS-JKSUJKDBSA-N 1 3 280.843 3.865 20 0 CHADHO C[N@@H+](CCCSc1ccccc1Cl)C1CCNCC1 ZINC000430615740 1118627499 /nfs/dbraw/zinc/62/74/99/1118627499.db2.gz DBTJWZIXWLRUAD-UHFFFAOYSA-N 1 3 298.883 3.506 20 0 CHADHO CN(CCCSc1ccccc1Cl)C1CC[NH2+]CC1 ZINC000430615740 1118627496 /nfs/dbraw/zinc/62/74/96/1118627496.db2.gz DBTJWZIXWLRUAD-UHFFFAOYSA-N 1 3 298.883 3.506 20 0 CHADHO C[N@H+](CCCSc1ccccc1Cl)C1CCNCC1 ZINC000430615740 1118627497 /nfs/dbraw/zinc/62/74/97/1118627497.db2.gz DBTJWZIXWLRUAD-UHFFFAOYSA-N 1 3 298.883 3.506 20 0 CHADHO C[NH+](C)CCCN[C@H](CCc1ccccc1)c1ccccc1 ZINC000341569710 1118743194 /nfs/dbraw/zinc/74/31/94/1118743194.db2.gz CVINBBWNJWFQKU-HXUWFJFHSA-N 1 3 296.458 3.902 20 0 CHADHO C[C@@H]([NH2+]CC1=CCCC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000401090822 1118778728 /nfs/dbraw/zinc/77/87/28/1118778728.db2.gz VLRPRKUJBQPAAI-VQIMIIECSA-N 1 3 284.447 3.597 20 0 CHADHO C[C@H](NCCCC[N@@H+]1CCCC[C@H]1C)c1ccc(F)cn1 ZINC000092739329 1118850568 /nfs/dbraw/zinc/85/05/68/1118850568.db2.gz DNPLEIMHASGEDU-CABCVRRESA-N 1 3 293.430 3.526 20 0 CHADHO C[C@H](NCCCC[N@H+]1CCCC[C@H]1C)c1ccc(F)cn1 ZINC000092739329 1118850573 /nfs/dbraw/zinc/85/05/73/1118850573.db2.gz DNPLEIMHASGEDU-CABCVRRESA-N 1 3 293.430 3.526 20 0 CHADHO Clc1ccc2c(c1)[C@H]([NH2+]CCCN1CCCC1)CCC2 ZINC000535687382 1118876669 /nfs/dbraw/zinc/87/66/69/1118876669.db2.gz VTASHGJIFHNZEV-QGZVFWFLSA-N 1 3 292.854 3.793 20 0 CHADHO C[C@@H]1C[C@H]([N@H+](C[C@@H]2CCCNC2)C2CC2)CC(C)(C)C1 ZINC000226436747 1118927964 /nfs/dbraw/zinc/92/79/64/1118927964.db2.gz FEFUVGRQTHZHPI-INMHGKMJSA-N 1 3 278.484 3.665 20 0 CHADHO C[C@@H]1C[C@H]([N@@H+](C[C@@H]2CCCNC2)C2CC2)CC(C)(C)C1 ZINC000226436747 1118927967 /nfs/dbraw/zinc/92/79/67/1118927967.db2.gz FEFUVGRQTHZHPI-INMHGKMJSA-N 1 3 278.484 3.665 20 0 CHADHO CN1CCCC[C@H]1CC[N@H+](C)Cc1ccccc1C1CC1 ZINC001167509986 1118973366 /nfs/dbraw/zinc/97/33/66/1118973366.db2.gz RZBOEVCJXJULDQ-SFHVURJKSA-N 1 3 286.463 3.870 20 0 CHADHO CN1CCCC[C@H]1CC[N@@H+](C)Cc1ccccc1C1CC1 ZINC001167509986 1118973369 /nfs/dbraw/zinc/97/33/69/1118973369.db2.gz RZBOEVCJXJULDQ-SFHVURJKSA-N 1 3 286.463 3.870 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H](C)CN1CCCCC1)c1ccsc1 ZINC000394347269 1119237605 /nfs/dbraw/zinc/23/76/05/1119237605.db2.gz DELPQEGWIJQSBN-GDBMZVCRSA-N 1 3 280.481 3.911 20 0 CHADHO CC[C@H]([NH2+]C[C@H](C)CN1CCCCC1)c1ccsc1 ZINC000394347274 1119237846 /nfs/dbraw/zinc/23/78/46/1119237846.db2.gz DELPQEGWIJQSBN-HOCLYGCPSA-N 1 3 280.481 3.911 20 0 CHADHO CCSc1ccc([C@H](C)NC[C@@H]2CCC[N@@H+]2CC)cc1 ZINC000535990246 1119337481 /nfs/dbraw/zinc/33/74/81/1119337481.db2.gz WZEUNXLWQFYYIT-HOCLYGCPSA-N 1 3 292.492 3.934 20 0 CHADHO CCSc1ccc([C@H](C)NC[C@@H]2CCC[N@H+]2CC)cc1 ZINC000535990246 1119337484 /nfs/dbraw/zinc/33/74/84/1119337484.db2.gz WZEUNXLWQFYYIT-HOCLYGCPSA-N 1 3 292.492 3.934 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H](C)c2cc(C)cc(C)c2)C1 ZINC000151095638 1119392529 /nfs/dbraw/zinc/39/25/29/1119392529.db2.gz HATKHDMJRKQFNL-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H](C)c2cc(C)cc(C)c2)C1 ZINC000151095638 1119392525 /nfs/dbraw/zinc/39/25/25/1119392525.db2.gz HATKHDMJRKQFNL-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO CCC[C@H](NC[C@@H]1CC[N@H+](CCC)C1)c1ccccc1 ZINC000151094387 1119393285 /nfs/dbraw/zinc/39/32/85/1119393285.db2.gz NWRGRGQINNVIRD-WMZOPIPTSA-N 1 3 274.452 3.849 20 0 CHADHO CCC[C@H](NC[C@@H]1CC[N@@H+](CCC)C1)c1ccccc1 ZINC000151094387 1119393286 /nfs/dbraw/zinc/39/32/86/1119393286.db2.gz NWRGRGQINNVIRD-WMZOPIPTSA-N 1 3 274.452 3.849 20 0 CHADHO CCC[C@H]([NH2+]C[C@@H]1CCN(CCC)C1)c1ccccc1 ZINC000151094387 1119393288 /nfs/dbraw/zinc/39/32/88/1119393288.db2.gz NWRGRGQINNVIRD-WMZOPIPTSA-N 1 3 274.452 3.849 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@@H](C)c2ccc(C)c(C)c2)C1 ZINC000151111477 1119398657 /nfs/dbraw/zinc/39/86/57/1119398657.db2.gz HZRUASLERNNPBB-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@@H](C)c2ccc(C)c(C)c2)C1 ZINC000151111477 1119398659 /nfs/dbraw/zinc/39/86/59/1119398659.db2.gz HZRUASLERNNPBB-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@H]1CCCc2ccc(F)cc21 ZINC000650756705 1119414025 /nfs/dbraw/zinc/41/40/25/1119414025.db2.gz IEUSTQKSUPEVGD-IBGZPJMESA-N 1 3 298.405 3.712 20 0 CHADHO Clc1cccc(C2CCN(C[C@H]3CCC[NH2+]C3)CC2)c1 ZINC000261805727 1119440013 /nfs/dbraw/zinc/44/00/13/1119440013.db2.gz HILPYIQCROMDPF-AWEZNQCLSA-N 1 3 292.854 3.519 20 0 CHADHO Cc1ccc([C@@H](C)CN2CC[C@H](C[NH+]3CCCC3)C2)cc1 ZINC000628182041 1119492794 /nfs/dbraw/zinc/49/27/94/1119492794.db2.gz AMJQGOUHZLBPTA-ZWKOTPCHSA-N 1 3 286.463 3.516 20 0 CHADHO C(C1CCCC1)N1CCC([NH2+][C@@H]2CCCC23CC3)CC1 ZINC000657859141 1119539950 /nfs/dbraw/zinc/53/99/50/1119539950.db2.gz QAEDYKARMWCRJH-QGZVFWFLSA-N 1 3 276.468 3.563 20 0 CHADHO CC1CCC([NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000089555220 1119542086 /nfs/dbraw/zinc/54/20/86/1119542086.db2.gz HRBWURZRRWEPIW-UHFFFAOYSA-N 1 3 278.484 3.952 20 0 CHADHO CC(C)CCC[C@H](C)[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000685455218 1119610957 /nfs/dbraw/zinc/61/09/57/1119610957.db2.gz KXMFLCVIAMZXSL-JKSUJKDBSA-N 1 3 254.462 3.521 20 0 CHADHO CCCc1ccc(C[N@@H+]2CCC[C@H]3CN(C)CC[C@H]32)cc1 ZINC000685470720 1119612364 /nfs/dbraw/zinc/61/23/64/1119612364.db2.gz LBZSUMNTSXDGKY-RBUKOAKNSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1ccc(C[N@H+]2CCC[C@H]3CN(C)CC[C@H]32)cc1 ZINC000685470720 1119612365 /nfs/dbraw/zinc/61/23/65/1119612365.db2.gz LBZSUMNTSXDGKY-RBUKOAKNSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1ccc(CN2CCC[C@H]3C[N@H+](C)CC[C@H]32)cc1 ZINC000685470720 1119612367 /nfs/dbraw/zinc/61/23/67/1119612367.db2.gz LBZSUMNTSXDGKY-RBUKOAKNSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1ccc(CN2CCC[C@H]3C[N@@H+](C)CC[C@H]32)cc1 ZINC000685470720 1119612369 /nfs/dbraw/zinc/61/23/69/1119612369.db2.gz LBZSUMNTSXDGKY-RBUKOAKNSA-N 1 3 286.463 3.555 20 0 CHADHO CC1(C)[C@H]2CCC[C@H]2[C@@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000657900658 1119620288 /nfs/dbraw/zinc/62/02/88/1119620288.db2.gz LNCCWQGMQKNAAD-SQNIBIBYSA-N 1 3 290.495 3.808 20 0 CHADHO Cc1ccc2oc(C[NH2+]C3CCN(C(C)C)CC3)cc2c1 ZINC000152037043 1119782556 /nfs/dbraw/zinc/78/25/56/1119782556.db2.gz HWBAMZRKOXWSER-UHFFFAOYSA-N 1 3 286.419 3.704 20 0 CHADHO C[C@H]1C[C@@H](NC2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)CS1 ZINC000414223174 1119946526 /nfs/dbraw/zinc/94/65/26/1119946526.db2.gz GDNDQSNKEYYJCU-WTTBNOFXSA-N 1 3 296.524 3.513 20 0 CHADHO C[C@H]1C[C@@H]([NH2+]C2CCN([C@H]3CCC[C@@H](C)C3)CC2)CS1 ZINC000414223174 1119946531 /nfs/dbraw/zinc/94/65/31/1119946531.db2.gz GDNDQSNKEYYJCU-WTTBNOFXSA-N 1 3 296.524 3.513 20 0 CHADHO CC(C)[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccccc1 ZINC000624121935 1120101163 /nfs/dbraw/zinc/10/11/63/1120101163.db2.gz GGPKTOFOVJGJQC-WMZOPIPTSA-N 1 3 274.452 3.705 20 0 CHADHO CC(C)C1CCC([NH2+][C@@H]2CCC[C@@H](N(C)C)C2)CC1 ZINC000715544786 1120110913 /nfs/dbraw/zinc/11/09/13/1120110913.db2.gz SHHIUQPJYRFDOR-BHUNQDJPSA-N 1 3 266.473 3.664 20 0 CHADHO CC(C)CC(CC(C)C)[NH2+][C@@H]1CCC[C@H](N(C)C)C1 ZINC000715543406 1120111116 /nfs/dbraw/zinc/11/11/16/1120111116.db2.gz NEQLVWYUUWIMBT-WBVHZDCISA-N 1 3 268.489 3.910 20 0 CHADHO C[NH+](C)CCC1CCN(Cc2ccc(Cl)cc2)CC1 ZINC000056522684 1120128305 /nfs/dbraw/zinc/12/83/05/1120128305.db2.gz GSHRLGDNXHRLDA-UHFFFAOYSA-N 1 3 280.843 3.504 20 0 CHADHO C[C@H](c1cccc(F)c1)[N@H+](C)CC[C@@H]1CCCCN1C ZINC000472774021 1120171627 /nfs/dbraw/zinc/17/16/27/1120171627.db2.gz RKJABCCTQNBIJL-PBHICJAKSA-N 1 3 278.415 3.693 20 0 CHADHO C[C@H](c1cccc(F)c1)[N@@H+](C)CC[C@@H]1CCCCN1C ZINC000472774021 1120171632 /nfs/dbraw/zinc/17/16/32/1120171632.db2.gz RKJABCCTQNBIJL-PBHICJAKSA-N 1 3 278.415 3.693 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@@H](C)[C@@H]2CC3CCC2CC3)C1 ZINC000394428742 1120217554 /nfs/dbraw/zinc/21/75/54/1120217554.db2.gz AUOIFVURPWVKFV-BSQPYMJMSA-N 1 3 278.484 3.521 20 0 CHADHO c1csc([C@@H](N[C@H]2CCC[NH2+]CC2)C2CCCC2)c1 ZINC000129085807 1120252607 /nfs/dbraw/zinc/25/26/07/1120252607.db2.gz AAUHJEGRQOQEBZ-HOCLYGCPSA-N 1 3 278.465 3.711 20 0 CHADHO Cc1cccc([C@H](C)N2CCC[C@H]([C@@H]3CCC[NH2+]3)C2)c1 ZINC000041088729 1120254686 /nfs/dbraw/zinc/25/46/86/1120254686.db2.gz TZYRBSXRNQDPBR-SZMVWBNQSA-N 1 3 272.436 3.520 20 0 CHADHO CC(C)(C)CCCN1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000499556132 1120321249 /nfs/dbraw/zinc/32/12/49/1120321249.db2.gz YQCJHSPDWMHBBZ-DOTOQJQBSA-N 1 3 278.484 3.761 20 0 CHADHO CC(C)(C)CCCN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000499556132 1120321255 /nfs/dbraw/zinc/32/12/55/1120321255.db2.gz YQCJHSPDWMHBBZ-DOTOQJQBSA-N 1 3 278.484 3.761 20 0 CHADHO CCC(F)(F)C(C)(C)C[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000629531509 1128913853 /nfs/dbraw/zinc/91/38/53/1128913853.db2.gz NMAVIALTSPUILB-LLVKDONJSA-N 1 3 299.409 3.571 20 0 CHADHO CCCCN1CCC([NH2+]Cc2cc3c(cccc3C)[nH]2)CC1 ZINC000657336379 1120438669 /nfs/dbraw/zinc/43/86/69/1120438669.db2.gz REYJYNKICAUVCV-UHFFFAOYSA-N 1 3 299.462 3.830 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CC[C@@]2(C1)CCCNC2 ZINC001222141287 1120493333 /nfs/dbraw/zinc/49/33/33/1120493333.db2.gz JPHFZMQOIUTUMP-ROUUACIJSA-N 1 3 278.484 3.835 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CC[C@@]2(C1)CCCNC2 ZINC001222141287 1120493337 /nfs/dbraw/zinc/49/33/37/1120493337.db2.gz JPHFZMQOIUTUMP-ROUUACIJSA-N 1 3 278.484 3.835 20 0 CHADHO C[N@H+](CCCN1CCCC1)[C@H]1CCCc2ccc(F)cc21 ZINC000499938084 1120555173 /nfs/dbraw/zinc/55/51/73/1120555173.db2.gz XAIUXWSBHQRMFS-SFHVURJKSA-N 1 3 290.426 3.621 20 0 CHADHO C[N@@H+](CCCN1CCCC1)[C@H]1CCCc2ccc(F)cc21 ZINC000499938084 1120555174 /nfs/dbraw/zinc/55/51/74/1120555174.db2.gz XAIUXWSBHQRMFS-SFHVURJKSA-N 1 3 290.426 3.621 20 0 CHADHO c1ccc([C@@H]2C[C@H]2C[NH2+][C@H]2CCNC[C@H]2C2CCCC2)cc1 ZINC000925677164 1120565588 /nfs/dbraw/zinc/56/55/88/1120565588.db2.gz OOIRIOUELURISR-MUGJNUQGSA-N 1 3 298.474 3.548 20 0 CHADHO CN(C)[C@@H]1CCC[N@H+](CC[C@@H]2CCc3ccccc32)CC1 ZINC000660416645 1120590571 /nfs/dbraw/zinc/59/05/71/1120590571.db2.gz VEYCAQBLNUBJAH-ZWKOTPCHSA-N 1 3 286.463 3.523 20 0 CHADHO CN(C)[C@@H]1CCC[N@@H+](CC[C@@H]2CCc3ccccc32)CC1 ZINC000660416645 1120590572 /nfs/dbraw/zinc/59/05/72/1120590572.db2.gz VEYCAQBLNUBJAH-ZWKOTPCHSA-N 1 3 286.463 3.523 20 0 CHADHO CCC(C)(C)c1ccc(C[N@@H+]2CC[C@H](CN(C)C)C2)cc1 ZINC000509023470 1120596880 /nfs/dbraw/zinc/59/68/80/1120596880.db2.gz WDIKCXQZRJUZBM-QGZVFWFLSA-N 1 3 288.479 3.758 20 0 CHADHO CCC(C)(C)c1ccc(C[N@H+]2CC[C@H](CN(C)C)C2)cc1 ZINC000509023470 1120596884 /nfs/dbraw/zinc/59/68/84/1120596884.db2.gz WDIKCXQZRJUZBM-QGZVFWFLSA-N 1 3 288.479 3.758 20 0 CHADHO Cc1cc(C)c(CN2CCC[C@@]3(CCC[NH2+]C3)C2)c(C)c1 ZINC000228081378 1120761831 /nfs/dbraw/zinc/76/18/31/1120761831.db2.gz NQCFDCDLFOCIMX-LJQANCHMSA-N 1 3 286.463 3.577 20 0 CHADHO CCCCN1CCC([NH2+]Cc2ccccc2C2CC2)CC1 ZINC000094357825 1120864846 /nfs/dbraw/zinc/86/48/46/1120864846.db2.gz JLSPRGOEBQSFQP-UHFFFAOYSA-N 1 3 286.463 3.918 20 0 CHADHO C[NH2+]C[C@@H]1CCCN([C@H](C)c2c(C)cc(C)cc2C)C1 ZINC000251016873 1120883174 /nfs/dbraw/zinc/88/31/74/1120883174.db2.gz HGZNRVQOEGSORY-SJORKVTESA-N 1 3 274.452 3.604 20 0 CHADHO CC(C)c1cccc(CNC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC000663319299 1120925519 /nfs/dbraw/zinc/92/55/19/1120925519.db2.gz QPFIKVZZVBIKTA-YQQQUEKLSA-N 1 3 286.463 3.915 20 0 CHADHO CC(C)c1cccc(CNC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC000663319299 1120925522 /nfs/dbraw/zinc/92/55/22/1120925522.db2.gz QPFIKVZZVBIKTA-YQQQUEKLSA-N 1 3 286.463 3.915 20 0 CHADHO CCC[C@H](N[C@@H]1CCC[NH2+]CC1)c1ccc(Cl)cc1 ZINC000643467037 1120996206 /nfs/dbraw/zinc/99/62/06/1120996206.db2.gz QCUWROCOGDXYPY-CVEARBPZSA-N 1 3 280.843 3.913 20 0 CHADHO c1ccc2c(c1)sc1c2cccc1C[N@@H+]1CCCNCC1 ZINC001204667377 1120998438 /nfs/dbraw/zinc/99/84/38/1120998438.db2.gz JUOPCICTUSOOTE-UHFFFAOYSA-N 1 3 296.439 3.850 20 0 CHADHO c1ccc2c(c1)sc1c2cccc1C[N@H+]1CCCNCC1 ZINC001204667377 1120998439 /nfs/dbraw/zinc/99/84/39/1120998439.db2.gz JUOPCICTUSOOTE-UHFFFAOYSA-N 1 3 296.439 3.850 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]C[C@@H]1CCCCN1 ZINC000643502892 1121002364 /nfs/dbraw/zinc/00/23/64/1121002364.db2.gz UPUUHESNMOZFKX-KSSFIOAISA-N 1 3 297.446 3.585 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCCc3ccc(F)cc32)C1 ZINC000344077336 1121074877 /nfs/dbraw/zinc/07/48/77/1121074877.db2.gz QHLNETKUEWSJDH-JZXOWHBKSA-N 1 3 290.426 3.666 20 0 CHADHO Fc1ccc2c(c1)[C@H]([NH2+]CCCN1CCCCC1)CCC2 ZINC000344107923 1121084401 /nfs/dbraw/zinc/08/44/01/1121084401.db2.gz XGBNZBLAFLXFIU-GOSISDBHSA-N 1 3 290.426 3.669 20 0 CHADHO C/C(=C\c1ccccc1)C[NH2+]CCCN1CCCCC1 ZINC000141071506 1121136408 /nfs/dbraw/zinc/13/64/08/1121136408.db2.gz ZGJZBCWEFYQPRT-BMRADRMJSA-N 1 3 272.436 3.556 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)c2sc(C(C)C)nc2C)C1 ZINC000163233984 1121177078 /nfs/dbraw/zinc/17/70/78/1121177078.db2.gz HGLRBDIOBWQSAX-GXTWGEPZSA-N 1 3 295.496 3.567 20 0 CHADHO C[C@H](c1ccccc1Cl)N1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000063197608 1121201330 /nfs/dbraw/zinc/20/13/30/1121201330.db2.gz GLJYLCZJPXCCGI-CXAGYDPISA-N 1 3 292.854 3.865 20 0 CHADHO c1ccc(C[N@@H+]2CC[C@@]3(CCN([C@H]4C=CCCC4)C3)C2)cc1 ZINC000512245952 1121224691 /nfs/dbraw/zinc/22/46/91/1121224691.db2.gz UDSZPGWSHSKQRB-VQTJNVASSA-N 1 3 296.458 3.693 20 0 CHADHO c1ccc(C[N@H+]2CC[C@@]3(CCN([C@H]4C=CCCC4)C3)C2)cc1 ZINC000512245952 1121224694 /nfs/dbraw/zinc/22/46/94/1121224694.db2.gz UDSZPGWSHSKQRB-VQTJNVASSA-N 1 3 296.458 3.693 20 0 CHADHO Cc1cccc2c1CCC[C@H]2NC1CC[NH+](C(C)C)CC1 ZINC000658336316 1121312844 /nfs/dbraw/zinc/31/28/44/1121312844.db2.gz ACNQSPORIQSUIN-LJQANCHMSA-N 1 3 286.463 3.835 20 0 CHADHO C[C@@H]1CCCCC[C@@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000675906476 1121386374 /nfs/dbraw/zinc/38/63/74/1121386374.db2.gz WYJZHNIYXFCKCL-QAPCUYQASA-N 1 3 278.484 3.952 20 0 CHADHO CCC[C@H](C)CCCN1CCC(C)([NH+]2CCC2)CC1 ZINC001175668562 1121428712 /nfs/dbraw/zinc/42/87/12/1121428712.db2.gz CIIMEPAODVLNJY-INIZCTEOSA-N 1 3 266.473 3.763 20 0 CHADHO C[C@@H](CC[NH+](C)C)N[C@H]1CCCc2c(Cl)cccc21 ZINC000543599596 1121509275 /nfs/dbraw/zinc/50/92/75/1121509275.db2.gz CFSSWHYVMSPDHN-LRDDRELGSA-N 1 3 280.843 3.647 20 0 CHADHO CCC1([NH+](C)C)CCN(c2ccnc3ccccc32)CC1 ZINC000631477497 1129003598 /nfs/dbraw/zinc/00/35/98/1129003598.db2.gz FQPOLNRCAQHQOM-UHFFFAOYSA-N 1 3 283.419 3.545 20 0 CHADHO CCC[NH+]1CCC(CNCc2cc(Cl)ccc2F)CC1 ZINC001177737061 1121747190 /nfs/dbraw/zinc/74/71/90/1121747190.db2.gz JCFSNRORHXMHCX-UHFFFAOYSA-N 1 3 298.833 3.691 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(C3CC3)cc2)[C@H](C)C1 ZINC001179906653 1121930317 /nfs/dbraw/zinc/93/03/17/1121930317.db2.gz ZLGOKHIDONMNLM-DNVCBOLYSA-N 1 3 286.463 3.726 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2ccc(C3CC3)cc2)[C@H](C)C1 ZINC001179906653 1121930323 /nfs/dbraw/zinc/93/03/23/1121930323.db2.gz ZLGOKHIDONMNLM-DNVCBOLYSA-N 1 3 286.463 3.726 20 0 CHADHO CCN(CC)C[C@H]1CC[N@H+](C[C@@H]2CCCC(C)(C)C2)C1 ZINC001180058435 1121943515 /nfs/dbraw/zinc/94/35/15/1121943515.db2.gz RACNMFAEOHRJDP-IAGOWNOFSA-N 1 3 280.500 3.867 20 0 CHADHO CCN(CC)C[C@H]1CC[N@@H+](C[C@@H]2CCCC(C)(C)C2)C1 ZINC001180058435 1121943518 /nfs/dbraw/zinc/94/35/18/1121943518.db2.gz RACNMFAEOHRJDP-IAGOWNOFSA-N 1 3 280.500 3.867 20 0 CHADHO CC(C)[NH+]1CCC(N(C)CCSC2CCCCC2)CC1 ZINC000501104174 1121954813 /nfs/dbraw/zinc/95/48/13/1121954813.db2.gz ZIXPRKMOIZMMCE-UHFFFAOYSA-N 1 3 298.540 3.857 20 0 CHADHO CC1(C)CNCC[C@H]1[NH2+]CCCc1cccc2ccccc21 ZINC000420366058 1122001278 /nfs/dbraw/zinc/00/12/78/1122001278.db2.gz QUPUWRCTMVQMDW-LJQANCHMSA-N 1 3 296.458 3.750 20 0 CHADHO C[C@@H](N)C[NH2+][C@H](c1cccc(Cl)c1)C1CCCC1 ZINC000420422761 1122006292 /nfs/dbraw/zinc/00/62/92/1122006292.db2.gz ZNVXOJFWPPEIIX-ABAIWWIYSA-N 1 3 266.816 3.508 20 0 CHADHO C[C@H](NCC[C@H]1CCC[NH2+]C1)c1c(F)cccc1Cl ZINC000420404239 1122006924 /nfs/dbraw/zinc/00/69/24/1122006924.db2.gz MAYLUMCVZCLTOX-NWDGAFQWSA-N 1 3 284.806 3.519 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H](C)c1csc2ccccc12 ZINC000817898119 1122109341 /nfs/dbraw/zinc/10/93/41/1122109341.db2.gz CYUKMSWKYSNANE-QJPTWQEYSA-N 1 3 262.422 3.678 20 0 CHADHO CN1CCC[C@H]1CC[N@@H+]1CCCC[C@@H]1c1ccc(F)cc1 ZINC000502924503 1122158054 /nfs/dbraw/zinc/15/80/54/1122158054.db2.gz DSNIMYPYHQKBMV-ZWKOTPCHSA-N 1 3 290.426 3.837 20 0 CHADHO CN1CCC[C@H]1CC[N@H+]1CCCC[C@@H]1c1ccc(F)cc1 ZINC000502924503 1122158055 /nfs/dbraw/zinc/15/80/55/1122158055.db2.gz DSNIMYPYHQKBMV-ZWKOTPCHSA-N 1 3 290.426 3.837 20 0 CHADHO CN1CCC[C@@H]1CC[N@@H+]1CCCC[C@@H]1c1ccc(F)cc1 ZINC000502924501 1122158362 /nfs/dbraw/zinc/15/83/62/1122158362.db2.gz DSNIMYPYHQKBMV-QZTJIDSGSA-N 1 3 290.426 3.837 20 0 CHADHO CN1CCC[C@@H]1CC[N@H+]1CCCC[C@@H]1c1ccc(F)cc1 ZINC000502924501 1122158365 /nfs/dbraw/zinc/15/83/65/1122158365.db2.gz DSNIMYPYHQKBMV-QZTJIDSGSA-N 1 3 290.426 3.837 20 0 CHADHO CCC[C@@H](CCc1ccccc1)[NH2+]CC[C@H](C)N(C)C ZINC001183105148 1122206838 /nfs/dbraw/zinc/20/68/38/1122206838.db2.gz ZEPIVJITDKOWFR-WMZOPIPTSA-N 1 3 276.468 3.718 20 0 CHADHO C[C@]1([NH3+])CCCN(Cc2cccc3c(F)cccc23)CC1 ZINC001205288671 1122251524 /nfs/dbraw/zinc/25/15/24/1122251524.db2.gz NGXQORWDRQBSJF-SFHVURJKSA-N 1 3 286.394 3.682 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CC[C@H](C)[C@H](CN)C1 ZINC001205295749 1122272906 /nfs/dbraw/zinc/27/29/06/1122272906.db2.gz BOAJNTJZHARPFS-PPPANMTLSA-N 1 3 266.473 3.820 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CC[C@H](C)[C@H](CN)C1 ZINC001205295749 1122272910 /nfs/dbraw/zinc/27/29/10/1122272910.db2.gz BOAJNTJZHARPFS-PPPANMTLSA-N 1 3 266.473 3.820 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H](C)[C@@H](C)c1ccc(OC)cc1 ZINC000514248431 1122391889 /nfs/dbraw/zinc/39/18/89/1122391889.db2.gz QBJCWUDJLFRWHA-CVEARBPZSA-N 1 3 292.467 3.509 20 0 CHADHO CCN(Cc1cc2cc(F)ccc2o1)[C@H]1CCC[NH2+]CC1 ZINC000435379358 1122461558 /nfs/dbraw/zinc/46/15/58/1122461558.db2.gz BOYKOSKKFQXVBI-HNNXBMFYSA-N 1 3 290.382 3.536 20 0 CHADHO C[C@H](C[NH2+][C@H](C)[C@@H](C)c1ccc(Cl)cc1)CN(C)C ZINC000425938112 1122668936 /nfs/dbraw/zinc/66/89/36/1122668936.db2.gz VTLGQPCNAVCFJA-MGPQQGTHSA-N 1 3 282.859 3.619 20 0 CHADHO CN(CCC[NH+]1CCCC1)CC[C@H]1CCc2ccccc21 ZINC001193850225 1122724682 /nfs/dbraw/zinc/72/46/82/1122724682.db2.gz VZMDJNKLTKFFDQ-GOSISDBHSA-N 1 3 286.463 3.524 20 0 CHADHO Cc1cc([C@@H](C)[NH2+]C2CCN(CC(C)C)CC2)cs1 ZINC000295839186 1122757804 /nfs/dbraw/zinc/75/78/04/1122757804.db2.gz FNAAUUVZLJWKCP-CQSZACIVSA-N 1 3 280.481 3.828 20 0 CHADHO C[C@H]1CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001167967475 1122846865 /nfs/dbraw/zinc/84/68/65/1122846865.db2.gz FDVRBXPPNPYXMM-MHDJUUOISA-N 1 3 276.468 3.560 20 0 CHADHO CC(C)C[C@@H](C)CN1CCC(C)([NH+]2CCCC2)CC1 ZINC001196684934 1122931027 /nfs/dbraw/zinc/93/10/27/1122931027.db2.gz QKXPBSSMDTXCGJ-MRXNPFEDSA-N 1 3 266.473 3.619 20 0 CHADHO CC[C@@H]([NH2+]CC[C@H]1CCCN1C)c1cc(C)ccc1C ZINC001196944219 1122940937 /nfs/dbraw/zinc/94/09/37/1122940937.db2.gz UHOSXHKWNRHMFV-SJLPKXTDSA-N 1 3 274.452 3.828 20 0 CHADHO CC[C@@H](NCC[C@H]1CCC[N@@H+]1C)c1cc(C)ccc1C ZINC001196944219 1122940940 /nfs/dbraw/zinc/94/09/40/1122940940.db2.gz UHOSXHKWNRHMFV-SJLPKXTDSA-N 1 3 274.452 3.828 20 0 CHADHO CC[C@@H](NCC[C@H]1CCC[N@H+]1C)c1cc(C)ccc1C ZINC001196944219 1122940941 /nfs/dbraw/zinc/94/09/41/1122940941.db2.gz UHOSXHKWNRHMFV-SJLPKXTDSA-N 1 3 274.452 3.828 20 0 CHADHO C[C@H]1[C@@H](C[NH3+])CCCN1Cc1ccc(C2CCC2)cc1 ZINC001205915231 1123082731 /nfs/dbraw/zinc/08/27/31/1123082731.db2.gz OXIFHRMDRZMHKQ-KBXCAEBGSA-N 1 3 272.436 3.513 20 0 CHADHO CCC(CC)[N@H+](CC)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167994483 1123104248 /nfs/dbraw/zinc/10/42/48/1123104248.db2.gz GELZXNOCVVVEFV-JWTNVVGKSA-N 1 3 278.484 3.902 20 0 CHADHO CCC(CC)[N@@H+](CC)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167994483 1123104249 /nfs/dbraw/zinc/10/42/49/1123104249.db2.gz GELZXNOCVVVEFV-JWTNVVGKSA-N 1 3 278.484 3.902 20 0 CHADHO C[N@H+](Cc1ccc(F)cc1)C1CCN(CC(C)(C)C)CC1 ZINC001201441505 1123104948 /nfs/dbraw/zinc/10/49/48/1123104948.db2.gz GZABOBZMNLYPLL-UHFFFAOYSA-N 1 3 292.442 3.768 20 0 CHADHO C[N@@H+](Cc1ccc(F)cc1)C1CCN(CC(C)(C)C)CC1 ZINC001201441505 1123104951 /nfs/dbraw/zinc/10/49/51/1123104951.db2.gz GZABOBZMNLYPLL-UHFFFAOYSA-N 1 3 292.442 3.768 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+][C@H]2CCCC(C)(C)C2)C1 ZINC001201557505 1123123202 /nfs/dbraw/zinc/12/32/02/1123123202.db2.gz KHNBAQJSPPJCMV-SJORKVTESA-N 1 3 280.500 3.913 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H]2CCc3ccc(F)cc32)C1 ZINC000246922454 1123139991 /nfs/dbraw/zinc/13/99/91/1123139991.db2.gz GNRAGLSMTBIWCM-KDOFPFPSSA-N 1 3 290.426 3.523 20 0 CHADHO Cc1sc2ccccc2c1C[N@@H+]1CCCC[C@H](N)C1 ZINC001205933112 1123173672 /nfs/dbraw/zinc/17/36/72/1123173672.db2.gz YJBKCQKPUCFCEW-ZDUSSCGKSA-N 1 3 274.433 3.523 20 0 CHADHO Cc1sc2ccccc2c1C[N@H+]1CCCC[C@H](N)C1 ZINC001205933112 1123173673 /nfs/dbraw/zinc/17/36/73/1123173673.db2.gz YJBKCQKPUCFCEW-ZDUSSCGKSA-N 1 3 274.433 3.523 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](NCc2ccc(-c3cccs3)cc2)C1 ZINC000665238511 1123241377 /nfs/dbraw/zinc/24/13/77/1123241377.db2.gz ZXEUCOLERXXIMY-CVEARBPZSA-N 1 3 286.444 3.775 20 0 CHADHO C[C@H]([NH2+]CC1(N)CCCC1)c1cc2c(s1)CCCC2 ZINC000665247583 1123255644 /nfs/dbraw/zinc/25/56/44/1123255644.db2.gz FQLACPYMXZHRNV-LBPRGKRZSA-N 1 3 278.465 3.549 20 0 CHADHO CC(C)CC[C@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1ccoc1 ZINC000428217988 1123283111 /nfs/dbraw/zinc/28/31/11/1123283111.db2.gz IQAQTHDFKNRVIJ-QAPCUYQASA-N 1 3 290.451 3.831 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)C1CCC(F)(F)CC1)CN1CCCC1 ZINC000474033086 1123312621 /nfs/dbraw/zinc/31/26/21/1123312621.db2.gz KTHVNFHJHBLANH-KBPBESRZSA-N 1 3 288.426 3.522 20 0 CHADHO C[C@H]1CC([NH2+]CCCN2CCCC[C@H]2C)C[C@H](C)C1 ZINC000252114851 1123412900 /nfs/dbraw/zinc/41/29/00/1123412900.db2.gz IISPYOIGOZHJRR-BZUAXINKSA-N 1 3 266.473 3.665 20 0 CHADHO C[N@H+]1CC=C(CNC(c2ccccc2)c2ccccc2)CC1 ZINC000272657614 1129120087 /nfs/dbraw/zinc/12/00/87/1129120087.db2.gz QXBWMPOYPODWID-UHFFFAOYSA-N 1 3 292.426 3.628 20 0 CHADHO C[N@@H+]1CC=C(CNC(c2ccccc2)c2ccccc2)CC1 ZINC000272657614 1129120090 /nfs/dbraw/zinc/12/00/90/1129120090.db2.gz QXBWMPOYPODWID-UHFFFAOYSA-N 1 3 292.426 3.628 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@@H](C)C1CCC(F)(F)CC1 ZINC000353241782 1123443023 /nfs/dbraw/zinc/44/30/23/1123443023.db2.gz GKQYGOPEDFKCMZ-ZDUSSCGKSA-N 1 3 276.415 3.520 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1C[N@@H+]1CC[C@H](CN(C)CC2CC2)C1 ZINC000443641868 1123456038 /nfs/dbraw/zinc/45/60/38/1123456038.db2.gz MRBLKZGEDCDJHB-UHOSZYNNSA-N 1 3 290.495 3.643 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1C[N@H+]1CC[C@H](CN(C)CC2CC2)C1 ZINC000443641868 1123456041 /nfs/dbraw/zinc/45/60/41/1123456041.db2.gz MRBLKZGEDCDJHB-UHOSZYNNSA-N 1 3 290.495 3.643 20 0 CHADHO CC(C)C[C@H](C[NH+]1CCC(N(C)C)CC1)c1ccccc1 ZINC000474154039 1123473358 /nfs/dbraw/zinc/47/33/58/1123473358.db2.gz POTPZEWRUBGTRN-GOSISDBHSA-N 1 3 288.479 3.842 20 0 CHADHO CC(C)C[C@H](CN1CCC([NH+](C)C)CC1)c1ccccc1 ZINC000474154039 1123473360 /nfs/dbraw/zinc/47/33/60/1123473360.db2.gz POTPZEWRUBGTRN-GOSISDBHSA-N 1 3 288.479 3.842 20 0 CHADHO C[C@H](c1cccc2ccccc21)N1CC[C@]2(CC[NH2+]C2)C1 ZINC000313870175 1129129735 /nfs/dbraw/zinc/12/97/35/1129129735.db2.gz QSRIHCMKEZARSW-BEFAXECRSA-N 1 3 280.415 3.586 20 0 CHADHO C[C@H]([NH3+])[C@H]1CCN(Cc2cc(-c3ccccc3)cs2)C1 ZINC000346650555 1123701444 /nfs/dbraw/zinc/70/14/44/1123701444.db2.gz PQBKCOCVGWCLMW-ZFWWWQNUSA-N 1 3 286.444 3.584 20 0 CHADHO CC1(C)CCCC[C@H]1C[N@@H+]1CC[C@@H](CN2CCCC2)C1 ZINC001307483646 1123725458 /nfs/dbraw/zinc/72/54/58/1123725458.db2.gz SGUTXZKRALZLPQ-IRXDYDNUSA-N 1 3 278.484 3.621 20 0 CHADHO CC1(C)CCCC[C@H]1C[N@H+]1CC[C@@H](CN2CCCC2)C1 ZINC001307483646 1123725460 /nfs/dbraw/zinc/72/54/60/1123725460.db2.gz SGUTXZKRALZLPQ-IRXDYDNUSA-N 1 3 278.484 3.621 20 0 CHADHO Cc1ccc([C@H]2CCCCN2C[C@H]2CCC[NH2+]C2)cc1 ZINC000346982106 1123739045 /nfs/dbraw/zinc/73/90/45/1123739045.db2.gz MYSKPAHGRGJSRA-FUHWJXTLSA-N 1 3 272.436 3.522 20 0 CHADHO C[C@@H]1C[C@@H](C[NH3+])CN1Cc1cc(-c2ccccc2)cs1 ZINC000469860035 1123757725 /nfs/dbraw/zinc/75/77/25/1123757725.db2.gz DRITXTWZOYNUOG-KGLIPLIRSA-N 1 3 286.444 3.584 20 0 CHADHO CN1CCC[C@@H](C[N@H+](C)C/C=C/c2ccc(Cl)cc2)C1 ZINC000508568628 1124115710 /nfs/dbraw/zinc/11/57/10/1124115710.db2.gz KWFHHMHNTFYKSM-WMHVBEDNSA-N 1 3 292.854 3.627 20 0 CHADHO CN1CCC[C@@H](C[N@@H+](C)C/C=C/c2ccc(Cl)cc2)C1 ZINC000508568628 1124115711 /nfs/dbraw/zinc/11/57/11/1124115711.db2.gz KWFHHMHNTFYKSM-WMHVBEDNSA-N 1 3 292.854 3.627 20 0 CHADHO C[C@@H](C[NH2+]CC[C@H](C)N1CCCCC1)c1ccccc1 ZINC000446759676 1124121980 /nfs/dbraw/zinc/12/19/80/1124121980.db2.gz PVPNZRNMFKWRMZ-IRXDYDNUSA-N 1 3 274.452 3.644 20 0 CHADHO CCC[NH+]1CCC(CN[C@H](C)c2cccnc2Cl)CC1 ZINC000122695353 1124524033 /nfs/dbraw/zinc/52/40/33/1124524033.db2.gz RIXJQBHPQYYLJW-CYBMUJFWSA-N 1 3 295.858 3.508 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2cccc3ccoc32)C[C@H]1C ZINC000449033236 1124636313 /nfs/dbraw/zinc/63/63/13/1124636313.db2.gz ZEIGBMOSWUASOA-PBHICJAKSA-N 1 3 286.419 3.737 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2cccc3ccoc32)C[C@H]1C ZINC000449033236 1124636317 /nfs/dbraw/zinc/63/63/17/1124636317.db2.gz ZEIGBMOSWUASOA-PBHICJAKSA-N 1 3 286.419 3.737 20 0 CHADHO CO[C@@H](C)CCNC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449114300 1124654422 /nfs/dbraw/zinc/65/44/22/1124654422.db2.gz ZCUOUWGYKCMTJD-HNNXBMFYSA-N 1 3 298.515 3.680 20 0 CHADHO CC[C@H](CCC(F)(F)F)[NH2+][C@H]1CCC[C@@H](N(C)C)C1 ZINC000872041583 1124664682 /nfs/dbraw/zinc/66/46/82/1124664682.db2.gz UPYOHMHIBMQPIZ-FRRDWIJNSA-N 1 3 280.378 3.570 20 0 CHADHO CSCC1CCC([NH2+]CC(C)(C)CN2CCCC2)CC1 ZINC000449280911 1124682648 /nfs/dbraw/zinc/68/26/48/1124682648.db2.gz BGZKSQROOOJBMX-UHFFFAOYSA-N 1 3 298.540 3.620 20 0 CHADHO CC(F)(F)CCC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000449351331 1124698293 /nfs/dbraw/zinc/69/82/93/1124698293.db2.gz OFZMGCGLBMHSCI-UHFFFAOYSA-N 1 3 288.426 3.809 20 0 CHADHO CC(C)(C)N1CCC([NH2+]C[C@H]2CCCCC2(F)F)CC1 ZINC000449372950 1124704739 /nfs/dbraw/zinc/70/47/39/1124704739.db2.gz AVAKASQPRUVWKJ-CYBMUJFWSA-N 1 3 288.426 3.664 20 0 CHADHO Cc1cc(F)ccc1[C@H](C)NCc1cccc2c1CC[NH2+]C2 ZINC000873235547 1124753189 /nfs/dbraw/zinc/75/31/89/1124753189.db2.gz OGCCYPUQRASTCJ-AWEZNQCLSA-N 1 3 298.405 3.631 20 0 CHADHO C1C([NH2+]C2CCN(C3CCCC3)CC2)CC12CCCC2 ZINC000925222915 1124879150 /nfs/dbraw/zinc/87/91/50/1124879150.db2.gz XRQVRSYIGCOGND-UHFFFAOYSA-N 1 3 276.468 3.706 20 0 CHADHO CSC(C)(C)CC[NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000877188814 1125019431 /nfs/dbraw/zinc/01/94/31/1125019431.db2.gz HIWLLFQYFDOOBP-LSDHHAIUSA-N 1 3 298.540 3.761 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN(CC/C=C\c2ccccc2)C1 ZINC000450463263 1125028847 /nfs/dbraw/zinc/02/88/47/1125028847.db2.gz NMFGZFIUFNKKET-ABMFHFBKSA-N 1 3 286.463 3.754 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN(CC/C=C\c2ccccc2)C1 ZINC000450463263 1125028855 /nfs/dbraw/zinc/02/88/55/1125028855.db2.gz NMFGZFIUFNKKET-ABMFHFBKSA-N 1 3 286.463 3.754 20 0 CHADHO c1ccc([C@@H]2CCCC[C@H]2[NH2+][C@@H]2CCNC23CCC3)cc1 ZINC000530177152 1125129670 /nfs/dbraw/zinc/12/96/70/1125129670.db2.gz HRUPILPMQWZXIQ-RCCFBDPRSA-N 1 3 284.447 3.587 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)NC[C@]1(F)CCCC[NH2+]C1 ZINC001246116182 1131336520 /nfs/dbraw/zinc/33/65/20/1131336520.db2.gz VKYCQWUEVDUCIL-JYJNAYRXSA-N 1 3 272.452 3.519 20 0 CHADHO CN1CCC2(CCC[N@@H+]2C[C@H]2CCCC(C)(C)C2)CC1 ZINC000530442763 1125154117 /nfs/dbraw/zinc/15/41/17/1125154117.db2.gz KXHVFZIBVKLXHX-INIZCTEOSA-N 1 3 278.484 3.763 20 0 CHADHO CN1CCC2(CCC[N@H+]2C[C@H]2CCCC(C)(C)C2)CC1 ZINC000530442763 1125154120 /nfs/dbraw/zinc/15/41/20/1125154120.db2.gz KXHVFZIBVKLXHX-INIZCTEOSA-N 1 3 278.484 3.763 20 0 CHADHO CCc1ccc(CNCCCC[NH+]2C[C@@H](C)C[C@H](C)C2)o1 ZINC000532112803 1125235985 /nfs/dbraw/zinc/23/59/85/1125235985.db2.gz PXVCNTPOEFDRHL-HOTGVXAUSA-N 1 3 292.467 3.690 20 0 CHADHO C[NH2+]C[C@H]1CCCN([C@H](C)c2cccc3ccccc32)C1 ZINC000040592194 1125388828 /nfs/dbraw/zinc/38/88/28/1125388828.db2.gz ZZFPDOUWXUFXDS-HZPDHXFCSA-N 1 3 282.431 3.832 20 0 CHADHO Cc1cccc([C@H]2CCCN2CC[C@H]2CCCC[NH2+]2)c1 ZINC001204849231 1125433013 /nfs/dbraw/zinc/43/30/13/1125433013.db2.gz ZAXJDYUCZQGDQI-QZTJIDSGSA-N 1 3 272.436 3.664 20 0 CHADHO CN1CCC[C@H]1CC[N@H+](Cc1ccco1)C1CCCC1 ZINC000124960839 1125444103 /nfs/dbraw/zinc/44/41/03/1125444103.db2.gz CDURGFBFIPBPSN-HNNXBMFYSA-N 1 3 276.424 3.509 20 0 CHADHO CN1CCC[C@H]1CC[N@@H+](Cc1ccco1)C1CCCC1 ZINC000124960839 1125444104 /nfs/dbraw/zinc/44/41/04/1125444104.db2.gz CDURGFBFIPBPSN-HNNXBMFYSA-N 1 3 276.424 3.509 20 0 CHADHO CC[C@@H](NC[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1 ZINC000125782945 1125452081 /nfs/dbraw/zinc/45/20/81/1125452081.db2.gz NYISISIFOCYTHP-FUHWJXTLSA-N 1 3 274.452 3.848 20 0 CHADHO CC[C@@H](NC[C@@H]1CCC[N@H+](C(C)C)C1)c1ccccc1 ZINC000125782945 1125452086 /nfs/dbraw/zinc/45/20/86/1125452086.db2.gz NYISISIFOCYTHP-FUHWJXTLSA-N 1 3 274.452 3.848 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)c1ccccc1 ZINC000125782945 1125452092 /nfs/dbraw/zinc/45/20/92/1125452092.db2.gz NYISISIFOCYTHP-FUHWJXTLSA-N 1 3 274.452 3.848 20 0 CHADHO CCCCC(CCCC)[NH+]1CCC2(CN(C)C2)CC1 ZINC001258388723 1129320107 /nfs/dbraw/zinc/32/01/07/1129320107.db2.gz KEVSGKJDGNUKFQ-UHFFFAOYSA-N 1 3 266.473 3.763 20 0 CHADHO CC[C@@H]1C[C@@H]([NH2+]C2CCC(C(C)(C)C)CC2)CCN1 ZINC001246169598 1131369362 /nfs/dbraw/zinc/36/93/62/1131369362.db2.gz CXNSNPSKQIEHJV-KNIAUWFNSA-N 1 3 266.473 3.712 20 0 CHADHO CC[C@@H]([NH2+][C@@H](C)c1ccc(CN)nc1C)C1CCCCC1 ZINC000643462354 1129442303 /nfs/dbraw/zinc/44/23/03/1129442303.db2.gz FBELGJNWJQDOSE-KBXCAEBGSA-N 1 3 289.467 3.858 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CCCCc1ccccc1 ZINC000643458315 1129442415 /nfs/dbraw/zinc/44/24/15/1129442415.db2.gz IUTOGDSVDXEMNM-HNNXBMFYSA-N 1 3 297.446 3.522 20 0 CHADHO CC(C)C[C@@H]1CCC[C@@H]([NH2+][C@H]2CCNC3(CCC3)C2)C1 ZINC000643548671 1129445864 /nfs/dbraw/zinc/44/58/64/1129445864.db2.gz SXQKHRHQLYSTLQ-BBWFWOEESA-N 1 3 278.484 3.856 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H]2CC[C@@H]3CCCC[C@H]3C2)C1 ZINC000250520308 1129483075 /nfs/dbraw/zinc/48/30/75/1129483075.db2.gz SLSWYLUJORKMEP-VSZNYVQBSA-N 1 3 278.484 3.665 20 0 CHADHO Clc1ccc(C2(NC[C@H]3CC[NH2+]C3)CCCCC2)cc1 ZINC000647892213 1129587459 /nfs/dbraw/zinc/58/74/59/1129587459.db2.gz CRJAUUOHCVWZIM-AWEZNQCLSA-N 1 3 292.854 3.699 20 0 CHADHO C(C1CCCCC1)N1CCC([NH2+][C@H]2CC[C@@H]2C2CC2)CC1 ZINC000798005395 1129674314 /nfs/dbraw/zinc/67/43/14/1129674314.db2.gz VBFKGAIWVUZJMU-MOPGFXCFSA-N 1 3 290.495 3.809 20 0 CHADHO CCC[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccs1 ZINC001169096069 1129696834 /nfs/dbraw/zinc/69/68/34/1129696834.db2.gz UJPJZIHJCKCRPY-XGUBFFRZSA-N 1 3 278.465 3.804 20 0 CHADHO CCC[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccs1 ZINC001169096069 1129696836 /nfs/dbraw/zinc/69/68/36/1129696836.db2.gz UJPJZIHJCKCRPY-XGUBFFRZSA-N 1 3 278.465 3.804 20 0 CHADHO CC(C)[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001169100728 1129697811 /nfs/dbraw/zinc/69/78/11/1129697811.db2.gz MAMULAUWASPGRH-ZJPYXAASSA-N 1 3 290.426 3.738 20 0 CHADHO CC(C)[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001169100728 1129697814 /nfs/dbraw/zinc/69/78/14/1129697814.db2.gz MAMULAUWASPGRH-ZJPYXAASSA-N 1 3 290.426 3.738 20 0 CHADHO CC[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)N2C)c1ccc(F)c(F)c1 ZINC001169119102 1129700569 /nfs/dbraw/zinc/70/05/69/1129700569.db2.gz QMYCEIDMQXWSRU-VWPFQQQWSA-N 1 3 294.389 3.631 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@H](N[C@@H]1CCCCc3ccccc31)C2 ZINC001169122764 1129700676 /nfs/dbraw/zinc/70/06/76/1129700676.db2.gz CZSXDYNMWXVQAT-VXIBKDFQSA-N 1 3 284.447 3.669 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](N[C@@H]1CCCCc3ccccc31)C2 ZINC001169122764 1129700678 /nfs/dbraw/zinc/70/06/78/1129700678.db2.gz CZSXDYNMWXVQAT-VXIBKDFQSA-N 1 3 284.447 3.669 20 0 CHADHO CCN(Cc1ccc(Cl)cc1)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169145221 1129704757 /nfs/dbraw/zinc/70/47/57/1129704757.db2.gz MAIJKHRSKGBBMH-FVQHAEBGSA-N 1 3 292.854 3.787 20 0 CHADHO CCN(Cc1ccc(Cl)cc1)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169145221 1129704759 /nfs/dbraw/zinc/70/47/59/1129704759.db2.gz MAIJKHRSKGBBMH-FVQHAEBGSA-N 1 3 292.854 3.787 20 0 CHADHO CCC[C@H](NC1CC[NH+](CC)CC1)c1cccc(F)c1 ZINC001169229596 1129710286 /nfs/dbraw/zinc/71/02/86/1129710286.db2.gz DDJHNMAIYVIPND-KRWDZBQOSA-N 1 3 278.415 3.741 20 0 CHADHO CC(C)[C@@H](NCc1ccc(C[NH3+])cc1F)c1ccccc1 ZINC000650753643 1129721221 /nfs/dbraw/zinc/72/12/21/1129721221.db2.gz RZGRIBOEDZJEJW-GOSISDBHSA-N 1 3 286.394 3.771 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H]2CCCCC[C@H]2C)C1 ZINC000651706117 1129745037 /nfs/dbraw/zinc/74/50/37/1129745037.db2.gz TUBYIHJEDTZSGA-IXDOHACOSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@@H]1CCC[C@@H](N2CCC([NH2+]C3CC4(CCC4)C3)CC2)C1 ZINC000652051706 1129756290 /nfs/dbraw/zinc/75/62/90/1129756290.db2.gz NSYPWXLJWLJFDA-CRAIPNDOSA-N 1 3 290.495 3.952 20 0 CHADHO CCCCCC1CCC([NH2+][C@H]2CCNC[C@H]2C)CC1 ZINC001246211259 1131400960 /nfs/dbraw/zinc/40/09/60/1131400960.db2.gz QDHSTUFRWVWEFV-VXLLPVPCSA-N 1 3 266.473 3.713 20 0 CHADHO C[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000381983705 1129853464 /nfs/dbraw/zinc/85/34/64/1129853464.db2.gz NNJBOAXRXVCXEJ-QRQLOZEOSA-N 1 3 286.463 3.677 20 0 CHADHO CCCC[C@@H]1C[C@@H]([NH2+]CCCC2CCCC2)CCN1 ZINC001246239310 1131423138 /nfs/dbraw/zinc/42/31/38/1131423138.db2.gz MNYJCTBRKYPQHY-SJORKVTESA-N 1 3 266.473 3.857 20 0 CHADHO C[C@H]1[C@@H]([NH+]2CCCC2)CCN1CC1CCC2(CC2)CC1 ZINC001170039421 1130008610 /nfs/dbraw/zinc/00/86/10/1130008610.db2.gz ONOAMIUTQDJSRZ-RDJZCZTQSA-N 1 3 276.468 3.515 20 0 CHADHO [NH3+][C@@H]1C[C@H](NCC[C@@H]2CCC(F)(F)C2)c2ccccc21 ZINC000902458884 1130014040 /nfs/dbraw/zinc/01/40/40/1130014040.db2.gz ZCUUDISSIJABGQ-GLQYFDAESA-N 1 3 280.362 3.546 20 0 CHADHO COc1cc([C@H](C)N[C@@H](C)C[C@H](C)[NH3+])cc2ccccc21 ZINC000902514703 1130018907 /nfs/dbraw/zinc/01/89/07/1130018907.db2.gz USBCXDUTCMTHLW-IHRRRGAJSA-N 1 3 286.419 3.625 20 0 CHADHO C1CCC(N2CCC([NH2+]C3C[C@H]4CCC[C@@H]4C3)CC2)C1 ZINC000902831945 1130066834 /nfs/dbraw/zinc/06/68/34/1130066834.db2.gz HHKQPOAGNPFXLC-HUUCEWRRSA-N 1 3 276.468 3.562 20 0 CHADHO CCCC[C@@H](CC)N[C@H](CC[NH+](C)C)c1cccnc1 ZINC000903383780 1130168649 /nfs/dbraw/zinc/16/86/49/1130168649.db2.gz OOOBHUQYIDKCFU-IAGOWNOFSA-N 1 3 277.456 3.633 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@@H](c2ccccc2)C2CCC2)C1 ZINC000791133278 1130354466 /nfs/dbraw/zinc/35/44/66/1130354466.db2.gz AEDNFTMHTWEHNL-QRVBRYPASA-N 1 3 286.463 3.990 20 0 CHADHO C[NH+](C)[C@@H]1CCC[C@@H](N[C@@H](c2ccccc2)C2CCC2)C1 ZINC000791133278 1130354473 /nfs/dbraw/zinc/35/44/73/1130354473.db2.gz AEDNFTMHTWEHNL-QRVBRYPASA-N 1 3 286.463 3.990 20 0 CHADHO CCCCN1CCC([NH2+][C@H](C)c2ccc(C)nc2C)CC1 ZINC000678415365 1130413186 /nfs/dbraw/zinc/41/31/86/1130413186.db2.gz BHEXXKMTCRNGIY-MRXNPFEDSA-N 1 3 289.467 3.614 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H]2c3ccccc3CC[C@H]2C)C1 ZINC000678767553 1130450504 /nfs/dbraw/zinc/45/05/04/1130450504.db2.gz NEEZRWRRDITVCO-GPMSIDNRSA-N 1 3 286.463 3.632 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H]2c3ccccc3CC[C@H]2C)C1 ZINC000678767553 1130450506 /nfs/dbraw/zinc/45/05/06/1130450506.db2.gz NEEZRWRRDITVCO-GPMSIDNRSA-N 1 3 286.463 3.632 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H]2c3ccccc3CC[C@H]2C)C1 ZINC000678767553 1130450513 /nfs/dbraw/zinc/45/05/13/1130450513.db2.gz NEEZRWRRDITVCO-GPMSIDNRSA-N 1 3 286.463 3.632 20 0 CHADHO C[C@H](CCN1CCC[C@@]2(CC[NH2+]C2)C1)CC(C)(C)C ZINC001234991484 1130700726 /nfs/dbraw/zinc/70/07/26/1130700726.db2.gz HUCMWJKKJBRRKL-WBVHZDCISA-N 1 3 266.473 3.524 20 0 CHADHO CC/C=C\CCCCCN1CCC[C@]2(CC[NH2+]C2)C1 ZINC001234992207 1130700751 /nfs/dbraw/zinc/70/07/51/1130700751.db2.gz JWEANHIOUSJMIK-CWIOURORSA-N 1 3 264.457 3.589 20 0 CHADHO C[C@@H](CN1CC[C@@]2(CC[NH2+]C2)C1)c1cccc2ccccc21 ZINC001235033272 1130702810 /nfs/dbraw/zinc/70/28/10/1130702810.db2.gz XBJLMLOFNMRNFW-OXJNMPFZSA-N 1 3 294.442 3.629 20 0 CHADHO c1ccc(-c2ccccc2CN2CC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC001235034256 1130703693 /nfs/dbraw/zinc/70/36/93/1130703693.db2.gz WAOXMZVTZAREKV-HXUWFJFHSA-N 1 3 292.426 3.539 20 0 CHADHO C[C@H](C[N@@H+]1CCC12CCNCC2)c1cccc2ccccc21 ZINC001235103124 1130710367 /nfs/dbraw/zinc/71/03/67/1130710367.db2.gz SBBGUDQOJSYCLZ-MRXNPFEDSA-N 1 3 294.442 3.771 20 0 CHADHO C[C@H](C[N@H+]1CCC12CCNCC2)c1cccc2ccccc21 ZINC001235103124 1130710370 /nfs/dbraw/zinc/71/03/70/1130710370.db2.gz SBBGUDQOJSYCLZ-MRXNPFEDSA-N 1 3 294.442 3.771 20 0 CHADHO C[C@H](CN1CCC12CC[NH2+]CC2)c1cccc2ccccc21 ZINC001235103124 1130710376 /nfs/dbraw/zinc/71/03/76/1130710376.db2.gz SBBGUDQOJSYCLZ-MRXNPFEDSA-N 1 3 294.442 3.771 20 0 CHADHO Cc1ccc2ccccc2c1C[N@@H+]1CCCC12CCNCC2 ZINC001235143538 1130714438 /nfs/dbraw/zinc/71/44/38/1130714438.db2.gz DZNLIDLUBBEASF-UHFFFAOYSA-N 1 3 294.442 3.866 20 0 CHADHO Cc1ccc2ccccc2c1C[N@H+]1CCCC12CCNCC2 ZINC001235143538 1130714442 /nfs/dbraw/zinc/71/44/42/1130714442.db2.gz DZNLIDLUBBEASF-UHFFFAOYSA-N 1 3 294.442 3.866 20 0 CHADHO c1ccc(CCCC[N@@H+]2CCCC[C@]23CCCNC3)cc1 ZINC001235172992 1130718264 /nfs/dbraw/zinc/71/82/64/1130718264.db2.gz OLZIVGYHHYIDCG-LJQANCHMSA-N 1 3 286.463 3.617 20 0 CHADHO c1ccc(CCCC[N@H+]2CCCC[C@]23CCCNC3)cc1 ZINC001235172992 1130718268 /nfs/dbraw/zinc/71/82/68/1130718268.db2.gz OLZIVGYHHYIDCG-LJQANCHMSA-N 1 3 286.463 3.617 20 0 CHADHO c1cc2cccc(C[N@@H+]3CCCCC34CCNCC4)c2o1 ZINC001235190632 1130720566 /nfs/dbraw/zinc/72/05/66/1130720566.db2.gz GPOWBQKNTSJZPX-UHFFFAOYSA-N 1 3 284.403 3.541 20 0 CHADHO c1cc2cccc(C[N@H+]3CCCCC34CCNCC4)c2o1 ZINC001235190632 1130720569 /nfs/dbraw/zinc/72/05/69/1130720569.db2.gz GPOWBQKNTSJZPX-UHFFFAOYSA-N 1 3 284.403 3.541 20 0 CHADHO CC(C)=CCCC1=CC[C@H](CN2C[C@H]3C[NH2+]CC[C@@H]32)CC1 ZINC001235254724 1130730459 /nfs/dbraw/zinc/73/04/59/1130730459.db2.gz CRXYQAGLJSPIBS-OTWHNJEPSA-N 1 3 288.479 3.753 20 0 CHADHO CC(C)=CCCC1=CC[C@H](C[N@@H+]2C[C@H]3CNCC[C@@H]32)CC1 ZINC001235254724 1130730461 /nfs/dbraw/zinc/73/04/61/1130730461.db2.gz CRXYQAGLJSPIBS-OTWHNJEPSA-N 1 3 288.479 3.753 20 0 CHADHO CC(C)=CCCC1=CC[C@H](C[N@H+]2C[C@H]3CNCC[C@@H]32)CC1 ZINC001235254724 1130730466 /nfs/dbraw/zinc/73/04/66/1130730466.db2.gz CRXYQAGLJSPIBS-OTWHNJEPSA-N 1 3 288.479 3.753 20 0 CHADHO CC/C=C\CC[N@@H+]1CC[C@@]2(c3ccccc3)CCNC[C@@H]2C1 ZINC001235366869 1130736660 /nfs/dbraw/zinc/73/66/60/1130736660.db2.gz RWISRRSGLNNBJI-JGAFRWBPSA-N 1 3 298.474 3.596 20 0 CHADHO CC/C=C\CC[N@H+]1CC[C@@]2(c3ccccc3)CCNC[C@@H]2C1 ZINC001235366869 1130736666 /nfs/dbraw/zinc/73/66/66/1130736666.db2.gz RWISRRSGLNNBJI-JGAFRWBPSA-N 1 3 298.474 3.596 20 0 CHADHO N[C@H]1CC[N@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001235361603 1130736947 /nfs/dbraw/zinc/73/69/47/1130736947.db2.gz IBJITKUJLJLRNZ-ZDUSSCGKSA-N 1 3 282.412 3.588 20 0 CHADHO N[C@H]1CC[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001235361603 1130736951 /nfs/dbraw/zinc/73/69/51/1130736951.db2.gz IBJITKUJLJLRNZ-ZDUSSCGKSA-N 1 3 282.412 3.588 20 0 CHADHO CC/C=C\CC[N@@H+]1CC[C@]2(c3ccccc3)CCNC[C@@H]2C1 ZINC001235366872 1130737945 /nfs/dbraw/zinc/73/79/45/1130737945.db2.gz RWISRRSGLNNBJI-QZPVUJMKSA-N 1 3 298.474 3.596 20 0 CHADHO CC/C=C\CC[N@H+]1CC[C@]2(c3ccccc3)CCNC[C@@H]2C1 ZINC001235366872 1130737950 /nfs/dbraw/zinc/73/79/50/1130737950.db2.gz RWISRRSGLNNBJI-QZPVUJMKSA-N 1 3 298.474 3.596 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@@H+](C)C1CCNCC1 ZINC001235465916 1130746645 /nfs/dbraw/zinc/74/66/45/1130746645.db2.gz KOHDFTARFFAPFI-UHFFFAOYSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@H+](C)C1CCNCC1 ZINC001235465916 1130746650 /nfs/dbraw/zinc/74/66/50/1130746650.db2.gz KOHDFTARFFAPFI-UHFFFAOYSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1ccccc1-c1ccccc1CN(C)C1CC[NH2+]CC1 ZINC001235465916 1130746651 /nfs/dbraw/zinc/74/66/51/1130746651.db2.gz KOHDFTARFFAPFI-UHFFFAOYSA-N 1 3 294.442 3.846 20 0 CHADHO c1ccc([C@H]2CCC[N@H+]2Cc2ccc3c(c2)CNC3)cc1 ZINC001235674827 1130765688 /nfs/dbraw/zinc/76/56/88/1130765688.db2.gz PUVNYYDFHVEKRO-LJQANCHMSA-N 1 3 278.399 3.627 20 0 CHADHO c1ccc([C@H]2CCC[N@@H+]2Cc2ccc3c(c2)CNC3)cc1 ZINC001235674827 1130765693 /nfs/dbraw/zinc/76/56/93/1130765693.db2.gz PUVNYYDFHVEKRO-LJQANCHMSA-N 1 3 278.399 3.627 20 0 CHADHO [NH3+]Cc1ccc(CN2CCC[C@@H]2c2cccc(F)c2)cc1 ZINC001235716097 1130771300 /nfs/dbraw/zinc/77/13/00/1130771300.db2.gz YSRGMTFDJMQHAC-GOSISDBHSA-N 1 3 284.378 3.622 20 0 CHADHO c1ccc2cc(C3CCN(C[C@@H]4CC[NH2+]C4)CC3)ccc2c1 ZINC001235715251 1130772268 /nfs/dbraw/zinc/77/22/68/1130772268.db2.gz OHYSBPKEMRMUDV-MRXNPFEDSA-N 1 3 294.442 3.629 20 0 CHADHO Cc1ccc(Cl)c(CN2CCC([C@H]3CCC[NH2+]3)CC2)c1 ZINC001235888969 1130793990 /nfs/dbraw/zinc/79/39/90/1130793990.db2.gz SPLHVPZYAMECOT-QGZVFWFLSA-N 1 3 292.854 3.612 20 0 CHADHO C[C@@H]1CC[C@H](N)C[N@@H+]1Cc1ccccc1-c1ccccc1 ZINC001235906869 1130803286 /nfs/dbraw/zinc/80/32/86/1130803286.db2.gz OZXZIDCWXSTSBK-QAPCUYQASA-N 1 3 280.415 3.665 20 0 CHADHO C[C@@H]1CC[C@H](N)C[N@H+]1Cc1ccccc1-c1ccccc1 ZINC001235906869 1130803289 /nfs/dbraw/zinc/80/32/89/1130803289.db2.gz OZXZIDCWXSTSBK-QAPCUYQASA-N 1 3 280.415 3.665 20 0 CHADHO [NH3+]CC[C@@H]1CCCN1Cc1ccc(-c2ccccc2)s1 ZINC001235925494 1130806185 /nfs/dbraw/zinc/80/61/85/1130806185.db2.gz QURWYVLNIWQGIB-HNNXBMFYSA-N 1 3 286.444 3.728 20 0 CHADHO C[C@H](C[N@@H+]1CCC[C@H]1CCN)c1cccc2ccccc21 ZINC001235925556 1130806259 /nfs/dbraw/zinc/80/62/59/1130806259.db2.gz UYWKIEFCJASQNQ-WBVHZDCISA-N 1 3 282.431 3.757 20 0 CHADHO C[C@H](C[N@H+]1CCC[C@H]1CCN)c1cccc2ccccc21 ZINC001235925556 1130806263 /nfs/dbraw/zinc/80/62/63/1130806263.db2.gz UYWKIEFCJASQNQ-WBVHZDCISA-N 1 3 282.431 3.757 20 0 CHADHO Clc1ccc([C@H]2CCN(CC[C@H]3CCCC[NH2+]3)C2)cc1 ZINC001235946718 1130812118 /nfs/dbraw/zinc/81/21/18/1130812118.db2.gz AGFBJVVVIJPTNZ-DOTOQJQBSA-N 1 3 292.854 3.662 20 0 CHADHO C[C@@H](CN(C)C[C@H]1CCC[NH2+]C1)c1cccc2ccccc21 ZINC001235952003 1130814681 /nfs/dbraw/zinc/81/46/81/1130814681.db2.gz WTCGRUOPISKWTD-IRXDYDNUSA-N 1 3 296.458 3.875 20 0 CHADHO C[C@@H](C[N@H+](C)C[C@H]1CCCNC1)c1cccc2ccccc21 ZINC001235952003 1130814687 /nfs/dbraw/zinc/81/46/87/1130814687.db2.gz WTCGRUOPISKWTD-IRXDYDNUSA-N 1 3 296.458 3.875 20 0 CHADHO C[C@@H](C[N@@H+](C)C[C@H]1CCCNC1)c1cccc2ccccc21 ZINC001235952003 1130814692 /nfs/dbraw/zinc/81/46/92/1130814692.db2.gz WTCGRUOPISKWTD-IRXDYDNUSA-N 1 3 296.458 3.875 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@H+](C)C[C@H]1CCCNC1 ZINC001235951965 1130814834 /nfs/dbraw/zinc/81/48/34/1130814834.db2.gz WKLDPZZMYCQVHB-SJORKVTESA-N 1 3 266.473 3.690 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@@H+](C)C[C@H]1CCCNC1 ZINC001235951965 1130814839 /nfs/dbraw/zinc/81/48/39/1130814839.db2.gz WKLDPZZMYCQVHB-SJORKVTESA-N 1 3 266.473 3.690 20 0 CHADHO C[C@H](CN)C[N@H+](Cc1ccccc1)[C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170731502 1130836307 /nfs/dbraw/zinc/83/63/07/1130836307.db2.gz RAXJLVXHJIHRDK-NRSFXHEJSA-N 1 3 286.463 3.518 20 0 CHADHO C[C@H](CN)C[N@@H+](Cc1ccccc1)[C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170731502 1130836310 /nfs/dbraw/zinc/83/63/10/1130836310.db2.gz RAXJLVXHJIHRDK-NRSFXHEJSA-N 1 3 286.463 3.518 20 0 CHADHO CC[C@@H](N)C[N@H+](C)CCC(c1ccccc1)c1ccccc1 ZINC001236092084 1130858151 /nfs/dbraw/zinc/85/81/51/1130858151.db2.gz GEKRSSLRKVDPAV-LJQANCHMSA-N 1 3 296.458 3.878 20 0 CHADHO CC[C@@H](N)C[N@@H+](C)CCC(c1ccccc1)c1ccccc1 ZINC001236092084 1130858156 /nfs/dbraw/zinc/85/81/56/1130858156.db2.gz GEKRSSLRKVDPAV-LJQANCHMSA-N 1 3 296.458 3.878 20 0 CHADHO CCCN(Cc1cccc(Cl)c1C)C1CC[NH2+]CC1 ZINC001236183961 1130882242 /nfs/dbraw/zinc/88/22/42/1130882242.db2.gz CVUDHHZKIVUFBQ-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO CCC[N@H+](Cc1cccc(Cl)c1C)C1CCNCC1 ZINC001236183961 1130882247 /nfs/dbraw/zinc/88/22/47/1130882247.db2.gz CVUDHHZKIVUFBQ-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO CCC[N@@H+](Cc1cccc(Cl)c1C)C1CCNCC1 ZINC001236183961 1130882255 /nfs/dbraw/zinc/88/22/55/1130882255.db2.gz CVUDHHZKIVUFBQ-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO CC(C)c1cccc(C[N@H+](C)[C@@H]2CCCC[C@H]2N)c1 ZINC001236214069 1130891701 /nfs/dbraw/zinc/89/17/01/1130891701.db2.gz DUKJBQMQIXDRBZ-IAGOWNOFSA-N 1 3 260.425 3.512 20 0 CHADHO CC(C)c1cccc(C[N@@H+](C)[C@@H]2CCCC[C@H]2N)c1 ZINC001236214069 1130891705 /nfs/dbraw/zinc/89/17/05/1130891705.db2.gz DUKJBQMQIXDRBZ-IAGOWNOFSA-N 1 3 260.425 3.512 20 0 CHADHO CC[C@H](N)C[N@@H+]1CCCC[C@H]1c1ccc(C)c(C)c1 ZINC001236246049 1130904098 /nfs/dbraw/zinc/90/40/98/1130904098.db2.gz XLPNQVKHLKSLJU-IRXDYDNUSA-N 1 3 260.425 3.568 20 0 CHADHO CC[C@H](N)C[N@H+]1CCCC[C@H]1c1ccc(C)c(C)c1 ZINC001236246049 1130904101 /nfs/dbraw/zinc/90/41/01/1130904101.db2.gz XLPNQVKHLKSLJU-IRXDYDNUSA-N 1 3 260.425 3.568 20 0 CHADHO CCC[C@@H](C)C[N@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236371812 1130922129 /nfs/dbraw/zinc/92/21/29/1130922129.db2.gz NPKFKXQDZOCDHD-CVEARBPZSA-N 1 3 266.473 3.667 20 0 CHADHO CCC[C@@H](C)C[N@@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236371812 1130922132 /nfs/dbraw/zinc/92/21/32/1130922132.db2.gz NPKFKXQDZOCDHD-CVEARBPZSA-N 1 3 266.473 3.667 20 0 CHADHO CCC(CC)C[N@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236370490 1130922833 /nfs/dbraw/zinc/92/28/33/1130922833.db2.gz GOTKDRNOQZQURQ-INIZCTEOSA-N 1 3 266.473 3.667 20 0 CHADHO CCC(CC)C[N@@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236370490 1130922836 /nfs/dbraw/zinc/92/28/36/1130922836.db2.gz GOTKDRNOQZQURQ-INIZCTEOSA-N 1 3 266.473 3.667 20 0 CHADHO C(C[N@H+](C[C@@H]1CCCNC1)C1CCCC1)C1CCCC1 ZINC001236373221 1130923359 /nfs/dbraw/zinc/92/33/59/1130923359.db2.gz UZCDXFUAWUBVFA-QGZVFWFLSA-N 1 3 278.484 3.811 20 0 CHADHO C(C[N@@H+](C[C@@H]1CCCNC1)C1CCCC1)C1CCCC1 ZINC001236373221 1130923360 /nfs/dbraw/zinc/92/33/60/1130923360.db2.gz UZCDXFUAWUBVFA-QGZVFWFLSA-N 1 3 278.484 3.811 20 0 CHADHO CC/C=C\CCC[N@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236373158 1130923481 /nfs/dbraw/zinc/92/34/81/1130923481.db2.gz UIESAGJUZBILCH-CWIOURORSA-N 1 3 278.484 3.977 20 0 CHADHO CC/C=C\CCC[N@@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236373158 1130923487 /nfs/dbraw/zinc/92/34/87/1130923487.db2.gz UIESAGJUZBILCH-CWIOURORSA-N 1 3 278.484 3.977 20 0 CHADHO CC/C=C\CCCCC[N@@H+](CCOCC)C1CCNCC1 ZINC001236460936 1130946832 /nfs/dbraw/zinc/94/68/32/1130946832.db2.gz VRKWCQLOOJVMEG-WAYWQWQTSA-N 1 3 296.499 3.604 20 0 CHADHO CC/C=C\CCCCC[N@H+](CCOCC)C1CCNCC1 ZINC001236460936 1130946838 /nfs/dbraw/zinc/94/68/38/1130946838.db2.gz VRKWCQLOOJVMEG-WAYWQWQTSA-N 1 3 296.499 3.604 20 0 CHADHO CC/C=C\CCCCCN(CCOCC)C1CC[NH2+]CC1 ZINC001236460936 1130946842 /nfs/dbraw/zinc/94/68/42/1130946842.db2.gz VRKWCQLOOJVMEG-WAYWQWQTSA-N 1 3 296.499 3.604 20 0 CHADHO Cc1cc(F)cc(C)c1CN(C1CCC1)C1CC[NH2+]CC1 ZINC001236638102 1130986390 /nfs/dbraw/zinc/98/63/90/1130986390.db2.gz VVUQMMUQJOAPFJ-UHFFFAOYSA-N 1 3 290.426 3.549 20 0 CHADHO Cc1cc(F)cc(C)c1C[N@H+](C1CCC1)C1CCNCC1 ZINC001236638102 1130986395 /nfs/dbraw/zinc/98/63/95/1130986395.db2.gz VVUQMMUQJOAPFJ-UHFFFAOYSA-N 1 3 290.426 3.549 20 0 CHADHO Cc1cc(F)cc(C)c1C[N@@H+](C1CCC1)C1CCNCC1 ZINC001236638102 1130986401 /nfs/dbraw/zinc/98/64/01/1130986401.db2.gz VVUQMMUQJOAPFJ-UHFFFAOYSA-N 1 3 290.426 3.549 20 0 CHADHO C[C@@H](NCCCCC[NH+]1CCCC1)c1cccnc1Cl ZINC000815647312 1131016078 /nfs/dbraw/zinc/01/60/78/1131016078.db2.gz GHFCCSIIOPOPEH-CQSZACIVSA-N 1 3 295.858 3.652 20 0 CHADHO CCCN(Cc1cccc(C(C)C)c1)C[C@@H]1CC[NH2+]C1 ZINC001236842567 1131020335 /nfs/dbraw/zinc/02/03/35/1131020335.db2.gz FNJQNZZSJSFNRC-QGZVFWFLSA-N 1 3 274.452 3.632 20 0 CHADHO CCC(CC)[N@H+](CCCNC)[C@H](C)c1ccccc1 ZINC001236860576 1131026089 /nfs/dbraw/zinc/02/60/89/1131026089.db2.gz RJFSYXFBJASXFW-OAHLLOKOSA-N 1 3 262.441 3.848 20 0 CHADHO C[C@H](N[C@H]1CCC[NH2+]CC1)c1csc2ccccc12 ZINC000817899420 1131187189 /nfs/dbraw/zinc/18/71/89/1131187189.db2.gz OJDSCKPEOMYWAJ-STQMWFEESA-N 1 3 274.433 3.694 20 0 CHADHO CC[C@H](NCc1ccc(CC[NH3+])cc1)c1ccccc1F ZINC000817948417 1131189142 /nfs/dbraw/zinc/18/91/42/1131189142.db2.gz JLTVPOPGUHZZSY-SFHVURJKSA-N 1 3 286.394 3.568 20 0 CHADHO CC(C)[C@H](N)C[NH2+][C@@H](C)c1ccc(SC(F)F)cc1 ZINC000817959178 1131192235 /nfs/dbraw/zinc/19/22/35/1131192235.db2.gz PXBVLSOJFYFFRP-GXFFZTMASA-N 1 3 288.407 3.635 20 0 CHADHO CC(C)(C)[C@@H]1C[C@H]([NH2+]C2CCC(C)(C)CC2)CCN1 ZINC001246313355 1131461709 /nfs/dbraw/zinc/46/17/09/1131461709.db2.gz YSHRFFVBJXOZFU-CABCVRRESA-N 1 3 266.473 3.712 20 0 CHADHO CSC(C)(C)C[C@H](C)[NH2+]C1(CC2CCC2)CCNCC1 ZINC001246448426 1131502746 /nfs/dbraw/zinc/50/27/46/1131502746.db2.gz UJSKKKOKDOYONI-AWEZNQCLSA-N 1 3 298.540 3.809 20 0 CHADHO CCC[C@@]1(CN[C@@H](C)C[C@H](C)CC(C)C)CC[NH2+]1 ZINC001246454169 1131503738 /nfs/dbraw/zinc/50/37/38/1131503738.db2.gz ABHRLNGPZQLRTJ-PMPSAXMXSA-N 1 3 254.462 3.569 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[NH2+][C@H](C1CCC1)C1CNC1 ZINC001246519199 1131545819 /nfs/dbraw/zinc/54/58/19/1131545819.db2.gz QSVLIDOQTYMPMZ-GRDNDAEWSA-N 1 3 266.473 3.569 20 0 CHADHO CCn1ccc2c1cccc2C[N@H+](C)CCCN1CCCC1 ZINC001139153201 1131586928 /nfs/dbraw/zinc/58/69/28/1131586928.db2.gz GNPQPYMVTRQENE-UHFFFAOYSA-N 1 3 299.462 3.579 20 0 CHADHO CCn1ccc2c1cccc2C[N@@H+](C)CCCN1CCCC1 ZINC001139153201 1131586933 /nfs/dbraw/zinc/58/69/33/1131586933.db2.gz GNPQPYMVTRQENE-UHFFFAOYSA-N 1 3 299.462 3.579 20 0 CHADHO C[C@H]1CCCC[N@@H+]([C@H]2CCNC3(CCCCC3)C2)C1 ZINC001246557874 1131620727 /nfs/dbraw/zinc/62/07/27/1131620727.db2.gz LQLASSOJHNABMA-HOTGVXAUSA-N 1 3 264.457 3.563 20 0 CHADHO C[C@H]1CCCC[N@H+]([C@H]2CCNC3(CCCCC3)C2)C1 ZINC001246557874 1131620731 /nfs/dbraw/zinc/62/07/31/1131620731.db2.gz LQLASSOJHNABMA-HOTGVXAUSA-N 1 3 264.457 3.563 20 0 CHADHO CCCCC(CCCC)[N@@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001246567277 1131635268 /nfs/dbraw/zinc/63/52/68/1131635268.db2.gz WXGKGZGIHYSACY-GJZGRUSLSA-N 1 3 254.462 3.795 20 0 CHADHO CCCCC(CCCC)[N@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001246567277 1131635271 /nfs/dbraw/zinc/63/52/71/1131635271.db2.gz WXGKGZGIHYSACY-GJZGRUSLSA-N 1 3 254.462 3.795 20 0 CHADHO CCCC[C@@H]1C[C@@H]([N@@H+]2CCC[C@](C)(F)CC2)CCN1 ZINC001246570892 1131645862 /nfs/dbraw/zinc/64/58/62/1131645862.db2.gz TZGZRIRJORJPKR-PMPSAXMXSA-N 1 3 270.436 3.511 20 0 CHADHO CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@](C)(F)CC2)CCN1 ZINC001246570892 1131645866 /nfs/dbraw/zinc/64/58/66/1131645866.db2.gz TZGZRIRJORJPKR-PMPSAXMXSA-N 1 3 270.436 3.511 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[N@H+]1C[C@@H](CN)CC[C@H]1C ZINC001246590681 1131707218 /nfs/dbraw/zinc/70/72/18/1131707218.db2.gz KOXSXBBJXLGTDG-XUWVNRHRSA-N 1 3 254.462 3.506 20 0 CHADHO CCCCCC[C@H](CC)[N@@H+]1CCCC[C@H](CN)C1 ZINC001246584774 1131693823 /nfs/dbraw/zinc/69/38/23/1131693823.db2.gz UUJHSJZXFJKORY-CVEARBPZSA-N 1 3 254.462 3.796 20 0 CHADHO CCCCCC[C@H](CC)[N@H+]1CCCC[C@H](CN)C1 ZINC001246584774 1131693826 /nfs/dbraw/zinc/69/38/26/1131693826.db2.gz UUJHSJZXFJKORY-CVEARBPZSA-N 1 3 254.462 3.796 20 0 CHADHO CCCC(CCC)[N@H+](C(C)C)[C@H]1CCCNCC1 ZINC001246588714 1131704337 /nfs/dbraw/zinc/70/43/37/1131704337.db2.gz CCXIOWWTWJXNPU-INIZCTEOSA-N 1 3 254.462 3.808 20 0 CHADHO CCCC(CCC)[N@@H+](C(C)C)[C@H]1CCCNCC1 ZINC001246588714 1131704341 /nfs/dbraw/zinc/70/43/41/1131704341.db2.gz CCXIOWWTWJXNPU-INIZCTEOSA-N 1 3 254.462 3.808 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[N@@H+]1C[C@@H](CN)CC[C@H]1C ZINC001246590681 1131707215 /nfs/dbraw/zinc/70/72/15/1131707215.db2.gz KOXSXBBJXLGTDG-XUWVNRHRSA-N 1 3 254.462 3.506 20 0 CHADHO C[C@@H]1C[C@H]([N@@H+]2CCC[C@]3(CCCCN3)C2)CC(C)(C)C1 ZINC001246614165 1131718070 /nfs/dbraw/zinc/71/80/70/1131718070.db2.gz MNXWGLQKFDMUFJ-SOLBZPMBSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H]1C[C@H]([N@H+]2CCC[C@]3(CCCCN3)C2)CC(C)(C)C1 ZINC001246614165 1131718072 /nfs/dbraw/zinc/71/80/72/1131718072.db2.gz MNXWGLQKFDMUFJ-SOLBZPMBSA-N 1 3 278.484 3.809 20 0 CHADHO C1CCC2(CC1)CCC[C@@H]([NH+]1CCCNCCC1)C2 ZINC001246904180 1131806548 /nfs/dbraw/zinc/80/65/48/1131806548.db2.gz FMIOXMQBEXZERC-MRXNPFEDSA-N 1 3 264.457 3.565 20 0 CHADHO CC(C)[C@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC000036968094 1131982626 /nfs/dbraw/zinc/98/26/26/1131982626.db2.gz MAMULAUWASPGRH-FBVQUNGASA-N 1 3 290.426 3.738 20 0 CHADHO CC(C)[C@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC000036968094 1131982632 /nfs/dbraw/zinc/98/26/32/1131982632.db2.gz MAMULAUWASPGRH-FBVQUNGASA-N 1 3 290.426 3.738 20 0 CHADHO C[C@H]([NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)C1(C)CC1 ZINC000716639071 1132029511 /nfs/dbraw/zinc/02/95/11/1132029511.db2.gz RNDOBBAHCMLEFS-WNHJNPCNSA-N 1 3 298.474 3.818 20 0 CHADHO C[C@@H]1CC[C@@H](C)C1[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001171629206 1132060232 /nfs/dbraw/zinc/06/02/32/1132060232.db2.gz PQROKQAFOCXNOV-CHWSQXEVSA-N 1 3 266.473 3.662 20 0 CHADHO Cc1ccc(CC[NH2+]C2CC(C)(C)N(C)C(C)(C)C2)cc1 ZINC001171616649 1132064994 /nfs/dbraw/zinc/06/49/94/1132064994.db2.gz CUKNPGMAJRXOPZ-UHFFFAOYSA-N 1 3 288.479 3.779 20 0 CHADHO CN1C(C)(C)CC([NH+]2CCC(C)(C)CC2)CC1(C)C ZINC001171636502 1132078361 /nfs/dbraw/zinc/07/83/61/1132078361.db2.gz GKQLFWWOQWEBSJ-UHFFFAOYSA-N 1 3 266.473 3.760 20 0 CHADHO CN1C(C)(C)CC([N@@H+]2CCc3ccsc3C2)CC1(C)C ZINC001171637449 1132081335 /nfs/dbraw/zinc/08/13/35/1132081335.db2.gz NUFPWPCLSPWSGH-UHFFFAOYSA-N 1 3 292.492 3.758 20 0 CHADHO CN1C(C)(C)CC([N@H+]2CCc3ccsc3C2)CC1(C)C ZINC001171637449 1132081342 /nfs/dbraw/zinc/08/13/42/1132081342.db2.gz NUFPWPCLSPWSGH-UHFFFAOYSA-N 1 3 292.492 3.758 20 0 CHADHO CCN1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(Cl)s2)C1 ZINC000121814204 1132111715 /nfs/dbraw/zinc/11/17/15/1132111715.db2.gz PUJWOMUCFMILTC-RYUDHWBXSA-N 1 3 286.872 3.784 20 0 CHADHO CC(C)OCC[C@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC001172439468 1132233473 /nfs/dbraw/zinc/23/34/73/1132233473.db2.gz DYBWMLOJMPOBMP-INIZCTEOSA-N 1 3 296.499 3.577 20 0 CHADHO CC(C)OCC[C@H](C)[N@@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001172450802 1132237654 /nfs/dbraw/zinc/23/76/54/1132237654.db2.gz KQQHUNVGTGSNGO-ROUUACIJSA-N 1 3 296.499 3.530 20 0 CHADHO CC(C)OCC[C@H](C)[N@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001172450802 1132237658 /nfs/dbraw/zinc/23/76/58/1132237658.db2.gz KQQHUNVGTGSNGO-ROUUACIJSA-N 1 3 296.499 3.530 20 0 CHADHO CC1(C)CC([N@H+](CCCN)C2CCCCC2)CC(C)(C)O1 ZINC001172644671 1132287068 /nfs/dbraw/zinc/28/70/68/1132287068.db2.gz XIFJYCABYISOHB-UHFFFAOYSA-N 1 3 296.499 3.706 20 0 CHADHO CC1(C)CC([N@@H+](CCCN)C2CCCCC2)CC(C)(C)O1 ZINC001172644671 1132287070 /nfs/dbraw/zinc/28/70/70/1132287070.db2.gz XIFJYCABYISOHB-UHFFFAOYSA-N 1 3 296.499 3.706 20 0 CHADHO CCCCN(C)CCC[NH2+][C@H]1CCc2ccc(C)cc2C1 ZINC001172825909 1132321251 /nfs/dbraw/zinc/32/12/51/1132321251.db2.gz LMUILGUEGPICRC-IBGZPJMESA-N 1 3 288.479 3.564 20 0 CHADHO CN1CC[C@@H]2C[N@@H+](C3CCC4(CCCCC4)CC3)C[C@@H]2C1 ZINC001173117204 1132396058 /nfs/dbraw/zinc/39/60/58/1132396058.db2.gz ZBNZRAHXQLLIBI-SJORKVTESA-N 1 3 290.495 3.763 20 0 CHADHO CN1CC[C@@H]2C[N@H+](C3CCC4(CCCCC4)CC3)C[C@@H]2C1 ZINC001173117204 1132396066 /nfs/dbraw/zinc/39/60/66/1132396066.db2.gz ZBNZRAHXQLLIBI-SJORKVTESA-N 1 3 290.495 3.763 20 0 CHADHO c1c2c[nH]ccc-2nc1C[N@@H+]1CC[C@H](C2CCCCC2)C1 ZINC001232016553 1132411344 /nfs/dbraw/zinc/41/13/44/1132411344.db2.gz ZAXZVZATFSHIQP-HNNXBMFYSA-N 1 3 283.419 3.965 20 0 CHADHO c1c2c[nH]ccc-2nc1C[N@H+]1CC[C@H](C2CCCCC2)C1 ZINC001232016553 1132411348 /nfs/dbraw/zinc/41/13/48/1132411348.db2.gz ZAXZVZATFSHIQP-HNNXBMFYSA-N 1 3 283.419 3.965 20 0 CHADHO CN(C)Cc1cc(F)cc(C[NH+]2C[C@H]3CCCC[C@@H]3C2)c1 ZINC001232145115 1132427102 /nfs/dbraw/zinc/42/71/02/1132427102.db2.gz VRPCUBUYOOYKTG-IAGOWNOFSA-N 1 3 290.426 3.509 20 0 CHADHO C[C@@H]1CCCCC[N@@H+]1Cc1cc(F)cc(CN(C)C)c1 ZINC001232146807 1132427182 /nfs/dbraw/zinc/42/71/82/1132427182.db2.gz HVPRUHULZZUYSG-CQSZACIVSA-N 1 3 278.415 3.652 20 0 CHADHO C[C@@H]1CCCCC[N@H+]1Cc1cc(F)cc(CN(C)C)c1 ZINC001232146807 1132427183 /nfs/dbraw/zinc/42/71/83/1132427183.db2.gz HVPRUHULZZUYSG-CQSZACIVSA-N 1 3 278.415 3.652 20 0 CHADHO CCCC[C@@H](CC(C)C)[N@H+]1C[C@H]2CN(CCC)C[C@H]2C1 ZINC001173259086 1132427825 /nfs/dbraw/zinc/42/78/25/1132427825.db2.gz FMQYMULNCJAZFP-KSZLIROESA-N 1 3 280.500 3.865 20 0 CHADHO CCCC[C@@H](CC(C)C)[N@@H+]1C[C@H]2CN(CCC)C[C@H]2C1 ZINC001173259086 1132427829 /nfs/dbraw/zinc/42/78/29/1132427829.db2.gz FMQYMULNCJAZFP-KSZLIROESA-N 1 3 280.500 3.865 20 0 CHADHO CC[C@H]1CC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC001173271665 1132436019 /nfs/dbraw/zinc/43/60/19/1132436019.db2.gz HONVTVWWCXQGQW-RDJZCZTQSA-N 1 3 278.484 3.952 20 0 CHADHO [NH3+]C[C@H]1CCCCN(Cc2ccc(-c3ccccc3)o2)C1 ZINC001206633106 1132552298 /nfs/dbraw/zinc/55/22/98/1132552298.db2.gz SYWJIUFUVVKPLU-OAHLLOKOSA-N 1 3 284.403 3.507 20 0 CHADHO Cc1cc(Cl)cc(C)c1CN1CCCC[C@@H](C[NH3+])C1 ZINC001206641080 1132569260 /nfs/dbraw/zinc/56/92/60/1132569260.db2.gz SGYNDQLKINHILE-AWEZNQCLSA-N 1 3 280.843 3.518 20 0 CHADHO Cc1ccsc1C[N@H+]1CCCC[C@H]1C[C@@H]1CCCN1C ZINC001204023829 1133401146 /nfs/dbraw/zinc/40/11/46/1133401146.db2.gz PJJNPSVPBDQMJV-HOTGVXAUSA-N 1 3 292.492 3.895 20 0 CHADHO Cc1ccsc1C[N@@H+]1CCCC[C@H]1C[C@@H]1CCCN1C ZINC001204023829 1133401148 /nfs/dbraw/zinc/40/11/48/1133401148.db2.gz PJJNPSVPBDQMJV-HOTGVXAUSA-N 1 3 292.492 3.895 20 0 CHADHO Cc1ccsc1CN1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C ZINC001204023829 1133401150 /nfs/dbraw/zinc/40/11/50/1133401150.db2.gz PJJNPSVPBDQMJV-HOTGVXAUSA-N 1 3 292.492 3.895 20 0 CHADHO Cc1ccsc1CN1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C ZINC001204023829 1133401156 /nfs/dbraw/zinc/40/11/56/1133401156.db2.gz PJJNPSVPBDQMJV-HOTGVXAUSA-N 1 3 292.492 3.895 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+](C[C@H]2CCCC(C)(C)C2)C1 ZINC001204161892 1133412385 /nfs/dbraw/zinc/41/23/85/1133412385.db2.gz HNAMINCQACIZNO-IRXDYDNUSA-N 1 3 280.500 3.867 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+](C[C@H]2CCCC(C)(C)C2)C1 ZINC001204161892 1133412388 /nfs/dbraw/zinc/41/23/88/1133412388.db2.gz HNAMINCQACIZNO-IRXDYDNUSA-N 1 3 280.500 3.867 20 0 CHADHO Cc1ccc(CN2CCCC[C@@H]2C[C@@H]2CCC[N@H+]2C)cc1 ZINC001204174591 1133415179 /nfs/dbraw/zinc/41/51/79/1133415179.db2.gz YLBKMACTAUGNBK-RBUKOAKNSA-N 1 3 286.463 3.834 20 0 CHADHO Cc1ccc(CN2CCCC[C@@H]2C[C@@H]2CCC[N@@H+]2C)cc1 ZINC001204174591 1133415182 /nfs/dbraw/zinc/41/51/82/1133415182.db2.gz YLBKMACTAUGNBK-RBUKOAKNSA-N 1 3 286.463 3.834 20 0 CHADHO Cc1ccc(C[N@H+]2CCCC[C@@H]2C[C@@H]2CCCN2C)cc1 ZINC001204174591 1133415184 /nfs/dbraw/zinc/41/51/84/1133415184.db2.gz YLBKMACTAUGNBK-RBUKOAKNSA-N 1 3 286.463 3.834 20 0 CHADHO Cc1ccc(C[N@@H+]2CCCC[C@@H]2C[C@@H]2CCCN2C)cc1 ZINC001204174591 1133415189 /nfs/dbraw/zinc/41/51/89/1133415189.db2.gz YLBKMACTAUGNBK-RBUKOAKNSA-N 1 3 286.463 3.834 20 0 CHADHO C[C@@H]1CCC[C@H](C)N1CCC[NH2+]C1CCCCC1 ZINC001204599347 1133465525 /nfs/dbraw/zinc/46/55/25/1133465525.db2.gz XLTQMZIKKIOQPF-GASCZTMLSA-N 1 3 252.446 3.562 20 0 CHADHO C[NH+](C)Cc1ccc(-c2ccc3c(N)ccnc3c2)cc1 ZINC001204641684 1133471350 /nfs/dbraw/zinc/47/13/50/1133471350.db2.gz ITTKRSWSBJCYJA-UHFFFAOYSA-N 1 3 277.371 3.546 20 0 CHADHO C[NH2+]C[C@@H]1CCCN(Cc2ccccc2-c2ccccc2)C1 ZINC001205008544 1133516498 /nfs/dbraw/zinc/51/64/98/1133516498.db2.gz CMLIBVYPPFJVKX-KRWDZBQOSA-N 1 3 294.442 3.785 20 0 CHADHO CC(C)c1ccc(C[C@H](C)C[N@@H+]2CCC[C@H](N)CC2)cc1 ZINC001205093895 1133527312 /nfs/dbraw/zinc/52/73/12/1133527312.db2.gz HMVDFYCDBRKKCC-LPHOPBHVSA-N 1 3 288.479 3.802 20 0 CHADHO CC(C)c1ccc(C[C@H](C)C[N@H+]2CCC[C@H](N)CC2)cc1 ZINC001205093895 1133527315 /nfs/dbraw/zinc/52/73/15/1133527315.db2.gz HMVDFYCDBRKKCC-LPHOPBHVSA-N 1 3 288.479 3.802 20 0 CHADHO CC(C)[C@@H](NC1CC[NH+](CC2CC2)CC1)c1ccccc1 ZINC000163081827 1133535329 /nfs/dbraw/zinc/53/53/29/1133535329.db2.gz FWNHCIVONXKDOI-LJQANCHMSA-N 1 3 286.463 3.848 20 0 CHADHO CCCCOc1cccc(CN2CCC[C@](C)([NH3+])CC2)c1 ZINC001205273249 1133553304 /nfs/dbraw/zinc/55/33/04/1133553304.db2.gz ISZFSNWXOYTZFY-SFHVURJKSA-N 1 3 290.451 3.569 20 0 CHADHO C[C@H]1CCN(Cc2cccc(-c3ccccc3)c2)C[C@@H]1C[NH3+] ZINC001205305031 1133558308 /nfs/dbraw/zinc/55/83/08/1133558308.db2.gz QOTXRWUJYAUALK-JXFKEZNVSA-N 1 3 294.442 3.770 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@H+]1CCNCC[C@@H]1C ZINC001205330976 1133562215 /nfs/dbraw/zinc/56/22/15/1133562215.db2.gz BOFRZAGLFPUUPX-KRWDZBQOSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@@H+]1CCNCC[C@@H]1C ZINC001205330976 1133562218 /nfs/dbraw/zinc/56/22/18/1133562218.db2.gz BOFRZAGLFPUUPX-KRWDZBQOSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1ccc(-c2cccc(C[N@H+]3CCNCC[C@@H]3C)c2)cc1 ZINC001205331494 1133562529 /nfs/dbraw/zinc/56/25/29/1133562529.db2.gz GZEYPGIFMJDNAH-KRWDZBQOSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1ccc(-c2cccc(C[N@@H+]3CCNCC[C@@H]3C)c2)cc1 ZINC001205331494 1133562532 /nfs/dbraw/zinc/56/25/32/1133562532.db2.gz GZEYPGIFMJDNAH-KRWDZBQOSA-N 1 3 294.442 3.846 20 0 CHADHO CN(C)C[C@@H]1CC[N@H+](Cc2ccc(C3CC3)c(C3CC3)c2)C1 ZINC001205385786 1133572471 /nfs/dbraw/zinc/57/24/71/1133572471.db2.gz QJJVUZHWRNXPHB-INIZCTEOSA-N 1 3 298.474 3.825 20 0 CHADHO CN(C)C[C@@H]1CC[N@@H+](Cc2ccc(C3CC3)c(C3CC3)c2)C1 ZINC001205385786 1133572475 /nfs/dbraw/zinc/57/24/75/1133572475.db2.gz QJJVUZHWRNXPHB-INIZCTEOSA-N 1 3 298.474 3.825 20 0 CHADHO Cc1ccc(F)c(CN(C)CC2CC[NH+](C(C)C)CC2)c1 ZINC001205648593 1133598492 /nfs/dbraw/zinc/59/84/92/1133598492.db2.gz VNBTUAOUDWCJNR-UHFFFAOYSA-N 1 3 292.442 3.686 20 0 CHADHO Cc1cc(F)cc(CN2CC[C@@H](C[NH3+])[C@@H](C)CC2)c1Cl ZINC001205654550 1133600175 /nfs/dbraw/zinc/60/01/75/1133600175.db2.gz XFADOIHNWFZTNI-AAEUAGOBSA-N 1 3 298.833 3.594 20 0 CHADHO N[C@H]1CCCC[N@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001205930810 1133633093 /nfs/dbraw/zinc/63/30/93/1133633093.db2.gz DLYDTQRFNZBWLM-SFHVURJKSA-N 1 3 298.405 3.806 20 0 CHADHO N[C@H]1CCCC[N@@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001205930810 1133633098 /nfs/dbraw/zinc/63/30/98/1133633098.db2.gz DLYDTQRFNZBWLM-SFHVURJKSA-N 1 3 298.405 3.806 20 0 CHADHO [NH3+]Cc1ccc(CN2CCC[C@@H]2c2ccc(F)cc2)cc1 ZINC001206049952 1133649589 /nfs/dbraw/zinc/64/95/89/1133649589.db2.gz VZGBKDKIXXFJOQ-GOSISDBHSA-N 1 3 284.378 3.622 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@H+]1CCNC[C@H](C)C1 ZINC001206276573 1133681189 /nfs/dbraw/zinc/68/11/89/1133681189.db2.gz GRUSUBKZJDQAMG-INIZCTEOSA-N 1 3 294.442 3.703 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@@H+]1CCNC[C@H](C)C1 ZINC001206276573 1133681191 /nfs/dbraw/zinc/68/11/91/1133681191.db2.gz GRUSUBKZJDQAMG-INIZCTEOSA-N 1 3 294.442 3.703 20 0 CHADHO Cc1c(C[N@H+]2CCNC[C@@H](C)C2)cccc1-c1ccccc1 ZINC001206284415 1133683044 /nfs/dbraw/zinc/68/30/44/1133683044.db2.gz DBEBRUYJYQSIOK-MRXNPFEDSA-N 1 3 294.442 3.703 20 0 CHADHO Cc1c(C[N@@H+]2CCNC[C@@H](C)C2)cccc1-c1ccccc1 ZINC001206284415 1133683046 /nfs/dbraw/zinc/68/30/46/1133683046.db2.gz DBEBRUYJYQSIOK-MRXNPFEDSA-N 1 3 294.442 3.703 20 0 CHADHO C[C@@]1(C[NH3+])CCCCN(Cc2cc3ccccc3s2)C1 ZINC001206548914 1133715073 /nfs/dbraw/zinc/71/50/73/1133715073.db2.gz KPMXENBCSLDYIA-KRWDZBQOSA-N 1 3 288.460 3.852 20 0 CHADHO CCn1ccc2ccc(CN3CCCC[C@](C)(C[NH3+])C3)cc21 ZINC001206548098 1133715719 /nfs/dbraw/zinc/71/57/19/1133715719.db2.gz GFPLPZOFUABRPN-LJQANCHMSA-N 1 3 299.462 3.612 20 0 CHADHO C[C@]1(C[NH3+])CCCCN(Cc2cc3ccccc3s2)C1 ZINC001206548917 1133715854 /nfs/dbraw/zinc/71/58/54/1133715854.db2.gz KPMXENBCSLDYIA-QGZVFWFLSA-N 1 3 288.460 3.852 20 0 CHADHO COC(C)(C)CCC[C@@H](C)CC[N@@H+]1CCCC[C@H](CN)C1 ZINC001206606580 1133726691 /nfs/dbraw/zinc/72/66/91/1133726691.db2.gz PYWPPOWDSWDBMO-IAGOWNOFSA-N 1 3 298.515 3.669 20 0 CHADHO COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCCC[C@H](CN)C1 ZINC001206606580 1133726694 /nfs/dbraw/zinc/72/66/94/1133726694.db2.gz PYWPPOWDSWDBMO-IAGOWNOFSA-N 1 3 298.515 3.669 20 0 CHADHO C[C@@H]1CC[C@H](CN)C[N@@H+]1CC1(c2ccccc2)CCCC1 ZINC001206760534 1133743632 /nfs/dbraw/zinc/74/36/32/1133743632.db2.gz JCRAOKMRKWHCLY-IAGOWNOFSA-N 1 3 286.463 3.558 20 0 CHADHO C[C@@H]1CC[C@H](CN)C[N@H+]1CC1(c2ccccc2)CCCC1 ZINC001206760534 1133743636 /nfs/dbraw/zinc/74/36/36/1133743636.db2.gz JCRAOKMRKWHCLY-IAGOWNOFSA-N 1 3 286.463 3.558 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@@H+]1C[C@H](CN)CC[C@@H]1C ZINC001206761294 1133743782 /nfs/dbraw/zinc/74/37/82/1133743782.db2.gz WDAWPGXZMMHREV-ULQDDVLXSA-N 1 3 298.515 3.667 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@H+]1C[C@H](CN)CC[C@@H]1C ZINC001206761294 1133743785 /nfs/dbraw/zinc/74/37/85/1133743785.db2.gz WDAWPGXZMMHREV-ULQDDVLXSA-N 1 3 298.515 3.667 20 0 CHADHO C[C@@H]1CC[C@H](C[NH3+])CN1Cc1ccc(F)c2ccccc12 ZINC001206767884 1133746199 /nfs/dbraw/zinc/74/61/99/1133746199.db2.gz FVSBECOTBMGAFL-ZIAGYGMSSA-N 1 3 286.394 3.538 20 0 CHADHO Cc1ccc2ccccc2c1C[N@H+]1C[C@@H](CN)CC[C@@H]1C ZINC001206770182 1133746377 /nfs/dbraw/zinc/74/63/77/1133746377.db2.gz RWFSEBMDSUIROU-JKSUJKDBSA-N 1 3 282.431 3.707 20 0 CHADHO Cc1ccc2ccccc2c1C[N@@H+]1C[C@@H](CN)CC[C@@H]1C ZINC001206770182 1133746380 /nfs/dbraw/zinc/74/63/80/1133746380.db2.gz RWFSEBMDSUIROU-JKSUJKDBSA-N 1 3 282.431 3.707 20 0 CHADHO C[C@@H]1CC[C@H](C[NH3+])CN1Cc1cccc2c(F)cccc12 ZINC001206811443 1133750984 /nfs/dbraw/zinc/75/09/84/1133750984.db2.gz UPSZZBCVTAQHJT-ZIAGYGMSSA-N 1 3 286.394 3.538 20 0 CHADHO CCN(CC)CC[C@@H](C)[NH2+][C@H](C)Cc1ccc(C)cc1 ZINC001207858582 1133854904 /nfs/dbraw/zinc/85/49/04/1133854904.db2.gz VQSIDDMNDPRYHS-IAGOWNOFSA-N 1 3 276.468 3.636 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@@H](C)Cc1ccc(C)cc1 ZINC001207858583 1133855614 /nfs/dbraw/zinc/85/56/14/1133855614.db2.gz VQSIDDMNDPRYHS-IRXDYDNUSA-N 1 3 276.468 3.636 20 0 CHADHO c1ccc(CN2CC[C@H](C[N@@H+]3CCCCC34CC4)C2)cc1 ZINC001208954090 1133966279 /nfs/dbraw/zinc/96/62/79/1133966279.db2.gz UHSFDARPBHDBDW-SFHVURJKSA-N 1 3 284.447 3.527 20 0 CHADHO c1ccc(CN2CC[C@H](C[N@H+]3CCCCC34CC4)C2)cc1 ZINC001208954090 1133966282 /nfs/dbraw/zinc/96/62/82/1133966282.db2.gz UHSFDARPBHDBDW-SFHVURJKSA-N 1 3 284.447 3.527 20 0 CHADHO CCN(Cc1ccccc1)C1CC[NH+](C[C@@H]2C[C@H]2C)CC1 ZINC001209420355 1134014260 /nfs/dbraw/zinc/01/42/60/1134014260.db2.gz HZPZAWJPSRFECO-AEFFLSMTSA-N 1 3 286.463 3.629 20 0 CHADHO CC(C)(CC[N@@H+]1CCC[C@@]12CCCNC2)c1ccccc1 ZINC001222230623 1135210754 /nfs/dbraw/zinc/21/07/54/1135210754.db2.gz BQXPRCOXAOVMJY-LJQANCHMSA-N 1 3 286.463 3.572 20 0 CHADHO CC(C)(CC[N@H+]1CCC[C@@]12CCCNC2)c1ccccc1 ZINC001222230623 1135210761 /nfs/dbraw/zinc/21/07/61/1135210761.db2.gz BQXPRCOXAOVMJY-LJQANCHMSA-N 1 3 286.463 3.572 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@@H+]1CCC[C@]12CCCNC2 ZINC001222232516 1135211426 /nfs/dbraw/zinc/21/14/26/1135211426.db2.gz VVAFFQJRHOLYCZ-MSOLQXFVSA-N 1 3 278.484 3.977 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@H+]1CCC[C@]12CCCNC2 ZINC001222232516 1135211431 /nfs/dbraw/zinc/21/14/31/1135211431.db2.gz VVAFFQJRHOLYCZ-MSOLQXFVSA-N 1 3 278.484 3.977 20 0 CHADHO Cc1ccc2ccccc2c1C[N@@H+]1CCC[C@@]12CCCNC2 ZINC001222247340 1135214345 /nfs/dbraw/zinc/21/43/45/1135214345.db2.gz DBZPMVUUPRTLQF-HXUWFJFHSA-N 1 3 294.442 3.866 20 0 CHADHO Cc1ccc2ccccc2c1C[N@H+]1CCC[C@@]12CCCNC2 ZINC001222247340 1135214350 /nfs/dbraw/zinc/21/43/50/1135214350.db2.gz DBZPMVUUPRTLQF-HXUWFJFHSA-N 1 3 294.442 3.866 20 0 CHADHO C[N@H+](Cc1cccc(-c2ccccc2)c1)C1CCNCC1 ZINC000347190926 529992749 /nfs/dbraw/zinc/99/27/49/529992749.db2.gz FKPQNVHFZWXPPT-UHFFFAOYSA-N 1 3 280.415 3.537 20 0 CHADHO C[N@@H+](Cc1cccc(-c2ccccc2)c1)C1CCNCC1 ZINC000347190926 529992750 /nfs/dbraw/zinc/99/27/50/529992750.db2.gz FKPQNVHFZWXPPT-UHFFFAOYSA-N 1 3 280.415 3.537 20 0 CHADHO CC[NH+](CC)Cc1ccccc1CNCc1ccccc1 ZINC000020129489 171018192 /nfs/dbraw/zinc/01/81/92/171018192.db2.gz WUHTTYIFNOBROI-UHFFFAOYSA-N 1 3 282.431 3.818 20 0 CHADHO C[C@@H]([NH2+]C[C@H](C)CN1CCCCC1)c1ccc(F)cc1 ZINC000038041768 174043463 /nfs/dbraw/zinc/04/34/63/174043463.db2.gz KFXAHBKCQMMYIG-LSDHHAIUSA-N 1 3 278.415 3.598 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)c1cccc(F)c1)CN1CCCCC1 ZINC000038041855 174044451 /nfs/dbraw/zinc/04/44/51/174044451.db2.gz JHPQZGMGIGCPPT-CABCVRRESA-N 1 3 278.415 3.598 20 0 CHADHO [NH3+]C[C@H]1CCCN(Cc2cccc(-c3ccccc3)c2)C1 ZINC000347088450 226045461 /nfs/dbraw/zinc/04/54/61/226045461.db2.gz FCHCJFXSBCXYMP-QGZVFWFLSA-N 1 3 280.415 3.524 20 0 CHADHO CC[NH+]1CCC(N[C@@H]2CCC(C)(C)c3ccccc32)CC1 ZINC000038098031 260125515 /nfs/dbraw/zinc/12/55/15/260125515.db2.gz QYMHCJSGSNBIQH-GOSISDBHSA-N 1 3 286.463 3.873 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]C[C@H](C)c2cccc(Cl)c2)C1 ZINC000516815504 260132800 /nfs/dbraw/zinc/13/28/00/260132800.db2.gz UGDVLMUQSIOQTL-LSDHHAIUSA-N 1 3 294.870 3.763 20 0 CHADHO CSc1ccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000091959892 260267439 /nfs/dbraw/zinc/26/74/39/260267439.db2.gz LJMYAGNKCUUPPZ-KCQAQPDRSA-N 1 3 278.465 3.542 20 0 CHADHO CSc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000091959892 260267440 /nfs/dbraw/zinc/26/74/40/260267440.db2.gz LJMYAGNKCUUPPZ-KCQAQPDRSA-N 1 3 278.465 3.542 20 0 CHADHO CC(C)C[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1ccccc1 ZINC000093212572 260273162 /nfs/dbraw/zinc/27/31/62/260273162.db2.gz VNFHCCKORQPFBW-BBWFWOEESA-N 1 3 260.425 3.633 20 0 CHADHO CCC[C@H]([NH2+][C@H]1CCN2CCC[C@H]2C1)C1CCCC1 ZINC000313428952 260293092 /nfs/dbraw/zinc/29/30/92/260293092.db2.gz OSANKKKQJWFYAB-ULQDDVLXSA-N 1 3 264.457 3.562 20 0 CHADHO C[C@H](CN[C@@H]1C[C@@H](C)c2ccccc21)C[NH+]1CCCC1 ZINC000313585308 260303337 /nfs/dbraw/zinc/30/33/37/260303337.db2.gz YKVXSEWYLRDOJQ-IIDMSEBBSA-N 1 3 272.436 3.556 20 0 CHADHO C[C@H](C[NH2+][C@@H]1C[C@@H](C)c2ccccc21)CN1CCCC1 ZINC000313585308 260303338 /nfs/dbraw/zinc/30/33/38/260303338.db2.gz YKVXSEWYLRDOJQ-IIDMSEBBSA-N 1 3 272.436 3.556 20 0 CHADHO C[C@@H]1CC[C@H](NCCC[NH+]2CCCC2)c2ccccc21 ZINC000126474255 260353321 /nfs/dbraw/zinc/35/33/21/260353321.db2.gz HSVYGUZZRBZOFC-QAPCUYQASA-N 1 3 272.436 3.701 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]CCCN2CCCC2)c2ccccc21 ZINC000126474255 260353322 /nfs/dbraw/zinc/35/33/22/260353322.db2.gz HSVYGUZZRBZOFC-QAPCUYQASA-N 1 3 272.436 3.701 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2cc3ccccc3s2)C1 ZINC000126480151 260353482 /nfs/dbraw/zinc/35/34/82/260353482.db2.gz CMYIBNHVVWYMGC-KBPBESRZSA-N 1 3 288.460 3.894 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@@H](C)c2cc3ccccc3s2)C1 ZINC000126480151 260353484 /nfs/dbraw/zinc/35/34/84/260353484.db2.gz CMYIBNHVVWYMGC-KBPBESRZSA-N 1 3 288.460 3.894 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@@H](C)c2cc3ccccc3s2)C1 ZINC000126480151 260353486 /nfs/dbraw/zinc/35/34/86/260353486.db2.gz CMYIBNHVVWYMGC-KBPBESRZSA-N 1 3 288.460 3.894 20 0 CHADHO CC(C)(C)N1CCC([NH2+][C@H]2CCc3cc(F)ccc32)CC1 ZINC000129973822 260392007 /nfs/dbraw/zinc/39/20/07/260392007.db2.gz MDCVGBCBUOZKJT-KRWDZBQOSA-N 1 3 290.426 3.666 20 0 CHADHO CC(C)CN1CCC([NH2+][C@H](C)c2cccs2)CC1 ZINC000154474905 261092223 /nfs/dbraw/zinc/09/22/23/261092223.db2.gz OSVVZAPXNCTUFT-CYBMUJFWSA-N 1 3 266.454 3.519 20 0 CHADHO C[C@@H]1C[C@@H]1C[NH2+]C1CCN(C(C)(C)CC(C)(C)C)CC1 ZINC000449078336 261151589 /nfs/dbraw/zinc/15/15/89/261151589.db2.gz LYNLQALNDWUPFH-HUUCEWRRSA-N 1 3 280.500 3.911 20 0 CHADHO C[C@@H]1C[C@@H]1CNC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449078336 261151591 /nfs/dbraw/zinc/15/15/91/261151591.db2.gz LYNLQALNDWUPFH-HUUCEWRRSA-N 1 3 280.500 3.911 20 0 CHADHO Cc1cncc([C@H](C)NCCCC[NH+]2CCC(C)CC2)c1 ZINC000184281361 262014771 /nfs/dbraw/zinc/01/47/71/262014771.db2.gz ZLCLRRDOGKEJLX-KRWDZBQOSA-N 1 3 289.467 3.553 20 0 CHADHO Cc1cncc([C@@H](C)NCCCC[NH+]2CCC(C)CC2)c1 ZINC000184281346 262015061 /nfs/dbraw/zinc/01/50/61/262015061.db2.gz ZLCLRRDOGKEJLX-QGZVFWFLSA-N 1 3 289.467 3.553 20 0 CHADHO CCC1CCC([NH2+]CCCN2CCCC[C@@H]2C)CC1 ZINC000020555354 262250819 /nfs/dbraw/zinc/25/08/19/262250819.db2.gz AQJBSSDVQNZFSN-GTPINHCMSA-N 1 3 266.473 3.809 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H]2CS[C@@H](C(C)(C)C)C2)C1 ZINC000488449049 262324660 /nfs/dbraw/zinc/32/46/60/262324660.db2.gz OMGVIBYKJAIXSW-OWCLPIDISA-N 1 3 298.540 3.617 20 0 CHADHO CC(C)[N@@H+]1CCC[C@H](CN[C@@H]2CS[C@@H](C(C)(C)C)C2)C1 ZINC000488449049 262324662 /nfs/dbraw/zinc/32/46/62/262324662.db2.gz OMGVIBYKJAIXSW-OWCLPIDISA-N 1 3 298.540 3.617 20 0 CHADHO CC(C)[N@H+]1CCC[C@H](CN[C@@H]2CS[C@@H](C(C)(C)C)C2)C1 ZINC000488449049 262324664 /nfs/dbraw/zinc/32/46/64/262324664.db2.gz OMGVIBYKJAIXSW-OWCLPIDISA-N 1 3 298.540 3.617 20 0 CHADHO CCOc1ccc([C@H](C)[NH2+]CCCN2CCCCC2)cc1 ZINC000021056100 262375955 /nfs/dbraw/zinc/37/59/55/262375955.db2.gz MMGDLYZPTPONBS-INIZCTEOSA-N 1 3 290.451 3.612 20 0 CHADHO CC(C)C[C@H]([NH3+])CNC(C)(C)Cc1ccccc1Cl ZINC000414699079 263033139 /nfs/dbraw/zinc/03/31/39/263033139.db2.gz DXSNWPDLMQERCR-AWEZNQCLSA-N 1 3 282.859 3.624 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCCC[C@H]1CN)c1cccc(Cl)c1 ZINC000414791460 263048798 /nfs/dbraw/zinc/04/87/98/263048798.db2.gz BFQPZZTZMOXGOS-INWMFGNUSA-N 1 3 280.843 3.551 20 0 CHADHO CCC([NH3+])(CC)CN[C@H]1CC[C@](C)(c2ccccc2)C1 ZINC000414810413 263052806 /nfs/dbraw/zinc/05/28/06/263052806.db2.gz NVCRQLOFOBSCDS-IRXDYDNUSA-N 1 3 274.452 3.604 20 0 CHADHO CCC([NH3+])(CC)CN[C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000414810411 263052922 /nfs/dbraw/zinc/05/29/22/263052922.db2.gz NVCRQLOFOBSCDS-DLBZAZTESA-N 1 3 274.452 3.604 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CNCc2cccc(Cl)c2)cc1 ZINC000414813616 263053214 /nfs/dbraw/zinc/05/32/14/263053214.db2.gz UGNHKDLRGWUTJQ-GFCCVEGCSA-N 1 3 274.795 3.650 20 0 CHADHO C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCNC2)C[C@@H](c2ccccc2)C1 ZINC000414827889 263055782 /nfs/dbraw/zinc/05/57/82/263055782.db2.gz KWIBBKUEVHMRDG-NBMJBFSESA-N 1 3 286.463 3.548 20 0 CHADHO Clc1scc(CNCC[C@H]2CCC[NH2+]C2)c1Cl ZINC000414835833 263057071 /nfs/dbraw/zinc/05/70/71/263057071.db2.gz IQGXQGREIWHPOW-SECBINFHSA-N 1 3 293.263 3.534 20 0 CHADHO C[C@@H](CCC1CCCCC1)NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414840295 263057567 /nfs/dbraw/zinc/05/75/67/263057567.db2.gz YNFHAZYBXBOFHK-JTUUTPGSSA-N 1 3 264.457 3.608 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000282997874 263080190 /nfs/dbraw/zinc/08/01/90/263080190.db2.gz GAAOFOSRQFDAPP-NEPXVJNWSA-N 1 3 286.463 3.500 20 0 CHADHO C[N@@H+]1CCC[C@H]1CCN(C1CC1)[C@H]1CCc2ccccc21 ZINC000340370031 263119910 /nfs/dbraw/zinc/11/99/10/263119910.db2.gz KIDCMCUBBWSWDS-LPHOPBHVSA-N 1 3 284.447 3.623 20 0 CHADHO C[N@H+]1CCC[C@H]1CCN(C1CC1)[C@H]1CCc2ccccc21 ZINC000340370031 263119911 /nfs/dbraw/zinc/11/99/11/263119911.db2.gz KIDCMCUBBWSWDS-LPHOPBHVSA-N 1 3 284.447 3.623 20 0 CHADHO C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@@H]2CCN[C@@H](C)C2)C1 ZINC000414927869 263133372 /nfs/dbraw/zinc/13/33/72/263133372.db2.gz AGZBNKSNSDKNFP-OBQKDBCYSA-N 1 3 286.463 3.689 20 0 CHADHO CC1([NH2+]CC2CCC(c3ccccc3)CC2)CCNCC1 ZINC000414945852 263155075 /nfs/dbraw/zinc/15/50/75/263155075.db2.gz SIUXFLITWJZGHM-UHFFFAOYSA-N 1 3 286.463 3.692 20 0 CHADHO Clc1ccc(Cl)c(CNCCC[C@H]2CCC[NH2+]2)c1 ZINC000414966520 263169679 /nfs/dbraw/zinc/16/96/79/263169679.db2.gz GMNBVVZEBFVNGA-ZDUSSCGKSA-N 1 3 287.234 3.615 20 0 CHADHO [NH3+][C@H]1CCC[C@@H](CNCc2cccc(Cl)c2Cl)C1 ZINC000414985937 263183125 /nfs/dbraw/zinc/18/31/25/263183125.db2.gz BWJQMCXDPQAUIH-PWSUYJOCSA-N 1 3 287.234 3.601 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](CNCc2ccc(Cl)cc2Cl)C1 ZINC000414992515 263188963 /nfs/dbraw/zinc/18/89/63/263188963.db2.gz KORQASDGHBJVRG-ZWNOBZJWSA-N 1 3 287.234 3.601 20 0 CHADHO CCC[C@H](CC)[NH2+]C[C@@H]1CNCC[C@@H]1c1ccc(F)cc1 ZINC000415005700 263215784 /nfs/dbraw/zinc/21/57/84/263215784.db2.gz POUXMZCRUWYBSW-RYQLBKOJSA-N 1 3 292.442 3.687 20 0 CHADHO C[C@H](CCCC[NH3+])NCc1cccc(Cl)c1Cl ZINC000415015635 263255524 /nfs/dbraw/zinc/25/55/24/263255524.db2.gz OMMJGVWHEZCAOR-SNVBAGLBSA-N 1 3 275.223 3.601 20 0 CHADHO COc1cc(CN[C@H](CCC[NH3+])c2ccccc2)ccc1C ZINC000415047577 263258110 /nfs/dbraw/zinc/25/81/10/263258110.db2.gz DZELRMDEEMQMAC-GOSISDBHSA-N 1 3 298.430 3.573 20 0 CHADHO [NH3+]CCC[C@H](NCc1cc(Cl)cs1)c1ccccc1 ZINC000415056700 263258585 /nfs/dbraw/zinc/25/85/85/263258585.db2.gz QJSVTAWFBZTGNK-HNNXBMFYSA-N 1 3 294.851 3.971 20 0 CHADHO CCc1ccc(CN[C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000415062241 263258746 /nfs/dbraw/zinc/25/87/46/263258746.db2.gz FASRMNNCRAVYMZ-IBGZPJMESA-N 1 3 282.431 3.819 20 0 CHADHO Cc1ccc(F)cc1CN[C@@H](CCC[NH3+])c1ccccc1 ZINC000415055382 263258770 /nfs/dbraw/zinc/25/87/70/263258770.db2.gz OQLBVCJQGPBKQY-SFHVURJKSA-N 1 3 286.394 3.704 20 0 CHADHO Cc1ccccc1CN[C@H](CCC[NH3+])c1ccccc1 ZINC000415067437 263259652 /nfs/dbraw/zinc/25/96/52/263259652.db2.gz PETWBJHWWJCWMY-GOSISDBHSA-N 1 3 268.404 3.565 20 0 CHADHO Cc1ccccc1CN[C@@H](CCC[NH3+])c1ccccc1 ZINC000415067438 263259827 /nfs/dbraw/zinc/25/98/27/263259827.db2.gz PETWBJHWWJCWMY-SFHVURJKSA-N 1 3 268.404 3.565 20 0 CHADHO CC(C)C[C@H]([NH3+])CNCC(c1ccccc1)c1ccccc1 ZINC000415078157 263268341 /nfs/dbraw/zinc/26/83/41/263268341.db2.gz FQZGRPOHNGUROB-IBGZPJMESA-N 1 3 296.458 3.782 20 0 CHADHO CCc1ccccc1CN[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415084914 263268642 /nfs/dbraw/zinc/26/86/42/263268642.db2.gz PFEOUKHXRSPGME-UXHICEINSA-N 1 3 294.442 3.832 20 0 CHADHO c1ccc(C[C@@H](N[C@@H]2CCC[NH2+]CC2)c2ccccc2)cc1 ZINC000415088423 263271243 /nfs/dbraw/zinc/27/12/43/263271243.db2.gz LYEYWNNDXOXJJU-WOJBJXKFSA-N 1 3 294.442 3.702 20 0 CHADHO Cc1ccccc1[C@@H](CC(C)C)NC[C@H]1CCC[NH2+]C1 ZINC000415112989 263273184 /nfs/dbraw/zinc/27/31/84/263273184.db2.gz SCBLSHAUSPYIFU-FUHWJXTLSA-N 1 3 274.452 3.671 20 0 CHADHO Cc1ccccc1[C@@H](CC(C)C)[NH2+]C[C@H]1CCCNC1 ZINC000415112989 263273185 /nfs/dbraw/zinc/27/31/85/263273185.db2.gz SCBLSHAUSPYIFU-FUHWJXTLSA-N 1 3 274.452 3.671 20 0 CHADHO CC(C)[N@H+](C)Cc1cccc(CNCc2ccsc2)c1 ZINC000065976585 265006831 /nfs/dbraw/zinc/00/68/31/265006831.db2.gz HGUWGKYUYZHLOV-UHFFFAOYSA-N 1 3 288.460 3.878 20 0 CHADHO CC(C)[N@@H+](C)Cc1cccc(CNCc2ccsc2)c1 ZINC000065976585 265006834 /nfs/dbraw/zinc/00/68/34/265006834.db2.gz HGUWGKYUYZHLOV-UHFFFAOYSA-N 1 3 288.460 3.878 20 0 CHADHO CN(C)Cc1cccc(C[NH2+]C[C@H]2C[C@H]2c2ccccc2)c1 ZINC000348242791 265147632 /nfs/dbraw/zinc/14/76/32/265147632.db2.gz LCSMAOMRIDEQEH-UXHICEINSA-N 1 3 294.442 3.642 20 0 CHADHO CC1(C)CC[C@@H](NC[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc21 ZINC000314691659 265178215 /nfs/dbraw/zinc/17/82/15/265178215.db2.gz LSLWAVKKQCMVFL-DNVCBOLYSA-N 1 3 298.474 3.873 20 0 CHADHO CC1(C)CC[C@@H](NC[C@H]2CC[N@H+](C3CC3)C2)c2ccccc21 ZINC000314691659 265178216 /nfs/dbraw/zinc/17/82/16/265178216.db2.gz LSLWAVKKQCMVFL-DNVCBOLYSA-N 1 3 298.474 3.873 20 0 CHADHO C[C@H](CCN[C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1)c1ccccc1 ZINC000093453206 265180290 /nfs/dbraw/zinc/18/02/90/265180290.db2.gz UXHZJVVKWSRGPE-LULLPPNCSA-N 1 3 286.463 3.691 20 0 CHADHO CC(C)(C[NH2+][C@H]1CCCc2sccc21)CN1CCCC1 ZINC000357851045 266376843 /nfs/dbraw/zinc/37/68/43/266376843.db2.gz NCFZGPSGUPYFKH-HNNXBMFYSA-N 1 3 292.492 3.837 20 0 CHADHO CC[C@H](c1ccccc1)[NH+]1CCC2(CCCN2C)CC1 ZINC000369384821 267239303 /nfs/dbraw/zinc/23/93/03/267239303.db2.gz UPIMNAXHJMULEK-QGZVFWFLSA-N 1 3 272.436 3.698 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H]([NH2+][C@@H]2CCN3CCC[C@@H]3C2)C1 ZINC000370477719 267321091 /nfs/dbraw/zinc/32/10/91/267321091.db2.gz QAULIHDZGHNSEV-WCIQWLHISA-N 1 3 298.474 3.713 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H](N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000370477719 267321093 /nfs/dbraw/zinc/32/10/93/267321093.db2.gz QAULIHDZGHNSEV-WCIQWLHISA-N 1 3 298.474 3.713 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H](N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)C1 ZINC000370477719 267321095 /nfs/dbraw/zinc/32/10/95/267321095.db2.gz QAULIHDZGHNSEV-WCIQWLHISA-N 1 3 298.474 3.713 20 0 CHADHO CC[C@@H](NCc1ccc(C[NH3+])cc1)c1cccc(C)c1 ZINC000570928765 327635468 /nfs/dbraw/zinc/63/54/68/327635468.db2.gz OQMYRADYIKGVDH-GOSISDBHSA-N 1 3 268.404 3.695 20 0 CHADHO CC(C)=CCC[C@@H](C)[NH2+]Cc1cccc(CN(C)C)c1 ZINC000531688001 328021564 /nfs/dbraw/zinc/02/15/64/328021564.db2.gz BQKYJFRXWOONMU-MRXNPFEDSA-N 1 3 274.452 3.973 20 0 CHADHO CC(C)CCC[NH2+][C@H](C)c1ccc(OCCN(C)C)cc1 ZINC000531687243 328022759 /nfs/dbraw/zinc/02/27/59/328022759.db2.gz BMZMEZIDICKYSL-MRXNPFEDSA-N 1 3 292.467 3.714 20 0 CHADHO CSC1(CNC2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)CC1 ZINC000193818508 329063110 /nfs/dbraw/zinc/06/31/10/329063110.db2.gz UYZQXAIIANLGCI-HOCLYGCPSA-N 1 3 296.524 3.515 20 0 CHADHO CSC1(C[NH2+]C2CCN([C@H]3CCC[C@H](C)C3)CC2)CC1 ZINC000193818508 329063112 /nfs/dbraw/zinc/06/31/12/329063112.db2.gz UYZQXAIIANLGCI-HOCLYGCPSA-N 1 3 296.524 3.515 20 0 CHADHO Cc1occc1CN1CCC(CCC[NH+]2CCCC2)CC1 ZINC000414413136 328166199 /nfs/dbraw/zinc/16/61/99/328166199.db2.gz RVDHGANSHQQVJK-UHFFFAOYSA-N 1 3 290.451 3.676 20 0 CHADHO C[N@H+]([C@@H]1CC[C@@](C)(c2ccccc2)C1)[C@@H]1CCCNCC1 ZINC000414754742 328220231 /nfs/dbraw/zinc/22/02/31/328220231.db2.gz SCZHGSWZSQHRDX-GUDVDZBRSA-N 1 3 286.463 3.571 20 0 CHADHO C[N@@H+]([C@@H]1CC[C@@](C)(c2ccccc2)C1)[C@@H]1CCCNCC1 ZINC000414754742 328220232 /nfs/dbraw/zinc/22/02/32/328220232.db2.gz SCZHGSWZSQHRDX-GUDVDZBRSA-N 1 3 286.463 3.571 20 0 CHADHO C[C@@H]1C[C@H]([NH2+]C2CCC(C)(c3ccccc3)CC2)CCN1 ZINC000414955846 328280157 /nfs/dbraw/zinc/28/01/57/328280157.db2.gz UTQTVNYBQYEESI-ZTRSQXPZSA-N 1 3 286.463 3.617 20 0 CHADHO C[C@H]1C[C@H]([NH2+]C2CCC(C)(c3ccccc3)CC2)CCN1 ZINC000414955845 328280167 /nfs/dbraw/zinc/28/01/67/328280167.db2.gz UTQTVNYBQYEESI-WEOZKBJRSA-N 1 3 286.463 3.617 20 0 CHADHO [NH3+][C@H]1CCC[C@@H](CNCc2c(Cl)oc3ccccc32)C1 ZINC000414995356 328290631 /nfs/dbraw/zinc/29/06/31/328290631.db2.gz FLKAVNQHRMWJEU-NEPJUHHUSA-N 1 3 292.810 3.693 20 0 CHADHO CC(C)(C)CC[NH2+]C1CCN(CC2CCCC2)CC1 ZINC000187764894 328302141 /nfs/dbraw/zinc/30/21/41/328302141.db2.gz WGONZGIPRZCGBK-UHFFFAOYSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@H]1CCC[C@H](C)C1[NH2+]Cc1ccc(CN(C)C)cc1 ZINC000531944500 328323342 /nfs/dbraw/zinc/32/33/42/328323342.db2.gz XVQYUVTZQLQNGJ-GJZGRUSLSA-N 1 3 274.452 3.663 20 0 CHADHO C[C@H]1Cc2ccccc2[C@@H]1NCc1ccc(C[NH+](C)C)cc1 ZINC000111410928 328354603 /nfs/dbraw/zinc/35/46/03/328354603.db2.gz CWRVUUXHIQGKMF-MGPUTAFESA-N 1 3 294.442 3.771 20 0 CHADHO C[C@H]1Cc2ccccc2[C@@H]1[NH2+]Cc1ccc(CN(C)C)cc1 ZINC000111410928 328354604 /nfs/dbraw/zinc/35/46/04/328354604.db2.gz CWRVUUXHIQGKMF-MGPUTAFESA-N 1 3 294.442 3.771 20 0 CHADHO C[N@@H+]1CCC[C@@H]1CCN1CCC[C@@](C)(c2ccccc2)C1 ZINC000534758348 328360298 /nfs/dbraw/zinc/36/02/98/328360298.db2.gz YURUMEHRKCVCIL-RTBURBONSA-N 1 3 286.463 3.524 20 0 CHADHO C[N@H+]1CCC[C@@H]1CCN1CCC[C@@](C)(c2ccccc2)C1 ZINC000534758348 328360300 /nfs/dbraw/zinc/36/03/00/328360300.db2.gz YURUMEHRKCVCIL-RTBURBONSA-N 1 3 286.463 3.524 20 0 CHADHO C[C@H](c1cccc(Cl)c1)[N@H+](C)CC[C@H]1CCCN1C ZINC000534757887 328360410 /nfs/dbraw/zinc/36/04/10/328360410.db2.gz DQUHVGOGBBLCPR-CZUORRHYSA-N 1 3 280.843 3.817 20 0 CHADHO C[C@H](c1cccc(Cl)c1)[N@@H+](C)CC[C@H]1CCCN1C ZINC000534757887 328360412 /nfs/dbraw/zinc/36/04/12/328360412.db2.gz DQUHVGOGBBLCPR-CZUORRHYSA-N 1 3 280.843 3.817 20 0 CHADHO C[N@@H+]1CCC[C@@H](CN[C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000534973200 328372329 /nfs/dbraw/zinc/37/23/29/328372329.db2.gz BZPBISDWAUXOKP-GUYCJALGSA-N 1 3 292.854 3.649 20 0 CHADHO C[N@H+]1CCC[C@@H](CN[C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000534973200 328372330 /nfs/dbraw/zinc/37/23/30/328372330.db2.gz BZPBISDWAUXOKP-GUYCJALGSA-N 1 3 292.854 3.649 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)c1ccc(Cl)cc1 ZINC000531993597 328386080 /nfs/dbraw/zinc/38/60/80/328386080.db2.gz HSFKBZNHZQEALB-RCBQFDQVSA-N 1 3 280.843 3.863 20 0 CHADHO C[N@@H+]1CCC[C@H](CNCc2ccc(C3CCCC3)cc2)C1 ZINC000584206188 327064130 /nfs/dbraw/zinc/06/41/30/327064130.db2.gz JPGPXGGOQUEBEC-QGZVFWFLSA-N 1 3 286.463 3.776 20 0 CHADHO C[N@H+]1CCC[C@H](CNCc2ccc(C3CCCC3)cc2)C1 ZINC000584206188 327064131 /nfs/dbraw/zinc/06/41/31/327064131.db2.gz JPGPXGGOQUEBEC-QGZVFWFLSA-N 1 3 286.463 3.776 20 0 CHADHO C1CC1[C@H]1CC[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000558241309 327080764 /nfs/dbraw/zinc/08/07/64/327080764.db2.gz NSKAELOJOURVIK-QZTJIDSGSA-N 1 3 276.468 3.562 20 0 CHADHO c1ccc2c(c1)cccc2CN[C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000262063949 327128745 /nfs/dbraw/zinc/12/87/45/327128745.db2.gz FIAHUVNZWQACRY-HSALFYBXSA-N 1 3 294.442 3.850 20 0 CHADHO C[C@@H](c1ccccc1Cl)N(C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000261567167 327142427 /nfs/dbraw/zinc/14/24/27/327142427.db2.gz HPUOHNFHOKPNHY-RDBSUJKOSA-N 1 3 280.843 3.721 20 0 CHADHO Cc1ccccc1[C@H](C)[NH+]1CCC2(CCCN2C)CC1 ZINC000374612299 327237430 /nfs/dbraw/zinc/23/74/30/327237430.db2.gz LYNCAMQHADXSNS-INIZCTEOSA-N 1 3 272.436 3.616 20 0 CHADHO CN1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2cccc3ccccc32)C1 ZINC000559504525 327251360 /nfs/dbraw/zinc/25/13/60/327251360.db2.gz FOECVVVSBUZJJK-AZUAARDMSA-N 1 3 294.442 3.756 20 0 CHADHO CN1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2cccc3ccccc32)C1 ZINC000559504525 327251361 /nfs/dbraw/zinc/25/13/61/327251361.db2.gz FOECVVVSBUZJJK-AZUAARDMSA-N 1 3 294.442 3.756 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@H]1N[C@H](c1cccs1)C1CCCC1 ZINC000261600068 327258463 /nfs/dbraw/zinc/25/84/63/327258463.db2.gz PTJFUDZUCOZZGI-XPKDYRNWSA-N 1 3 278.465 3.567 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@H](c1cccs1)C1CCCC1 ZINC000261600068 327258465 /nfs/dbraw/zinc/25/84/65/327258465.db2.gz PTJFUDZUCOZZGI-XPKDYRNWSA-N 1 3 278.465 3.567 20 0 CHADHO C[C@@H]1CCC[C@H](N[C@@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC000261573616 327384804 /nfs/dbraw/zinc/38/48/04/327384804.db2.gz VTMIVTFQRSATCS-DLTLXFJOSA-N 1 3 258.409 3.690 20 0 CHADHO C[C@@H]1CCC[C@H](N[C@@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC000261573619 327384812 /nfs/dbraw/zinc/38/48/12/327384812.db2.gz VTMIVTFQRSATCS-OSRSDYAFSA-N 1 3 258.409 3.690 20 0 CHADHO C[C@@H](CC[NH2+]CCCN1CCCCC1)c1ccccc1 ZINC000043532938 328802073 /nfs/dbraw/zinc/80/20/73/328802073.db2.gz KOFFCWOQRUZLIC-KRWDZBQOSA-N 1 3 274.452 3.646 20 0 CHADHO Cc1ccc2nccc(N[C@@H]3CCC[C@@H]([NH+](C)C)C3)c2c1 ZINC000302162792 328831314 /nfs/dbraw/zinc/83/13/14/328831314.db2.gz QBURYVNGKZQTPZ-HUUCEWRRSA-N 1 3 283.419 3.828 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC2(C)CCCCC2)CC1 ZINC000394666533 329126415 /nfs/dbraw/zinc/12/64/15/329126415.db2.gz QAZBMUVGXXJDDT-UHFFFAOYSA-N 1 3 266.473 3.809 20 0 CHADHO CCC[C@@H]([NH2+]CC1(CN(C)C)CCCC1)c1cccnc1 ZINC000183950603 329254956 /nfs/dbraw/zinc/25/49/56/329254956.db2.gz YWXVNSNPULMENH-QGZVFWFLSA-N 1 3 289.467 3.634 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCc1cc(-c2ccccc2)cs1 ZINC000584409735 329459709 /nfs/dbraw/zinc/45/97/09/329459709.db2.gz DEHWUZZFRZJRSM-STQMWFEESA-N 1 3 274.433 3.631 20 0 CHADHO [NH3+]CCCN[C@H](Cc1ccccc1Cl)c1ccccc1 ZINC000420377974 329763182 /nfs/dbraw/zinc/76/31/82/329763182.db2.gz TWEJEAVIDYAQCE-QGZVFWFLSA-N 1 3 288.822 3.562 20 0 CHADHO CC[C@@H]1CCC[C@H](C[N@@H+]2CCC[C@@H](N(C)C)CC2)C1 ZINC000432801295 330038192 /nfs/dbraw/zinc/03/81/92/330038192.db2.gz VIWFSUMFMQAXPT-IXDOHACOSA-N 1 3 266.473 3.619 20 0 CHADHO CC[C@@H]1CCC[C@H](C[N@H+]2CCC[C@@H](N(C)C)CC2)C1 ZINC000432801295 330038193 /nfs/dbraw/zinc/03/81/93/330038193.db2.gz VIWFSUMFMQAXPT-IXDOHACOSA-N 1 3 266.473 3.619 20 0 CHADHO C[C@@H](NCCCCC[NH+]1CCCC1)c1ccncc1Cl ZINC000421865179 330098771 /nfs/dbraw/zinc/09/87/71/330098771.db2.gz ZETZDQOFCLTEHB-CQSZACIVSA-N 1 3 295.858 3.652 20 0 CHADHO C[C@H]([NH2+]C1CCNCC1)c1ccc(-c2ccccc2)cc1 ZINC000422690533 330150739 /nfs/dbraw/zinc/15/07/39/330150739.db2.gz GPSKXLWJWFUMTA-HNNXBMFYSA-N 1 3 280.415 3.756 20 0 CHADHO CCCC[C@H](N[C@H](C)C[C@@H](C)[NH3+])c1ccc(OC)cc1 ZINC000422717973 330152207 /nfs/dbraw/zinc/15/22/07/330152207.db2.gz WHIPUWQFYNZJLA-CPUCHLNUSA-N 1 3 278.440 3.642 20 0 CHADHO Clc1ccc([C@H](N[C@@H]2CCC[NH2+]CC2)C2CC2)cc1 ZINC000422761694 330153858 /nfs/dbraw/zinc/15/38/58/330153858.db2.gz MCDXQLAFRCRDOI-HZPDHXFCSA-N 1 3 278.827 3.523 20 0 CHADHO C[C@@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc2ccccc21 ZINC000422763951 330153914 /nfs/dbraw/zinc/15/39/14/330153914.db2.gz PCEVIVKVCVLDRG-KTFSGNIMSA-N 1 3 280.415 3.773 20 0 CHADHO Cc1ccc([C@H](C)C[NH2+][C@@H](C)c2ccc(CN)nc2C)cc1 ZINC000422760665 330154050 /nfs/dbraw/zinc/15/40/50/330154050.db2.gz LCDDUKBESJDTNY-CABCVRRESA-N 1 3 297.446 3.611 20 0 CHADHO C[C@@H](NC1CCC(C[NH3+])CC1)c1ccc(F)cc1Cl ZINC000422762678 330154084 /nfs/dbraw/zinc/15/40/84/330154084.db2.gz SOPOGPOHAFZWTI-XSRFYTQQSA-N 1 3 284.806 3.647 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](Cc1ccccc1)c1ccccc1 ZINC000422768247 330154161 /nfs/dbraw/zinc/15/41/61/330154161.db2.gz RVWUEJXOOJXINE-BXWFABGCSA-N 1 3 282.431 3.686 20 0 CHADHO NC[C@@H]1CCC[C@H]1[NH2+]CC1(c2cccs2)CCCCC1 ZINC000422767940 330154407 /nfs/dbraw/zinc/15/44/07/330154407.db2.gz NHZOBVHGYJHYQR-LSDHHAIUSA-N 1 3 292.492 3.667 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCc1ccc(-c2ccccc2)cc1 ZINC000422791025 330155324 /nfs/dbraw/zinc/15/53/24/330155324.db2.gz YCRJLKSTKQQBOO-CABCVRRESA-N 1 3 268.404 3.569 20 0 CHADHO CC(C)(C)[C@@H](N[C@H]1CCC[NH2+]CC1)c1cccc(F)c1 ZINC000422839813 330157149 /nfs/dbraw/zinc/15/71/49/330157149.db2.gz RKXOJWPLCSAYNA-HOTGVXAUSA-N 1 3 278.415 3.645 20 0 CHADHO CCCC[C@@H](CCC)[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000422841001 330157193 /nfs/dbraw/zinc/15/71/93/330157193.db2.gz UZUBBECBQPXECF-UKRRQHHQSA-N 1 3 277.456 3.858 20 0 CHADHO C[C@@H](N)C[C@H](C)[NH2+]CC(C)(C)Cc1cccc(Cl)c1 ZINC000422880673 330158974 /nfs/dbraw/zinc/15/89/74/330158974.db2.gz XKYBGLQFOUUQFA-OLZOCXBDSA-N 1 3 282.859 3.624 20 0 CHADHO C[C@H]([NH3+])[C@H](Cc1ccccc1)N[C@@H]1C[C@H]1C1CCCCC1 ZINC000422917530 330160281 /nfs/dbraw/zinc/16/02/81/330160281.db2.gz GDBWDDZVPHVDBF-UDTPNQRGSA-N 1 3 286.463 3.503 20 0 CHADHO CC[C@H](CSc1ccc(C)c(C)c1)N[C@H](C)C[C@H](C)[NH3+] ZINC000422998457 330163434 /nfs/dbraw/zinc/16/34/34/330163434.db2.gz CUJMENDVHPAKEA-ARFHVFGLSA-N 1 3 294.508 3.890 20 0 CHADHO CC[C@H](CSc1ccc(C)c(C)c1)[NH2+][C@H](C)C[C@H](C)N ZINC000422998457 330163435 /nfs/dbraw/zinc/16/34/35/330163435.db2.gz CUJMENDVHPAKEA-ARFHVFGLSA-N 1 3 294.508 3.890 20 0 CHADHO CC(C)C[C@@H](N[C@H]1CCC[NH2+]CC1)c1cccs1 ZINC000422949580 330163914 /nfs/dbraw/zinc/16/39/14/330163914.db2.gz UJPLGOWCABQDDB-UONOGXRCSA-N 1 3 266.454 3.567 20 0 CHADHO [NH3+][C@H]1C[C@H](NCCC2Cc3ccccc3C2)c2ccccc21 ZINC000423017751 330165250 /nfs/dbraw/zinc/16/52/50/330165250.db2.gz WZXYFQBRDKSCFD-PMACEKPBSA-N 1 3 292.426 3.526 20 0 CHADHO CC(C)CSCCC[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCCN1 ZINC000423016813 330165295 /nfs/dbraw/zinc/16/52/95/330165295.db2.gz UQYKOSDDXXQLFF-BRWVUGGUSA-N 1 3 298.540 3.666 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]C[C@@H]1CCC(C)(C)c2ccccc21 ZINC000423020075 330165736 /nfs/dbraw/zinc/16/57/36/330165736.db2.gz YORIIUHDYAXVQG-ZNMIVQPWSA-N 1 3 274.452 3.557 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCC[C@@H](c2ccccc2)C1 ZINC000423077675 330168647 /nfs/dbraw/zinc/16/86/47/330168647.db2.gz MPHRVNFJYXNYLX-XWSJACJDSA-N 1 3 286.463 3.820 20 0 CHADHO Cc1ccc([C@@H](N[C@H](C)CCCC[NH3+])c2ccccn2)cc1 ZINC000423082599 330168741 /nfs/dbraw/zinc/16/87/41/330168741.db2.gz DNMLDOQYLBSFAQ-VQIMIIECSA-N 1 3 297.446 3.587 20 0 CHADHO CC(C)[C@@H]1C[C@@H](C[NH2+][C@@H](C)C[C@H](C)N)c2ccccc21 ZINC000423089426 330169124 /nfs/dbraw/zinc/16/91/24/330169124.db2.gz VHUPPCGYJHJYLZ-XSWJXKHESA-N 1 3 274.452 3.629 20 0 CHADHO C[C@H](C[C@@H]1CCCCC[NH2+]1)NCCc1ccc2[nH]ccc2c1 ZINC000423096655 330169771 /nfs/dbraw/zinc/16/97/71/330169771.db2.gz HXCLIBGKTHLOSW-QAPCUYQASA-N 1 3 299.462 3.611 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[C@@H](c2ccccc2F)C1 ZINC000423097616 330169945 /nfs/dbraw/zinc/16/99/45/330169945.db2.gz QWQWZSKMHBGDJD-FSZRXZPDSA-N 1 3 290.426 3.569 20 0 CHADHO C[C@@H]1CCNCC[C@H]1[NH2+][C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423100312 330170212 /nfs/dbraw/zinc/17/02/12/330170212.db2.gz VDAQLXCCIQAZMO-ODVANORSSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@@H]1CC[NH2+]CC[C@H]1N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423100312 330170213 /nfs/dbraw/zinc/17/02/13/330170213.db2.gz VDAQLXCCIQAZMO-ODVANORSSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@H](C[C@@H]1CCCCC[NH2+]1)NCC1(C(F)(F)F)CCC1 ZINC000423111254 330170882 /nfs/dbraw/zinc/17/08/82/330170882.db2.gz QKRYYFVEYOGQFD-OLZOCXBDSA-N 1 3 292.389 3.619 20 0 CHADHO C[C@@H](C[C@H]1CCCCC[NH2+]1)NCCc1cccc2[nH]ccc21 ZINC000423116840 330171040 /nfs/dbraw/zinc/17/10/40/330171040.db2.gz RSSFEDSJZFOZAD-DOTOQJQBSA-N 1 3 299.462 3.611 20 0 CHADHO [NH3+]C[C@@H]1CCCC[C@@H]1NCc1ccc2sccc2c1 ZINC000423121862 330171359 /nfs/dbraw/zinc/17/13/59/330171359.db2.gz JLIJOVGJAZRSEI-GJZGRUSLSA-N 1 3 274.433 3.508 20 0 CHADHO C[C@@]1(CN[C@@H]2C[C@@H]([NH3+])c3ccccc32)C[C@H]1c1ccccc1 ZINC000423132981 330171873 /nfs/dbraw/zinc/17/18/73/330171873.db2.gz JTUKESQKTGUGOK-NMLBUPMWSA-N 1 3 292.426 3.915 20 0 CHADHO C[C@@H]1CCNCC[C@@H]1[NH2+][C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423144800 330172501 /nfs/dbraw/zinc/17/25/01/330172501.db2.gz ICAWMACNWZFFBS-WBOJAVRRSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@@H]1CC[NH2+]CC[C@@H]1N[C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423144800 330172502 /nfs/dbraw/zinc/17/25/02/330172502.db2.gz ICAWMACNWZFFBS-WBOJAVRRSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@H]1CCNCC[C@@H]1[NH2+][C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423144801 330172604 /nfs/dbraw/zinc/17/26/04/330172604.db2.gz ICAWMACNWZFFBS-WSMBLCCSSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@H]1CC[NH2+]CC[C@@H]1N[C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423144801 330172606 /nfs/dbraw/zinc/17/26/06/330172606.db2.gz ICAWMACNWZFFBS-WSMBLCCSSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](c1ccc(F)c(Cl)c1)C1CC1 ZINC000423153446 330173109 /nfs/dbraw/zinc/17/31/09/330173109.db2.gz GNSOWCPLJIQVTQ-AMJWSMQMSA-N 1 3 284.806 3.646 20 0 CHADHO C[C@H](N[C@@H]1CC[C@@H](c2cccc(Cl)c2)C1)[C@@H]1CC[NH2+]C1 ZINC000423160712 330173702 /nfs/dbraw/zinc/17/37/02/330173702.db2.gz HQUYIPCZCHTOHJ-DPAVQSFQSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@H](N[C@@H]1CC[C@H](c2cccc(Cl)c2)C1)[C@H]1CC[NH2+]C1 ZINC000423160714 330173754 /nfs/dbraw/zinc/17/37/54/330173754.db2.gz HQUYIPCZCHTOHJ-NZUILWFCSA-N 1 3 292.854 3.564 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C[C@@H]1CCCC(C)(C)C1 ZINC000423165680 330173853 /nfs/dbraw/zinc/17/38/53/330173853.db2.gz QBLFUPDPNRBDTC-UKRRQHHQSA-N 1 3 289.467 3.716 20 0 CHADHO Clc1cccc([C@@H]2CC[C@H]([NH2+][C@@H]3CCCNCC3)C2)c1 ZINC000423165818 330173877 /nfs/dbraw/zinc/17/38/77/330173877.db2.gz QJVMJPYPRYTHHE-OIISXLGYSA-N 1 3 292.854 3.708 20 0 CHADHO [NH3+][C@@H]1C[C@H](NC[C@@H]2CCC[C@H]2C2CC2)c2ccccc21 ZINC000423169663 330174149 /nfs/dbraw/zinc/17/41/49/330174149.db2.gz JYTJKUPNPFUKMK-ZZCKCESHSA-N 1 3 270.420 3.547 20 0 CHADHO C[C@H](CCCc1cccnc1)N[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423171750 330174431 /nfs/dbraw/zinc/17/44/31/330174431.db2.gz PVZPFEOLTXBXDA-ZMYBRWDISA-N 1 3 295.430 3.527 20 0 CHADHO CC(C)CCC[C@H]([NH2+]C1CCNCC1)c1ccccc1 ZINC000423178736 330174982 /nfs/dbraw/zinc/17/49/82/330174982.db2.gz GMKKWOPOULIMBI-SFHVURJKSA-N 1 3 274.452 3.896 20 0 CHADHO CC1(C)[C@@H](c2ccccc2)C[C@@H]1NCC1([NH3+])CCCCC1 ZINC000423176627 330175207 /nfs/dbraw/zinc/17/52/07/330175207.db2.gz HJXWXYMTBCWIRB-SJORKVTESA-N 1 3 286.463 3.820 20 0 CHADHO C[C@H](NCCC[NH3+])c1ccc(-c2c(F)cccc2F)cc1 ZINC000423189659 330175645 /nfs/dbraw/zinc/17/56/45/330175645.db2.gz NAAGDPQGUSRZHG-LBPRGKRZSA-N 1 3 290.357 3.631 20 0 CHADHO NCCC[NH2+][C@H]1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000423195483 330176232 /nfs/dbraw/zinc/17/62/32/330176232.db2.gz SQQJHGKPVNJSOD-CVEARBPZSA-N 1 3 280.843 3.695 20 0 CHADHO Clc1ccc2c(c1)[C@H](NC[C@H]1CCC[NH2+]C1)CCCC2 ZINC000423221223 330179440 /nfs/dbraw/zinc/17/94/40/330179440.db2.gz ZJPOBPFXRJRIER-SUMWQHHRSA-N 1 3 292.854 3.697 20 0 CHADHO C[C@H]([NH3+])CCN[C@@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423226020 330180365 /nfs/dbraw/zinc/18/03/65/330180365.db2.gz PCYLQPMBRXANJG-NHYWBVRUSA-N 1 3 266.816 3.508 20 0 CHADHO C[C@H]([NH3+])CCN[C@@H]1CCCc2c3ccccc3sc21 ZINC000423228246 330180492 /nfs/dbraw/zinc/18/04/92/330180492.db2.gz YWYWASGKLSDDBM-SMDDNHRTSA-N 1 3 274.433 3.606 20 0 CHADHO C[C@H](NCC[C@H]1CC[NH2+]C1)c1cc(Cl)ccc1Cl ZINC000423249618 330182505 /nfs/dbraw/zinc/18/25/05/330182505.db2.gz PAIVBGVLWKEHBB-WDEREUQCSA-N 1 3 287.234 3.644 20 0 CHADHO CC(C)Sc1ccc([C@@H](C)[NH2+]C[C@@H](N)C(C)C)cc1 ZINC000423264512 330184132 /nfs/dbraw/zinc/18/41/32/330184132.db2.gz CCUYOZMTEWARBQ-CZUORRHYSA-N 1 3 280.481 3.821 20 0 CHADHO CC(C)([NH3+])CN[C@H]1CCC[C@H](c2cccc(Cl)c2)C1 ZINC000423286663 330186090 /nfs/dbraw/zinc/18/60/90/330186090.db2.gz IAJORBBHTIXZIZ-ZFWWWQNUSA-N 1 3 280.843 3.693 20 0 CHADHO CCC[C@H]([NH2+]CC(C)(C)N)c1ccc(Cl)cc1 ZINC000423287914 330186183 /nfs/dbraw/zinc/18/61/83/330186183.db2.gz PHLBMPRPMMQAJA-ZDUSSCGKSA-N 1 3 254.805 3.508 20 0 CHADHO CCOc1ccc([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000423289843 330186498 /nfs/dbraw/zinc/18/64/98/330186498.db2.gz BRBUWGSHTFDUBZ-GJZGRUSLSA-N 1 3 298.430 3.956 20 0 CHADHO CCC(N)(CC)C[NH2+][C@H]1CCCc2c3ccccc3[nH]c21 ZINC000423290530 330186711 /nfs/dbraw/zinc/18/67/11/330186711.db2.gz DJJXRHUSAFOTMD-INIZCTEOSA-N 1 3 285.435 3.652 20 0 CHADHO COc1ccc([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)c(C)c1 ZINC000423291059 330187132 /nfs/dbraw/zinc/18/71/32/330187132.db2.gz GMWBCJYAUVGWKH-HUUCEWRRSA-N 1 3 298.430 3.874 20 0 CHADHO COc1ccc([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)c(C)c1 ZINC000423291057 330187185 /nfs/dbraw/zinc/18/71/85/330187185.db2.gz GMWBCJYAUVGWKH-CABCVRRESA-N 1 3 298.430 3.874 20 0 CHADHO CCC(N)(CC)C[NH2+][C@H]1CC[C@H](C)c2ccsc21 ZINC000423291763 330187442 /nfs/dbraw/zinc/18/74/42/330187442.db2.gz JTDBVEAPBXBGIS-AAEUAGOBSA-N 1 3 266.454 3.794 20 0 CHADHO CO[C@H](c1ccccc1)[C@H](C)NCc1ccc([C@H](C)[NH3+])cc1 ZINC000423292411 330187448 /nfs/dbraw/zinc/18/74/48/330187448.db2.gz MWPFYBGHDQRWFI-DOXZYTNZSA-N 1 3 298.430 3.572 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@H]2CCCc3c(O)cccc32)cc1 ZINC000423293109 330187672 /nfs/dbraw/zinc/18/76/72/330187672.db2.gz PSTVWYWNZXYSKH-UGSOOPFHSA-N 1 3 296.414 3.579 20 0 CHADHO CCCC[C@H](CN)[NH2+][C@@H](C)c1cc2ccccc2o1 ZINC000423297980 330188665 /nfs/dbraw/zinc/18/86/65/330188665.db2.gz MQADDLXJPRUWDM-GXTWGEPZSA-N 1 3 260.381 3.601 20 0 CHADHO C[C@@H](C[NH3+])CN[C@@H](C)c1ccc(-c2ccccc2F)s1 ZINC000423298264 330188898 /nfs/dbraw/zinc/18/88/98/330188898.db2.gz NVCQVYFLWPFSMS-RYUDHWBXSA-N 1 3 292.423 3.800 20 0 CHADHO Cc1ccsc1[C@@H](Cc1ccccc1)NC[C@H](C)C[NH3+] ZINC000423303062 330188941 /nfs/dbraw/zinc/18/89/41/330188941.db2.gz WMFPCHHDOXFEQD-CZUORRHYSA-N 1 3 288.460 3.525 20 0 CHADHO Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]C[C@H](C)CN ZINC000423303062 330188942 /nfs/dbraw/zinc/18/89/42/330188942.db2.gz WMFPCHHDOXFEQD-CZUORRHYSA-N 1 3 288.460 3.525 20 0 CHADHO C[C@H](CN)C[NH2+][C@@H]1CCC[C@H](c2cccc(Cl)c2)C1 ZINC000423309521 330189470 /nfs/dbraw/zinc/18/94/70/330189470.db2.gz PYFCOOKGWWTKCQ-IVMMDQJWSA-N 1 3 280.843 3.551 20 0 CHADHO CCC[C@@H]([NH2+]CC1(N)CCC1)c1ccc(Cl)cc1 ZINC000423324102 330190610 /nfs/dbraw/zinc/19/06/10/330190610.db2.gz KFSPAHXIEDTJBF-CQSZACIVSA-N 1 3 266.816 3.652 20 0 CHADHO Clc1ccc([C@@H]2CCC[C@@H](NC[C@@H]3CC[NH2+]C3)C2)cc1 ZINC000423328489 330191053 /nfs/dbraw/zinc/19/10/53/330191053.db2.gz DSJPOHXDZQHUDP-FRFSOERESA-N 1 3 292.854 3.565 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]C[C@]1(C)CCCNC1 ZINC000423333594 330191405 /nfs/dbraw/zinc/19/14/05/330191405.db2.gz HWDYVQZRLXCNQF-GRDNDAEWSA-N 1 3 294.870 3.811 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]C[C@@]1(C)CCCNC1 ZINC000423333597 330191589 /nfs/dbraw/zinc/19/15/89/330191589.db2.gz HWDYVQZRLXCNQF-ZQIUZPCESA-N 1 3 294.870 3.811 20 0 CHADHO C[C@H]([NH2+]C[C@]1(C)CCCNC1)[C@@H](C)c1ccc(Cl)cc1 ZINC000423333595 330191617 /nfs/dbraw/zinc/19/16/17/330191617.db2.gz HWDYVQZRLXCNQF-JKIFEVAISA-N 1 3 294.870 3.811 20 0 CHADHO Clc1ccc([C@H]2CCCCC[C@@H]2[NH2+]CC2CNC2)cc1 ZINC000423336619 330191689 /nfs/dbraw/zinc/19/16/89/330191689.db2.gz XWLARWRSIGNFJW-SJORKVTESA-N 1 3 292.854 3.565 20 0 CHADHO C[C@@H](NCC1=CC[NH2+]CC1)c1cc(Cl)ccc1Cl ZINC000423345963 330192370 /nfs/dbraw/zinc/19/23/70/330192370.db2.gz OTCDSPXLZRNLBS-SNVBAGLBSA-N 1 3 285.218 3.564 20 0 CHADHO C[C@@H](NCC1=CC[NH2+]CC1)c1ccc(Cl)c(Cl)c1 ZINC000423349020 330192697 /nfs/dbraw/zinc/19/26/97/330192697.db2.gz VQQBXNITYJOKSL-SNVBAGLBSA-N 1 3 285.218 3.564 20 0 CHADHO Cc1ccsc1[C@H](C)NCc1ccc2c(c1)C[NH2+]C2 ZINC000423352791 330193094 /nfs/dbraw/zinc/19/30/94/330193094.db2.gz BTWIUHWPOSYHBM-LBPRGKRZSA-N 1 3 272.417 3.511 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000423361350 330193571 /nfs/dbraw/zinc/19/35/71/330193571.db2.gz AFHDZWLJJITMOE-IRWJRLHMSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)c1ccc(F)c2ccccc21 ZINC000423361487 330193871 /nfs/dbraw/zinc/19/38/71/330193871.db2.gz GYPORSUZQQLHTE-MJBXVCDLSA-N 1 3 286.394 3.899 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CC2)CCN1 ZINC000423363055 330193983 /nfs/dbraw/zinc/19/39/83/330193983.db2.gz AHCGVYIYKWSBBS-LYRGGWFBSA-N 1 3 278.827 3.521 20 0 CHADHO N[C@H]1CCC[C@@H]([NH2+]C2CCC3(CCCCC3)CC2)C1 ZINC000423364837 330194408 /nfs/dbraw/zinc/19/44/08/330194408.db2.gz JYNMMQXPIMYWRJ-GOEBONIOSA-N 1 3 264.457 3.739 20 0 CHADHO CCC[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1ccc(Cl)cc1 ZINC000423365527 330194586 /nfs/dbraw/zinc/19/45/86/330194586.db2.gz BVTIPIIDXSCJCY-WQVCFCJDSA-N 1 3 280.843 3.911 20 0 CHADHO C[C@H]1C[C@H](NCc2ccc3c(c2)C[NH2+]C3)c2ccccc21 ZINC000423368932 330194940 /nfs/dbraw/zinc/19/49/40/330194940.db2.gz DNDUWQQGFSMUSR-DJJJIMSYSA-N 1 3 278.399 3.628 20 0 CHADHO C[C@@H]1C[C@@H](NCc2ccc3c(c2)C[NH2+]C3)c2ccccc21 ZINC000423368931 330195052 /nfs/dbraw/zinc/19/50/52/330195052.db2.gz DNDUWQQGFSMUSR-BFUOFWGJSA-N 1 3 278.399 3.628 20 0 CHADHO Cc1cccc(CC[C@@H](C)[NH2+]Cc2ccc3c(c2)CNC3)c1 ZINC000423371481 330195300 /nfs/dbraw/zinc/19/53/00/330195300.db2.gz GFQACOUMWDFHKJ-MRXNPFEDSA-N 1 3 294.442 3.709 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@@H]1N[C@H](Cc1ccccc1)c1ccccc1 ZINC000423400397 330195900 /nfs/dbraw/zinc/19/59/00/330195900.db2.gz QHGCSGQQVLNRHU-LSTHTHJFSA-N 1 3 294.442 3.558 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H](Cc1ccccc1)c1ccccc1 ZINC000423400397 330195901 /nfs/dbraw/zinc/19/59/01/330195901.db2.gz QHGCSGQQVLNRHU-LSTHTHJFSA-N 1 3 294.442 3.558 20 0 CHADHO COc1ccc([C@H](C)[NH2+][C@H]2CCN[C@@H](C)C2)c2ccccc12 ZINC000423401236 330196209 /nfs/dbraw/zinc/19/62/09/330196209.db2.gz XAYGVSNLIANUAE-KKUMJFAQSA-N 1 3 298.430 3.640 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)N[C@H]1CC[NH2+]C[C@H]1C ZINC000423401990 330196443 /nfs/dbraw/zinc/19/64/43/330196443.db2.gz RCMLIJODYBOMEO-NJAFHUGGSA-N 1 3 274.452 3.670 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)[NH2+][C@H]1CCNC[C@H]1C ZINC000423401990 330196445 /nfs/dbraw/zinc/19/64/45/330196445.db2.gz RCMLIJODYBOMEO-NJAFHUGGSA-N 1 3 274.452 3.670 20 0 CHADHO CCSc1ccccc1[C@H](C)N[C@H]1CCC[C@@H]([NH3+])C1 ZINC000423383635 330199336 /nfs/dbraw/zinc/19/93/36/330199336.db2.gz KMKAHIKNSSCYBY-MJBXVCDLSA-N 1 3 278.465 3.719 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@H]1N[C@H](c1ccccc1)C1CCCC1 ZINC000423385207 330199534 /nfs/dbraw/zinc/19/95/34/330199534.db2.gz GOLFEVCZYZCAOA-ZTFGCOKTSA-N 1 3 272.436 3.506 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@H](c1ccccc1)C1CCCC1 ZINC000423385207 330199536 /nfs/dbraw/zinc/19/95/36/330199536.db2.gz GOLFEVCZYZCAOA-ZTFGCOKTSA-N 1 3 272.436 3.506 20 0 CHADHO Cc1ccccc1[C@H]([NH2+][C@@H]1CCNC[C@H]1C)C1CCCC1 ZINC000423386272 330199764 /nfs/dbraw/zinc/19/97/64/330199764.db2.gz GZZPJRJDEHSADI-ATZDWAIDSA-N 1 3 286.463 3.814 20 0 CHADHO Cc1ccccc1[C@H](N[C@@H]1CC[NH2+]C[C@H]1C)C1CCCC1 ZINC000423386272 330199765 /nfs/dbraw/zinc/19/97/65/330199765.db2.gz GZZPJRJDEHSADI-ATZDWAIDSA-N 1 3 286.463 3.814 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@H]2CCCC[C@H]2c2ccccc2)C1 ZINC000423387347 330200096 /nfs/dbraw/zinc/20/00/96/330200096.db2.gz MMEJHBHULQORGR-OWSLCNJRSA-N 1 3 272.436 3.572 20 0 CHADHO CCC[C@@H](C)[C@H](CC)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423392293 330200155 /nfs/dbraw/zinc/20/01/55/330200155.db2.gz PXZRGWKUFSEXIT-DYVFJYSZSA-N 1 3 260.425 3.594 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@@H]1N[C@H](c1ccc(F)cc1)C1CCCC1 ZINC000423391288 330200213 /nfs/dbraw/zinc/20/02/13/330200213.db2.gz KSBOUJTXOGFOBD-BVGQSLNGSA-N 1 3 290.426 3.645 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H](c1ccc(F)cc1)C1CCCC1 ZINC000423391288 330200215 /nfs/dbraw/zinc/20/02/15/330200215.db2.gz KSBOUJTXOGFOBD-BVGQSLNGSA-N 1 3 290.426 3.645 20 0 CHADHO C[C@H]([NH2+]Cc1ccc2c(c1)CNC2)C1CCC(F)(F)CC1 ZINC000423389855 330200271 /nfs/dbraw/zinc/20/02/71/330200271.db2.gz OOFUSQXMVPULRC-LBPRGKRZSA-N 1 3 294.389 3.593 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)c1ccc(-c2ccccc2)s1)[C@H](C)N ZINC000423447000 330202339 /nfs/dbraw/zinc/20/23/39/330202339.db2.gz OLWHTZMXFFACDP-XQQFMLRXSA-N 1 3 274.433 3.801 20 0 CHADHO C[C@@H](N)[C@H](C)[NH2+][C@@H](C)c1ccc(-c2ccccc2F)s1 ZINC000423448135 330202602 /nfs/dbraw/zinc/20/26/02/330202602.db2.gz PTIWDGUHZYBTLM-WOPDTQHZSA-N 1 3 292.423 3.941 20 0 CHADHO C[C@H](N[C@@H](CCC[NH3+])c1ccccc1)c1cccc(F)c1 ZINC000423496399 330207824 /nfs/dbraw/zinc/20/78/24/330207824.db2.gz DPRXIKGKGQETTK-KSSFIOAISA-N 1 3 286.394 3.957 20 0 CHADHO C[C@H](N[C@@H]1CC[C@@H](C[NH3+])C1)c1cc(Cl)ccc1Cl ZINC000423496346 330207887 /nfs/dbraw/zinc/20/78/87/330207887.db2.gz WLVXABNSBICYCY-HOSYDEDBSA-N 1 3 287.234 3.771 20 0 CHADHO [NH3+]CCC[C@@H](N[C@@H]1CCc2ccccc21)c1ccccc1 ZINC000423495307 330207910 /nfs/dbraw/zinc/20/79/10/330207910.db2.gz BQFSQRIUHQTGJL-RTBURBONSA-N 1 3 280.415 3.744 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CNC[C@H]1c1ccccc1)[C@H](C)c1ccccc1 ZINC000423501360 330208584 /nfs/dbraw/zinc/20/85/84/330208584.db2.gz DIVBDVNAHUEETE-ACZWYYKOSA-N 1 3 294.442 3.524 20 0 CHADHO C[C@H](N[C@H](CCC[NH3+])c1ccccc1)c1ccccc1F ZINC000423505659 330208758 /nfs/dbraw/zinc/20/87/58/330208758.db2.gz ORIUBUMSTFAZTR-KBXCAEBGSA-N 1 3 286.394 3.957 20 0 CHADHO C[C@@H](N[C@H](CCC[NH3+])c1ccccc1)c1ccccc1 ZINC000423504672 330208842 /nfs/dbraw/zinc/20/88/42/330208842.db2.gz NRQSPBZDPFOIFK-CRAIPNDOSA-N 1 3 268.404 3.817 20 0 CHADHO C[C@@H]([NH2+]CC1(N)C2CC3CC(C2)CC1C3)c1cccs1 ZINC000423515994 330209316 /nfs/dbraw/zinc/20/93/16/330209316.db2.gz AJLVNAKNQAULDL-VQGSXZNQSA-N 1 3 290.476 3.552 20 0 CHADHO COc1ccc([C@H](C)NCCC[NH2+]C2CC2)c2ccccc12 ZINC000423517831 330209586 /nfs/dbraw/zinc/20/95/86/330209586.db2.gz CAGVPYCUQIRTOE-AWEZNQCLSA-N 1 3 298.430 3.641 20 0 CHADHO COc1ccc([C@H](C)[NH2+]CCCNC2CC2)c2ccccc12 ZINC000423517831 330209587 /nfs/dbraw/zinc/20/95/87/330209587.db2.gz CAGVPYCUQIRTOE-AWEZNQCLSA-N 1 3 298.430 3.641 20 0 CHADHO CC(C)C[C@H]([NH2+]CCCNC1CC1)c1cccs1 ZINC000423517237 330209590 /nfs/dbraw/zinc/20/95/90/330209590.db2.gz BIECQEVWZAZDKI-AWEZNQCLSA-N 1 3 266.454 3.567 20 0 CHADHO CCc1cccnc1[C@@H](C)N[C@H](CCC[NH3+])c1ccccc1 ZINC000423525453 330209975 /nfs/dbraw/zinc/20/99/75/330209975.db2.gz YIQPEBQSRGIXKD-CRAIPNDOSA-N 1 3 297.446 3.775 20 0 CHADHO C[C@H](C[NH2+]C[C@H](C)c1ccc(F)cc1)CN1CCCCC1 ZINC000527116441 330223360 /nfs/dbraw/zinc/22/33/60/330223360.db2.gz JWLSFHUYUIGEIC-CVEARBPZSA-N 1 3 292.442 3.641 20 0 CHADHO CC(C)C[C@@H](C)[NH2+][C@@H](C)c1cccc(OCCN(C)C)c1 ZINC000536839104 330232417 /nfs/dbraw/zinc/23/24/17/330232417.db2.gz NGPISJWKRVFYHW-CVEARBPZSA-N 1 3 292.467 3.712 20 0 CHADHO CCC[C@H](C)[C@H](CC)[NH2+]CCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000536859121 330252474 /nfs/dbraw/zinc/25/24/74/330252474.db2.gz UTUZSIUAURSIAI-XSLAGTTESA-N 1 3 298.515 3.680 20 0 CHADHO C[C@H]([NH2+]CC[C@H]1CCCCN1C)c1cc2ccccc2o1 ZINC000527505096 330254978 /nfs/dbraw/zinc/25/49/78/330254978.db2.gz HDHCIEANHCUMIE-GOEBONIOSA-N 1 3 286.419 3.958 20 0 CHADHO CCC(F)(F)C(C)(C)C[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000527631526 330266898 /nfs/dbraw/zinc/26/68/98/330266898.db2.gz LILRDGHZMMJWTP-UHFFFAOYSA-N 1 3 290.442 3.957 20 0 CHADHO CCC(F)(F)C(C)(C)CNC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000527631526 330266900 /nfs/dbraw/zinc/26/69/00/330266900.db2.gz LILRDGHZMMJWTP-UHFFFAOYSA-N 1 3 290.442 3.957 20 0 CHADHO CC[NH+](CC)Cc1ccccc1CNCc1ccnc(C)c1 ZINC000527633560 330267346 /nfs/dbraw/zinc/26/73/46/330267346.db2.gz VJZDTZQEXJCGOF-UHFFFAOYSA-N 1 3 297.446 3.522 20 0 CHADHO CC[C@H](N[C@H]1CC[N@@H+]2CCC[C@H]2C1)c1cc(C)ccc1C ZINC000527817794 330282769 /nfs/dbraw/zinc/28/27/69/330282769.db2.gz CMXISNXUNAQDHN-LNLFQRSKSA-N 1 3 286.463 3.971 20 0 CHADHO CC[C@H](N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(C)ccc1C ZINC000527817794 330282770 /nfs/dbraw/zinc/28/27/70/330282770.db2.gz CMXISNXUNAQDHN-LNLFQRSKSA-N 1 3 286.463 3.971 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H](C)c2cccc(C(C)C)c2)C1 ZINC000527844251 330287556 /nfs/dbraw/zinc/28/75/56/330287556.db2.gz AJMWGYPYGPFQOF-JKSUJKDBSA-N 1 3 274.452 3.802 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H](C)c2cccc(C(C)C)c2)C1 ZINC000527844251 330287557 /nfs/dbraw/zinc/28/75/57/330287557.db2.gz AJMWGYPYGPFQOF-JKSUJKDBSA-N 1 3 274.452 3.802 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)c2cccc(C(C)C)c2)C1 ZINC000527844251 330287558 /nfs/dbraw/zinc/28/75/58/330287558.db2.gz AJMWGYPYGPFQOF-JKSUJKDBSA-N 1 3 274.452 3.802 20 0 CHADHO CC[NH+]1CCC(N[C@H](C)c2cccc(C(C)C)c2)CC1 ZINC000527845970 330287774 /nfs/dbraw/zinc/28/77/74/330287774.db2.gz KZMSRJLNGHSRSD-OAHLLOKOSA-N 1 3 274.452 3.945 20 0 CHADHO CCc1ccc([C@@H](C)NCCC2CC[NH+](CC)CC2)o1 ZINC000121830997 330407850 /nfs/dbraw/zinc/40/78/50/330407850.db2.gz BNKOOVXIAYMPKI-CQSZACIVSA-N 1 3 278.440 3.615 20 0 CHADHO Cc1cccc2c1ncc(C)c2N1CCC[C@@H]([NH+](C)C)CC1 ZINC000428678174 330529355 /nfs/dbraw/zinc/52/93/55/330529355.db2.gz GMWPAMQQZLBPSJ-MRXNPFEDSA-N 1 3 297.446 3.772 20 0 CHADHO C[C@H](C[NH2+][C@H]1CC[C@H](c2ccccc2)C1)CN1CCCC1 ZINC000436276874 330672729 /nfs/dbraw/zinc/67/27/29/330672729.db2.gz VSERVRBETYRFMK-NEWSRXKRSA-N 1 3 286.463 3.644 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCC[C@H](N(C)C)C1)c1cc(F)cc(F)c1 ZINC000449177467 330903902 /nfs/dbraw/zinc/90/39/02/330903902.db2.gz VTCSNAQJLAYUJD-JLZZUVOBSA-N 1 3 296.405 3.531 20 0 CHADHO CSc1ccccc1[C@H](C)[NH2+]CC(C)(C)CN(C)C ZINC000194830419 331062895 /nfs/dbraw/zinc/06/28/95/331062895.db2.gz UYKSCSYWQZBROV-ZDUSSCGKSA-N 1 3 280.481 3.647 20 0 CHADHO Cc1cc([C@H](C)NCc2ccc(C[NH+](C)C)cc2)cs1 ZINC000453102473 331089301 /nfs/dbraw/zinc/08/93/01/331089301.db2.gz ZNZUFMLUYMKLJP-AWEZNQCLSA-N 1 3 288.460 3.969 20 0 CHADHO Cc1cc([C@H](C)[NH2+][C@H]2CCC[C@@H](N(C)C)C2)cs1 ZINC000453133909 331092658 /nfs/dbraw/zinc/09/26/58/331092658.db2.gz NIFJEBUWWVPVRQ-AEGPPILISA-N 1 3 266.454 3.580 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1ccsc1 ZINC000453139559 331093368 /nfs/dbraw/zinc/09/33/68/331093368.db2.gz RSDWXMNENIOIIH-KFWWJZLASA-N 1 3 266.454 3.662 20 0 CHADHO C[C@@H](NCCCC[N@H+](C)C1CC1)c1ccccc1Cl ZINC000453409334 331129753 /nfs/dbraw/zinc/12/97/53/331129753.db2.gz GEVOKXHCIMYTJE-CYBMUJFWSA-N 1 3 280.843 3.865 20 0 CHADHO C[C@@H](NCCCC[N@@H+](C)C1CC1)c1ccccc1Cl ZINC000453409334 331129754 /nfs/dbraw/zinc/12/97/54/331129754.db2.gz GEVOKXHCIMYTJE-CYBMUJFWSA-N 1 3 280.843 3.865 20 0 CHADHO CC[C@]1(C(C)C)C[C@@H]1NC1CC[NH+](C(C)(C)C)CC1 ZINC000453435705 331131600 /nfs/dbraw/zinc/13/16/00/331131600.db2.gz KZZYBCPYKHIRDF-DOTOQJQBSA-N 1 3 266.473 3.664 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]C2CC(C(C)(C)C)C2)C1 ZINC000459420542 331280710 /nfs/dbraw/zinc/28/07/10/331280710.db2.gz CSUPEOZCTOKSOE-FHERZECASA-N 1 3 266.473 3.521 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@@H]1C[C@H](c2ccccc2)C1(C)C ZINC000463538153 331349258 /nfs/dbraw/zinc/34/92/58/331349258.db2.gz AAWJMBDVOPZSIN-QZTJIDSGSA-N 1 3 288.479 3.889 20 0 CHADHO CC(C)[N@H+](C)CCCN[C@@H]1C[C@H](c2ccccc2)C1(C)C ZINC000463538153 331349259 /nfs/dbraw/zinc/34/92/59/331349259.db2.gz AAWJMBDVOPZSIN-QZTJIDSGSA-N 1 3 288.479 3.889 20 0 CHADHO CC(C)[N@@H+](C)CCCN[C@@H]1C[C@H](c2ccccc2)C1(C)C ZINC000463538153 331349260 /nfs/dbraw/zinc/34/92/60/331349260.db2.gz AAWJMBDVOPZSIN-QZTJIDSGSA-N 1 3 288.479 3.889 20 0 CHADHO CC1(C)[C@@H](c2ccccc2)C[C@@H]1[NH2+]CCCN1CCCC1 ZINC000463557985 331349406 /nfs/dbraw/zinc/34/94/06/331349406.db2.gz NZQJMYPYBGWCMQ-MSOLQXFVSA-N 1 3 286.463 3.644 20 0 CHADHO CC1(C)[C@@H](c2ccccc2)C[C@@H]1NCCC[NH+]1CCCC1 ZINC000463557985 331349407 /nfs/dbraw/zinc/34/94/07/331349407.db2.gz NZQJMYPYBGWCMQ-MSOLQXFVSA-N 1 3 286.463 3.644 20 0 CHADHO CC1(C)[C@@H]([NH2+]CCCN2CCCC2)C[C@H]1c1ccccc1 ZINC000463557987 331349427 /nfs/dbraw/zinc/34/94/27/331349427.db2.gz NZQJMYPYBGWCMQ-ROUUACIJSA-N 1 3 286.463 3.644 20 0 CHADHO CC1(C)[C@@H](NCCC[NH+]2CCCC2)C[C@H]1c1ccccc1 ZINC000463557987 331349428 /nfs/dbraw/zinc/34/94/28/331349428.db2.gz NZQJMYPYBGWCMQ-ROUUACIJSA-N 1 3 286.463 3.644 20 0 CHADHO C1CC([C@H]2CC[C@@H]2[NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000510721254 332913422 /nfs/dbraw/zinc/91/34/22/332913422.db2.gz MMFRSVZVDMDRSH-MOPGFXCFSA-N 1 3 290.495 3.952 20 0 CHADHO C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1cccc(CN(C)C)c1 ZINC000480260747 331764829 /nfs/dbraw/zinc/76/48/29/331764829.db2.gz UIBZNZHOIHYYFU-HUUCEWRRSA-N 1 3 274.452 3.663 20 0 CHADHO C[C@@H](C[NH2+]CC(C)(C)CN1CCCC1)Cc1ccccc1 ZINC000483406832 331872662 /nfs/dbraw/zinc/87/26/62/331872662.db2.gz MSJMEIMFNCGRAN-QGZVFWFLSA-N 1 3 288.479 3.577 20 0 CHADHO C[C@H]([NH2+]C1CCC2(CC2)CC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000488508869 332014672 /nfs/dbraw/zinc/01/46/72/332014672.db2.gz UNYIZGSNWATALE-JKSUJKDBSA-N 1 3 290.495 3.952 20 0 CHADHO CN(CCCc1cccc(F)c1)CC[C@H]1CCCC[N@@H+]1C ZINC000490105328 332081679 /nfs/dbraw/zinc/08/16/79/332081679.db2.gz XWUXZWDKUBCPBE-GOSISDBHSA-N 1 3 292.442 3.565 20 0 CHADHO CN(CCCc1cccc(F)c1)CC[C@H]1CCCC[N@H+]1C ZINC000490105328 332081681 /nfs/dbraw/zinc/08/16/81/332081681.db2.gz XWUXZWDKUBCPBE-GOSISDBHSA-N 1 3 292.442 3.565 20 0 CHADHO CC[C@H]1CCCC[C@H]1[NH2+]Cc1cccc(CN(C)C)c1 ZINC000502021057 332645579 /nfs/dbraw/zinc/64/55/79/332645579.db2.gz XUJZQFRLGPKWBA-ZWKOTPCHSA-N 1 3 274.452 3.807 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](N[C@H](c2ccc(F)c(Cl)c2)C2CC2)C1 ZINC000566481471 334651740 /nfs/dbraw/zinc/65/17/40/334651740.db2.gz DDEWODXUURBRSY-IOASZLSFSA-N 1 3 296.817 3.790 20 0 CHADHO CC(C)[C@@H](C)C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000513226704 333009460 /nfs/dbraw/zinc/00/94/60/333009460.db2.gz LMIJIXUYXYDYCX-HNNXBMFYSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@H]1C[C@H](CCNCc2ccco2)C[N@@H+]1Cc1ccccc1 ZINC000513508618 333023513 /nfs/dbraw/zinc/02/35/13/333023513.db2.gz YTZSQFNCJSFMSF-WMZOPIPTSA-N 1 3 298.430 3.670 20 0 CHADHO C[C@H]1C[C@H](CCNCc2ccco2)C[N@H+]1Cc1ccccc1 ZINC000513508618 333023514 /nfs/dbraw/zinc/02/35/14/333023514.db2.gz YTZSQFNCJSFMSF-WMZOPIPTSA-N 1 3 298.430 3.670 20 0 CHADHO N[C@@H]1CCC[C@@H]([NH2+]CC(c2ccccc2)c2ccccc2)C1 ZINC000516877609 333085184 /nfs/dbraw/zinc/08/51/84/333085184.db2.gz IWHIKLZSZOTARG-RTBURBONSA-N 1 3 294.442 3.678 20 0 CHADHO CC(C)CN1CCC([NH2+]CC(C(C)C)C(C)C)CC1 ZINC000219303115 333146659 /nfs/dbraw/zinc/14/66/59/333146659.db2.gz GQCCUWZEAZQBES-UHFFFAOYSA-N 1 3 268.489 3.625 20 0 CHADHO CN(Cc1ccc(C(C)(C)C)cc1)[C@H]1CCC[NH2+]CC1 ZINC000234316158 333359610 /nfs/dbraw/zinc/35/96/10/333359610.db2.gz RGRTYIZBVAGVIN-KRWDZBQOSA-N 1 3 274.452 3.558 20 0 CHADHO C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000235286804 333367257 /nfs/dbraw/zinc/36/72/57/333367257.db2.gz IAFRWLKTRUUBAS-OCCSQVGLSA-N 1 3 266.473 3.710 20 0 CHADHO CCN1CC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3)cc2)C1 ZINC000236823942 333375720 /nfs/dbraw/zinc/37/57/20/333375720.db2.gz OWPYJRLALMOWTN-SFHVURJKSA-N 1 3 294.442 3.785 20 0 CHADHO Cc1cccc([C@H](N[C@H]2CCC[C@H]([NH3+])C2)C(C)C)c1 ZINC000530227521 333529183 /nfs/dbraw/zinc/52/91/83/333529183.db2.gz YNRRACLRZYHMQW-YESZJQIVSA-N 1 3 260.425 3.552 20 0 CHADHO CC[C@H](C)[C@H](C)[NH2+][C@H](C)c1cccc(OCCN(C)C)c1 ZINC000540183120 333718698 /nfs/dbraw/zinc/71/86/98/333718698.db2.gz QJWNFAHDDVHZLG-HRCADAONSA-N 1 3 292.467 3.712 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H](c3ccccc3)C2)C1 ZINC000131999579 333970146 /nfs/dbraw/zinc/97/01/46/333970146.db2.gz PTLYYVSDQLWZBM-INDMIFKZSA-N 1 3 286.463 3.785 20 0 CHADHO C(CN1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1)C1CCCC1 ZINC000134915922 334108456 /nfs/dbraw/zinc/10/84/56/334108456.db2.gz CCDMWHARMYHVBR-SJLPKXTDSA-N 1 3 276.468 3.515 20 0 CHADHO C(CN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)C1CCCC1 ZINC000134915922 334108457 /nfs/dbraw/zinc/10/84/57/334108457.db2.gz CCDMWHARMYHVBR-SJLPKXTDSA-N 1 3 276.468 3.515 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+]C1CCC(C)(C)CC1 ZINC000079619863 334158272 /nfs/dbraw/zinc/15/82/72/334158272.db2.gz YTEHEIDRIKSARV-OAHLLOKOSA-N 1 3 266.473 3.809 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+]([C@H](C)c2cccc(C)c2)C1 ZINC000246222466 334242213 /nfs/dbraw/zinc/24/22/13/334242213.db2.gz PGBSUJGQNUZRHL-SJORKVTESA-N 1 3 274.452 3.720 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+]([C@H](C)c2cccc(C)c2)C1 ZINC000246222466 334242215 /nfs/dbraw/zinc/24/22/15/334242215.db2.gz PGBSUJGQNUZRHL-SJORKVTESA-N 1 3 274.452 3.720 20 0 CHADHO C[C@@H]1CCc2c(F)cccc2[C@@H]1N[C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000247949360 334292075 /nfs/dbraw/zinc/29/20/75/334292075.db2.gz DXAVUFMQUADJBK-ZUMXRPEOSA-N 1 3 290.426 3.521 20 0 CHADHO C[C@@H]1CCc2c(F)cccc2[C@@H]1N[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000247949360 334292077 /nfs/dbraw/zinc/29/20/77/334292077.db2.gz DXAVUFMQUADJBK-ZUMXRPEOSA-N 1 3 290.426 3.521 20 0 CHADHO CC[C@H](c1ccccc1)[N@@H+]1CC[C@H]2[C@@H](CCCN2C)C1 ZINC000247975884 334292639 /nfs/dbraw/zinc/29/26/39/334292639.db2.gz HUYHVOSHDQWKSS-KSZLIROESA-N 1 3 272.436 3.554 20 0 CHADHO CC[C@H](c1ccccc1)[N@H+]1CC[C@H]2[C@@H](CCCN2C)C1 ZINC000247975884 334292640 /nfs/dbraw/zinc/29/26/40/334292640.db2.gz HUYHVOSHDQWKSS-KSZLIROESA-N 1 3 272.436 3.554 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2C)C1 ZINC000248147786 334295873 /nfs/dbraw/zinc/29/58/73/334295873.db2.gz QJWYENWLEKEFIT-SJORKVTESA-N 1 3 274.452 3.720 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+]([C@H](C)c2ccccc2C)C1 ZINC000248147786 334295874 /nfs/dbraw/zinc/29/58/74/334295874.db2.gz QJWYENWLEKEFIT-SJORKVTESA-N 1 3 274.452 3.720 20 0 CHADHO C[C@@H]([NH2+][C@H]1CCCC[C@H]1C)[C@@H]1CCCN(C2CCC2)C1 ZINC000248399812 334300273 /nfs/dbraw/zinc/30/02/73/334300273.db2.gz KHTIQUILXCCIQQ-KONPQCLYSA-N 1 3 278.484 3.808 20 0 CHADHO CC(C)c1ccc(CN[C@@H]2CC[N@H+](C)[C@H]3CCC[C@H]32)cc1 ZINC000552247722 334308180 /nfs/dbraw/zinc/30/81/80/334308180.db2.gz YGDQLFSZYRNRKZ-OTWHNJEPSA-N 1 3 286.463 3.772 20 0 CHADHO CC(C)c1ccc(CN[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@H]32)cc1 ZINC000552247722 334308182 /nfs/dbraw/zinc/30/81/82/334308182.db2.gz YGDQLFSZYRNRKZ-OTWHNJEPSA-N 1 3 286.463 3.772 20 0 CHADHO CCCc1ccc(CN(C)[C@H]2CC[N@H+](CC)C[C@H]2C)cc1 ZINC000552290849 334313887 /nfs/dbraw/zinc/31/38/87/334313887.db2.gz VFEFOFBALJRALA-APWZRJJASA-N 1 3 288.479 3.801 20 0 CHADHO CCCc1ccc(CN(C)[C@H]2CC[N@@H+](CC)C[C@H]2C)cc1 ZINC000552290849 334313888 /nfs/dbraw/zinc/31/38/88/334313888.db2.gz VFEFOFBALJRALA-APWZRJJASA-N 1 3 288.479 3.801 20 0 CHADHO CCCc1ccc(CN(C)[C@@H]2CC[N@H+](CC)C[C@H]2C)cc1 ZINC000552290852 334313933 /nfs/dbraw/zinc/31/39/33/334313933.db2.gz VFEFOFBALJRALA-VQIMIIECSA-N 1 3 288.479 3.801 20 0 CHADHO CCCc1ccc(CN(C)[C@@H]2CC[N@@H+](CC)C[C@H]2C)cc1 ZINC000552290852 334313935 /nfs/dbraw/zinc/31/39/35/334313935.db2.gz VFEFOFBALJRALA-VQIMIIECSA-N 1 3 288.479 3.801 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC000249091946 334327446 /nfs/dbraw/zinc/32/74/46/334327446.db2.gz DJKARLMOZLEMSD-ZOBORPQBSA-N 1 3 292.389 3.570 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+][C@H]2CCC23CCCC3)C1 ZINC000249127805 334328513 /nfs/dbraw/zinc/32/85/13/334328513.db2.gz ULUBGNVEPUJOCT-SJORKVTESA-N 1 3 278.484 3.667 20 0 CHADHO Cc1ccsc1[C@@H](C)[NH2+]CCCN1CCCC[C@H]1C ZINC000250871216 334352515 /nfs/dbraw/zinc/35/25/15/334352515.db2.gz KPOUILXTPVQOBA-HUUCEWRRSA-N 1 3 280.481 3.972 20 0 CHADHO C[C@H](c1ccc(C(C)(C)C)cc1)N1CC[C@@H]([C@H](C)[NH3+])C1 ZINC000252767900 334391371 /nfs/dbraw/zinc/39/13/71/334391371.db2.gz JSSYKNNQGDSSRL-SQWLQELKSA-N 1 3 274.452 3.714 20 0 CHADHO CCCc1cc(N2CC[C@@H](C[NH+](C)C)C2)c2ccccc2n1 ZINC000555194842 334470650 /nfs/dbraw/zinc/47/06/50/334470650.db2.gz IDTIMCVDJQHJIO-HNNXBMFYSA-N 1 3 297.446 3.575 20 0 CHADHO CC(C)[C@H]1CC[C@@H]1[NH2+]C1CCN(CC2CCCC2)CC1 ZINC000572906777 334890177 /nfs/dbraw/zinc/89/01/77/334890177.db2.gz IYZYRGDGCWOPPJ-MSOLQXFVSA-N 1 3 278.484 3.665 20 0 CHADHO CC1=C[C@H](C)C[C@H](C[N@@H+]2CC[C@@H](C3CCN(C)CC3)C2)C1 ZINC000576438599 335203580 /nfs/dbraw/zinc/20/35/80/335203580.db2.gz RZEAGSXFMMUSNS-VDZJLULYSA-N 1 3 290.495 3.643 20 0 CHADHO CC1=C[C@H](C)C[C@H](C[N@H+]2CC[C@@H](C3CCN(C)CC3)C2)C1 ZINC000576438599 335203582 /nfs/dbraw/zinc/20/35/82/335203582.db2.gz RZEAGSXFMMUSNS-VDZJLULYSA-N 1 3 290.495 3.643 20 0 CHADHO CC(C)(CN[C@H]1CCC[C@H]([NH3+])C1)c1c(F)cccc1Cl ZINC000577509568 335362642 /nfs/dbraw/zinc/36/26/42/335362642.db2.gz DWFUQINGENTZJR-RYUDHWBXSA-N 1 3 298.833 3.616 20 0 CHADHO Cc1cc(C)cc([C@H](C)NCc2ccc(C[NH3+])cc2)c1 ZINC000578771112 335673512 /nfs/dbraw/zinc/67/35/12/335673512.db2.gz QQZYHNWIOLGVHM-HNNXBMFYSA-N 1 3 268.404 3.613 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)NCc1cccc(C)c1F ZINC000384482219 336124905 /nfs/dbraw/zinc/12/49/05/336124905.db2.gz ZBVYLBZPHMYSLL-HNNXBMFYSA-N 1 3 280.431 3.734 20 0 CHADHO CCCOc1ccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000156193071 520427753 /nfs/dbraw/zinc/42/77/53/520427753.db2.gz IEQWRASUGHPXSM-HLLBOEOZSA-N 1 3 290.451 3.609 20 0 CHADHO CCCOc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000156193071 520427767 /nfs/dbraw/zinc/42/77/67/520427767.db2.gz IEQWRASUGHPXSM-HLLBOEOZSA-N 1 3 290.451 3.609 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N[C@@H](C)c1ccc(C)o1 ZINC000019915076 520636972 /nfs/dbraw/zinc/63/69/72/520636972.db2.gz IOZYKTZJERQTRY-ZFWWWQNUSA-N 1 3 266.429 3.749 20 0 CHADHO CCN(Cc1ccc2ccccc2c1)C[C@@H]1CCC[NH2+]C1 ZINC000226436217 521334894 /nfs/dbraw/zinc/33/48/94/521334894.db2.gz UAHZWZLRFZCLHG-QGZVFWFLSA-N 1 3 282.431 3.661 20 0 CHADHO CC[N@@H+](Cc1ccc2ccccc2c1)C[C@@H]1CCCNC1 ZINC000226436217 521334901 /nfs/dbraw/zinc/33/49/01/521334901.db2.gz UAHZWZLRFZCLHG-QGZVFWFLSA-N 1 3 282.431 3.661 20 0 CHADHO CC[N@H+](Cc1ccc2ccccc2c1)C[C@@H]1CCCNC1 ZINC000226436217 521334909 /nfs/dbraw/zinc/33/49/09/521334909.db2.gz UAHZWZLRFZCLHG-QGZVFWFLSA-N 1 3 282.431 3.661 20 0 CHADHO CN(C)[C@H]1CCC[N@H+](Cc2csc3ccccc23)CC1 ZINC000277092170 522097424 /nfs/dbraw/zinc/09/74/24/522097424.db2.gz FYTSTYLHINBPQM-HNNXBMFYSA-N 1 3 288.460 3.817 20 0 CHADHO CN(C)[C@H]1CCC[N@@H+](Cc2csc3ccccc23)CC1 ZINC000277092170 522097427 /nfs/dbraw/zinc/09/74/27/522097427.db2.gz FYTSTYLHINBPQM-HNNXBMFYSA-N 1 3 288.460 3.817 20 0 CHADHO CC[C@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(C)cc1 ZINC000037649151 522615847 /nfs/dbraw/zinc/61/58/47/522615847.db2.gz FCBQOFFGWZJELH-YJBOKZPZSA-N 1 3 272.436 3.520 20 0 CHADHO CC[C@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(C)cc1 ZINC000037649151 522615856 /nfs/dbraw/zinc/61/58/56/522615856.db2.gz FCBQOFFGWZJELH-YJBOKZPZSA-N 1 3 272.436 3.520 20 0 CHADHO Cc1ccccc1[C@@H](C)[NH2+]C1CCN(c2ccncc2)CC1 ZINC000298515471 525360470 /nfs/dbraw/zinc/36/04/70/525360470.db2.gz REBOTWVOLXBINB-MRXNPFEDSA-N 1 3 295.430 3.710 20 0 CHADHO C[C@@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1ccc(F)cc1 ZINC000037786296 525402635 /nfs/dbraw/zinc/40/26/35/525402635.db2.gz UARJHAJKQZOMIP-CYBMUJFWSA-N 1 3 278.415 3.739 20 0 CHADHO C[C@@H](NCC1CC[NH+](C2CC2)CC1)c1csc(Cl)c1 ZINC000278557232 525426763 /nfs/dbraw/zinc/42/67/63/525426763.db2.gz WINVPWDIKBZZNR-LLVKDONJSA-N 1 3 298.883 3.927 20 0 CHADHO C[C@H]1CCCC[N@@H+]1CCCCNCc1ccc(Cl)o1 ZINC000340424514 526246481 /nfs/dbraw/zinc/24/64/81/526246481.db2.gz FOOQXIDNQWQFBY-ZDUSSCGKSA-N 1 3 284.831 3.677 20 0 CHADHO C[C@H]1CCCC[N@H+]1CCCCNCc1ccc(Cl)o1 ZINC000340424514 526246483 /nfs/dbraw/zinc/24/64/83/526246483.db2.gz FOOQXIDNQWQFBY-ZDUSSCGKSA-N 1 3 284.831 3.677 20 0 CHADHO c1cc(N2CCC([NH2+]C(C3CCC3)C3CCC3)CC2)ccn1 ZINC000298074862 526431832 /nfs/dbraw/zinc/43/18/32/526431832.db2.gz LHFDXSYPCFGNNJ-UHFFFAOYSA-N 1 3 299.462 3.609 20 0 CHADHO Cc1nc(C)c([C@@H](C)[NH2+]C2CCN(C(C)(C)C)CC2)s1 ZINC000111361563 526744810 /nfs/dbraw/zinc/74/48/10/526744810.db2.gz JZSZDNVSMLFLPR-GFCCVEGCSA-N 1 3 295.496 3.673 20 0 CHADHO CCN1CC[C@@H]([N@H+](C)Cc2ccc3ccccc3n2)C[C@@H]1C ZINC000353749439 527755042 /nfs/dbraw/zinc/75/50/42/527755042.db2.gz KYYQWUJWBFSMNV-MAUKXSAKSA-N 1 3 297.446 3.539 20 0 CHADHO CCN1CC[C@@H]([N@@H+](C)Cc2ccc3ccccc3n2)C[C@@H]1C ZINC000353749439 527755049 /nfs/dbraw/zinc/75/50/49/527755049.db2.gz KYYQWUJWBFSMNV-MAUKXSAKSA-N 1 3 297.446 3.539 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2ccc3occc3c2)[C@@H](C)C1 ZINC000347862867 527835163 /nfs/dbraw/zinc/83/51/63/527835163.db2.gz WVRFIPOJNSEWCG-YOEHRIQHSA-N 1 3 286.419 3.595 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2ccc3occc3c2)[C@@H](C)C1 ZINC000347862867 527835169 /nfs/dbraw/zinc/83/51/69/527835169.db2.gz WVRFIPOJNSEWCG-YOEHRIQHSA-N 1 3 286.419 3.595 20 0 CHADHO CC/C=C\CC[N@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001208729312 1117920483 /nfs/dbraw/zinc/92/04/83/1117920483.db2.gz SMNOEDAGSKDWDJ-CWIOURORSA-N 1 3 264.457 3.683 20 0 CHADHO CC[C@@H]1CCC[C@@H]([NH2+]C[C@H](C)CN2CCCC2)CC1 ZINC000251689234 1125484357 /nfs/dbraw/zinc/48/43/57/1125484357.db2.gz IHPZDZHBKSCHFX-GVDBMIGSSA-N 1 3 266.473 3.667 20 0 CHADHO CC[C@@H]([NH2+]CC1=CCN(C)CC1)c1ccc(Cl)s1 ZINC000271888285 1122181208 /nfs/dbraw/zinc/18/12/08/1122181208.db2.gz RFLVYGVABHBCKY-GFCCVEGCSA-N 1 3 284.856 3.704 20 0 CHADHO CC(C)=CCCN1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC001191048444 1122571337 /nfs/dbraw/zinc/57/13/37/1122571337.db2.gz OBCIDHVQFFGDGK-ZWKOTPCHSA-N 1 3 278.484 3.929 20 0 CHADHO C[C@@H](CC(C)(C)C)[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000853240248 1123428908 /nfs/dbraw/zinc/42/89/08/1123428908.db2.gz NRODDDNKPPFWHZ-HOCLYGCPSA-N 1 3 266.473 3.523 20 0 CHADHO CCCCC(CCCC)[N@@H+]1CCCC[C@H](CN)C1 ZINC001246583763 1131690378 /nfs/dbraw/zinc/69/03/78/1131690378.db2.gz RWVHJBVTWPYMJJ-OAHLLOKOSA-N 1 3 254.462 3.796 20 0 CHADHO CCCCC(CCCC)[N@H+]1CCCC[C@H](CN)C1 ZINC001246583763 1131690380 /nfs/dbraw/zinc/69/03/80/1131690380.db2.gz RWVHJBVTWPYMJJ-OAHLLOKOSA-N 1 3 254.462 3.796 20 0 CHADHO CC[C@@H]1C[C@H](N2CCC(F)(F)C(C)(C)C2)C[C@H](CC)[NH2+]1 ZINC001246594101 1131707814 /nfs/dbraw/zinc/70/78/14/1131707814.db2.gz CWJMPSHPMOAJGC-WDNDVIMCSA-N 1 3 288.426 3.663 20 0 CHADHO CC1(C)CCC[C@@H]([N@@H+]2CCC[C@@]3(CCCCN3)C2)C1 ZINC001246616354 1131720096 /nfs/dbraw/zinc/72/00/96/1131720096.db2.gz WBGDYCUKESNISU-WBVHZDCISA-N 1 3 264.457 3.563 20 0 CHADHO CC1(C)CCC[C@@H]([N@H+]2CCC[C@@]3(CCCCN3)C2)C1 ZINC001246616354 1131720098 /nfs/dbraw/zinc/72/00/98/1131720098.db2.gz WBGDYCUKESNISU-WBVHZDCISA-N 1 3 264.457 3.563 20 0 CHADHO CC1(C)CCC[C@@H](N2CCC[C@@]3(CCCC[NH2+]3)C2)C1 ZINC001246616354 1131720100 /nfs/dbraw/zinc/72/01/00/1131720100.db2.gz WBGDYCUKESNISU-WBVHZDCISA-N 1 3 264.457 3.563 20 0 CHADHO CCC(CC)N1CCC([NH2+][C@@H](C)CCOCC(C)C)CC1 ZINC001172463829 1132243305 /nfs/dbraw/zinc/24/33/05/1132243305.db2.gz UPYMREPOYZRBER-INIZCTEOSA-N 1 3 298.515 3.680 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@H+]1CCCC[C@H](CN)C1 ZINC001206606579 1133726863 /nfs/dbraw/zinc/72/68/63/1133726863.db2.gz PYWPPOWDSWDBMO-DLBZAZTESA-N 1 3 298.515 3.669 20 0 CHADHO CCN(Cc1cccc(Cl)c1)C[C@H]1CCC[N@H+](C)C1 ZINC001208616989 1133918353 /nfs/dbraw/zinc/91/83/53/1133918353.db2.gz LTMAVWMUFNLCBB-HNNXBMFYSA-N 1 3 280.843 3.504 20 0 CHADHO CCN(Cc1cccc(Cl)c1)C[C@H]1CCC[N@@H+](C)C1 ZINC001208616989 1133918355 /nfs/dbraw/zinc/91/83/55/1133918355.db2.gz LTMAVWMUFNLCBB-HNNXBMFYSA-N 1 3 280.843 3.504 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2coc3ccccc23)[C@@H](C)C1 ZINC000245708755 1125591218 /nfs/dbraw/zinc/59/12/18/1125591218.db2.gz FQBNGQNQYPKFTG-WMLDXEAASA-N 1 3 286.419 3.595 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2coc3ccccc23)[C@@H](C)C1 ZINC000245708755 1125591224 /nfs/dbraw/zinc/59/12/24/1125591224.db2.gz FQBNGQNQYPKFTG-WMLDXEAASA-N 1 3 286.419 3.595 20 0 CHADHO CCC1([NH+]2CCC2)CCN(C[C@@H]2C[C@H]2c2ccccc2)CC1 ZINC000886717492 1125713189 /nfs/dbraw/zinc/71/31/89/1125713189.db2.gz BBLXCLMBQQPAAD-OALUTQOASA-N 1 3 298.474 3.740 20 0 CHADHO CCC1(N2CCC2)CC[NH+](C[C@@H]2C[C@H]2c2ccccc2)CC1 ZINC000886717492 1125713196 /nfs/dbraw/zinc/71/31/96/1125713196.db2.gz BBLXCLMBQQPAAD-OALUTQOASA-N 1 3 298.474 3.740 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@@H]2N(C)C[C@@]2(C)CC[NH2+]C2)cc1 ZINC000261701537 1125739669 /nfs/dbraw/zinc/73/96/69/1125739669.db2.gz CPYUYGOSZALLJI-FHWLQOOXSA-N 1 3 286.463 3.563 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@H](C)N(C)C[C@]1(C)CC[NH2+]C1 ZINC000261769209 1125742504 /nfs/dbraw/zinc/74/25/04/1125742504.db2.gz MLWKRTOIMZOASO-GRDNDAEWSA-N 1 3 294.870 3.763 20 0 CHADHO C[C@]1(C[NH3+])CCN(Cc2cccc(-c3ccccc3)c2)C1 ZINC000261856835 1125745683 /nfs/dbraw/zinc/74/56/83/1125745683.db2.gz RXLCKZLRSPFNAM-LJQANCHMSA-N 1 3 280.415 3.524 20 0 CHADHO CCCc1ccc(C[N@@H+]2CCCC23CCN(C)CC3)s1 ZINC000621723964 1129186396 /nfs/dbraw/zinc/18/63/96/1129186396.db2.gz WLHMZSBDGBZWQH-UHFFFAOYSA-N 1 3 292.492 3.761 20 0 CHADHO CCCc1ccc(C[N@H+]2CCCC23CCN(C)CC3)s1 ZINC000621723964 1129186398 /nfs/dbraw/zinc/18/63/98/1129186398.db2.gz WLHMZSBDGBZWQH-UHFFFAOYSA-N 1 3 292.492 3.761 20 0 CHADHO CN1CCCC[C@H]1CC[N@H+](C)[C@H]1CCc2ccc(F)cc21 ZINC000483062964 1126766215 /nfs/dbraw/zinc/76/62/15/1126766215.db2.gz LFMSEUISFLKLOZ-WMZOPIPTSA-N 1 3 290.426 3.619 20 0 CHADHO CN1CCCC[C@H]1CC[N@@H+](C)[C@H]1CCc2ccc(F)cc21 ZINC000483062964 1126766218 /nfs/dbraw/zinc/76/62/18/1126766218.db2.gz LFMSEUISFLKLOZ-WMZOPIPTSA-N 1 3 290.426 3.619 20 0 CHADHO COc1cccc([C@H](C)N[C@H](CC[NH+](C)C)C(C)(C)C)c1 ZINC000483183764 1126772450 /nfs/dbraw/zinc/77/24/50/1126772450.db2.gz JXQZXJBQVYHOSJ-WMLDXEAASA-N 1 3 292.467 3.712 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]CCC2CCCCC2)C1 ZINC000483313230 1126780290 /nfs/dbraw/zinc/78/02/90/1126780290.db2.gz JGIPSXMMMAPCJA-KRWDZBQOSA-N 1 3 266.473 3.667 20 0 CHADHO Cc1c(C)c(C)c(C[NH+]2CCC(N(C)C)CC2)c(C)c1C ZINC000483402572 1126784134 /nfs/dbraw/zinc/78/41/34/1126784134.db2.gz GTGYFXYJZIUVGE-UHFFFAOYSA-N 1 3 288.479 3.755 20 0 CHADHO C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+][C@H]1CCC[C@@H](N(C)C)C1 ZINC000484480418 1126821314 /nfs/dbraw/zinc/82/13/14/1126821314.db2.gz NPVIXUSVKAXUCB-BUIXCFAXSA-N 1 3 290.426 3.521 20 0 CHADHO C[C@@H](CC[N@@H+]1CCCC12CCNCC2)CC(C)(C)C ZINC001235141322 1130715232 /nfs/dbraw/zinc/71/52/32/1130715232.db2.gz QZEHIZXNPAQNRM-HNNXBMFYSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@@H](CC[N@H+]1CCCC12CCNCC2)CC(C)(C)C ZINC001235141322 1130715238 /nfs/dbraw/zinc/71/52/38/1130715238.db2.gz QZEHIZXNPAQNRM-HNNXBMFYSA-N 1 3 266.473 3.667 20 0 CHADHO CCC[C@@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)c1cccnc1 ZINC000185357855 1126899375 /nfs/dbraw/zinc/89/93/75/1126899375.db2.gz RJWFYQCKLYMQBD-SJLPKXTDSA-N 1 3 289.467 3.633 20 0 CHADHO CCC[C@@H](NC[C@H]1CC[N@H+](CC)C1)c1ccsc1 ZINC000191208499 1126948780 /nfs/dbraw/zinc/94/87/80/1126948780.db2.gz HLCSCXOAOCYUNW-UKRRQHHQSA-N 1 3 266.454 3.521 20 0 CHADHO CCC[C@@H](NC[C@H]1CC[N@@H+](CC)C1)c1ccsc1 ZINC000191208499 1126948781 /nfs/dbraw/zinc/94/87/81/1126948781.db2.gz HLCSCXOAOCYUNW-UKRRQHHQSA-N 1 3 266.454 3.521 20 0 CHADHO CCC[C@@H]([NH2+]C[C@H]1CCN(CC)C1)c1ccsc1 ZINC000191208499 1126948782 /nfs/dbraw/zinc/94/87/82/1126948782.db2.gz HLCSCXOAOCYUNW-UKRRQHHQSA-N 1 3 266.454 3.521 20 0 CHADHO CC[C@@H](NC[C@@H]1CCC[N@H+](CC)C1)c1cccs1 ZINC001319754032 1126984111 /nfs/dbraw/zinc/98/41/11/1126984111.db2.gz IXLLSTPDILHRDS-UONOGXRCSA-N 1 3 266.454 3.521 20 0 CHADHO CC[C@@H](NC[C@@H]1CCC[N@@H+](CC)C1)c1cccs1 ZINC001319754032 1126984113 /nfs/dbraw/zinc/98/41/13/1126984113.db2.gz IXLLSTPDILHRDS-UONOGXRCSA-N 1 3 266.454 3.521 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@@H](C)c1cccc(-c2ccncc2)c1 ZINC000268807054 1127024401 /nfs/dbraw/zinc/02/44/01/1127024401.db2.gz ABNFGWWOIOFAMD-CVEARBPZSA-N 1 3 297.446 3.739 20 0 CHADHO CC[N@H+](C)Cc1cccc(CN[C@H](C)c2cnccc2C)c1 ZINC000271588966 1127094112 /nfs/dbraw/zinc/09/41/12/1127094112.db2.gz SQPYWDNOOSMLKO-MRXNPFEDSA-N 1 3 297.446 3.693 20 0 CHADHO CC[N@@H+](C)Cc1cccc(CN[C@H](C)c2cnccc2C)c1 ZINC000271588966 1127094116 /nfs/dbraw/zinc/09/41/16/1127094116.db2.gz SQPYWDNOOSMLKO-MRXNPFEDSA-N 1 3 297.446 3.693 20 0 CHADHO CC(C)C(CN1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)C(C)C ZINC000572489930 1127201981 /nfs/dbraw/zinc/20/19/81/1127201981.db2.gz JUHCEHRWOYNVDA-LPHOPBHVSA-N 1 3 292.511 3.863 20 0 CHADHO CC(C)C(CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)C(C)C ZINC000572489930 1127201985 /nfs/dbraw/zinc/20/19/85/1127201985.db2.gz JUHCEHRWOYNVDA-LPHOPBHVSA-N 1 3 292.511 3.863 20 0 CHADHO Cc1ccnc([C@H](C)NCCCC[N@@H+]2CCCC[C@H]2C)c1 ZINC000285472532 1127230347 /nfs/dbraw/zinc/23/03/47/1127230347.db2.gz AXWCMCKSJQGELK-SJORKVTESA-N 1 3 289.467 3.695 20 0 CHADHO Cc1ccnc([C@H](C)NCCCC[N@H+]2CCCC[C@H]2C)c1 ZINC000285472532 1127230350 /nfs/dbraw/zinc/23/03/50/1127230350.db2.gz AXWCMCKSJQGELK-SJORKVTESA-N 1 3 289.467 3.695 20 0 CHADHO CC(C)[N@H+](C)CC1CCN(Cc2cccc(Cl)c2)CC1 ZINC000590786867 1127273401 /nfs/dbraw/zinc/27/34/01/1127273401.db2.gz DGCSKYGQYRZTMO-UHFFFAOYSA-N 1 3 294.870 3.892 20 0 CHADHO CC(C)[N@@H+](C)CC1CCN(Cc2cccc(Cl)c2)CC1 ZINC000590786867 1127273402 /nfs/dbraw/zinc/27/34/02/1127273402.db2.gz DGCSKYGQYRZTMO-UHFFFAOYSA-N 1 3 294.870 3.892 20 0 CHADHO CC[C@@H]1CCC[C@H]([NH2+]CC[C@H](C)N2CCCCC2)C1 ZINC001308365062 1127372802 /nfs/dbraw/zinc/37/28/02/1127372802.db2.gz CLTUZFHDNDFRQO-BBWFWOEESA-N 1 3 266.473 3.809 20 0 CHADHO CC[C@H]1CCC[C@@H](CN2CCC([NH2+]C3CCC3)CC2)C1 ZINC001308970074 1127621763 /nfs/dbraw/zinc/62/17/63/1127621763.db2.gz BJAKSGODTNEOIN-JKSUJKDBSA-N 1 3 278.484 3.809 20 0 CHADHO CC[C@@H](CC(F)F)CN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000659945179 1127665925 /nfs/dbraw/zinc/66/59/25/1127665925.db2.gz SYPRBKRUEYIMKL-GJZGRUSLSA-N 1 3 288.426 3.618 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)c1ccsc1 ZINC000297645653 1127703275 /nfs/dbraw/zinc/70/32/75/1127703275.db2.gz JXTVZHRFDSSKNA-GOEBONIOSA-N 1 3 280.481 3.909 20 0 CHADHO Cc1cccc(C)c1CN1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000606447706 1127762704 /nfs/dbraw/zinc/76/27/04/1127762704.db2.gz SPSUBEUIZGOSMS-GOSISDBHSA-N 1 3 286.463 3.754 20 0 CHADHO Cc1cc(C)cc(C2=CC[N@H+](CC[C@H]3CCCN3C)CC2)c1 ZINC000539884847 1127951458 /nfs/dbraw/zinc/95/14/58/1127951458.db2.gz FJRLRFQPZJDYDE-HXUWFJFHSA-N 1 3 298.474 3.877 20 0 CHADHO Cc1cc(C)cc(C2=CC[N@@H+](CC[C@H]3CCCN3C)CC2)c1 ZINC000539884847 1127951461 /nfs/dbraw/zinc/95/14/61/1127951461.db2.gz FJRLRFQPZJDYDE-HXUWFJFHSA-N 1 3 298.474 3.877 20 0 CHADHO CCC(C)(C)c1ccc(CN[C@@H]2CC[N@H+](C)C[C@@H]2C)cc1 ZINC000540153086 1127965088 /nfs/dbraw/zinc/96/50/88/1127965088.db2.gz DTVBQEIJHIQFOQ-MAUKXSAKSA-N 1 3 288.479 3.804 20 0 CHADHO CCC(C)(C)c1ccc(CN[C@@H]2CC[N@@H+](C)C[C@@H]2C)cc1 ZINC000540153086 1127965091 /nfs/dbraw/zinc/96/50/91/1127965091.db2.gz DTVBQEIJHIQFOQ-MAUKXSAKSA-N 1 3 288.479 3.804 20 0 CHADHO C[C@H]([NH2+]CC1(CN(C)C)CCCC1)c1cccc(F)c1 ZINC000544899238 1127988831 /nfs/dbraw/zinc/98/88/31/1127988831.db2.gz RYEGDMWGTBXFGB-AWEZNQCLSA-N 1 3 278.415 3.598 20 0 CHADHO Clc1cccc(Cl)c1C1(NCC2CC[NH2+]CC2)CC1 ZINC000469981386 1128059987 /nfs/dbraw/zinc/05/99/87/1128059987.db2.gz IGCCLYOLDQXKHA-UHFFFAOYSA-N 1 3 299.245 3.572 20 0 CHADHO CC(C)c1ccc(CCN[C@H]2CC[N@@H+]3CCCC[C@H]23)cc1 ZINC000470103640 1128063483 /nfs/dbraw/zinc/06/34/83/1128063483.db2.gz GXGBBELPGMIIQX-RBUKOAKNSA-N 1 3 286.463 3.569 20 0 CHADHO CC(C)c1ccc(CCN[C@H]2CC[N@H+]3CCCC[C@H]23)cc1 ZINC000470103640 1128063486 /nfs/dbraw/zinc/06/34/86/1128063486.db2.gz GXGBBELPGMIIQX-RBUKOAKNSA-N 1 3 286.463 3.569 20 0 CHADHO CC(C)CCN1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000303511186 1128070373 /nfs/dbraw/zinc/07/03/73/1128070373.db2.gz BLMMMZXKTCHWJA-IRXDYDNUSA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)CCN1CCC[C@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000303511186 1128070377 /nfs/dbraw/zinc/07/03/77/1128070377.db2.gz BLMMMZXKTCHWJA-IRXDYDNUSA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)CC[C@@H](C)[NH2+]CCCN1CCCC[C@H]1C ZINC000252173074 1128127384 /nfs/dbraw/zinc/12/73/84/1128127384.db2.gz OJFUJKXEAOUBNN-HZPDHXFCSA-N 1 3 254.462 3.665 20 0 CHADHO CCC1([NH3+])CCN([C@@H]2CC[C@@H](C)c3ccsc32)CC1 ZINC000925760803 1128141054 /nfs/dbraw/zinc/14/10/54/1128141054.db2.gz SESDNGUBTJNLMM-TZMCWYRMSA-N 1 3 278.465 3.890 20 0 CHADHO CC(C)CCC[C@H](C)[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000715232774 1128290326 /nfs/dbraw/zinc/29/03/26/1128290326.db2.gz AIQQNSVLOXTGOO-ARFHVFGLSA-N 1 3 254.462 3.664 20 0 CHADHO C[C@@H]1C[C@H](N[C@@H]2CCCc3c4ccccc4[nH]c32)CC[N@@H+]1C ZINC000316741943 1128335598 /nfs/dbraw/zinc/33/55/98/1128335598.db2.gz IARUVLWFJKZXKS-HBUWYVDXSA-N 1 3 297.446 3.618 20 0 CHADHO C[C@@H]1C[C@H](N[C@@H]2CCCc3c4ccccc4[nH]c32)CC[N@H+]1C ZINC000316741943 1128335603 /nfs/dbraw/zinc/33/56/03/1128335603.db2.gz IARUVLWFJKZXKS-HBUWYVDXSA-N 1 3 297.446 3.618 20 0 CHADHO CC[C@@H](c1ccccc1)[NH+]1CCC(C)(N(C)C)CC1 ZINC000931350534 1128357632 /nfs/dbraw/zinc/35/76/32/1128357632.db2.gz NNRWUYDAJBKAPW-INIZCTEOSA-N 1 3 260.425 3.554 20 0 CHADHO CN(C)C1(C)CC[NH+](CC[C@@H]2CCc3ccccc32)CC1 ZINC000931356193 1128357919 /nfs/dbraw/zinc/35/79/19/1128357919.db2.gz ZMZHYPUACDPIKG-KRWDZBQOSA-N 1 3 286.463 3.523 20 0 CHADHO CCCC[C@@H](CC)N1CCC([N@H+](C)C2CCOCC2)CC1 ZINC001257425501 1128358398 /nfs/dbraw/zinc/35/83/98/1128358398.db2.gz SKPALWRSRVDDJY-MRXNPFEDSA-N 1 3 296.499 3.530 20 0 CHADHO CCCC[C@@H](CC)N1CCC([N@@H+](C)C2CCOCC2)CC1 ZINC001257425501 1128358401 /nfs/dbraw/zinc/35/84/01/1128358401.db2.gz SKPALWRSRVDDJY-MRXNPFEDSA-N 1 3 296.499 3.530 20 0 CHADHO FC1(CC[NH2+]C2CCN(C3CCCCC3)CC2)CCC1 ZINC000562059006 1128375102 /nfs/dbraw/zinc/37/51/02/1128375102.db2.gz ZDSBQMLMKFRVNX-UHFFFAOYSA-N 1 3 282.447 3.655 20 0 CHADHO C[C@H](C[NH2+]C1CCN(CC2CCCC2)CC1)C(C)(C)C ZINC000670267224 1128379047 /nfs/dbraw/zinc/37/90/47/1128379047.db2.gz WFDQOWHWRDTPKU-OAHLLOKOSA-N 1 3 280.500 3.913 20 0 CHADHO C[C@@H]1C[C@H](N(C)Cc2ccc3ccccc3c2)CC[N@@H+]1C ZINC000123342684 1128410605 /nfs/dbraw/zinc/41/06/05/1128410605.db2.gz VDUVNDUAWYGGFI-DNVCBOLYSA-N 1 3 282.431 3.754 20 0 CHADHO C[C@@H]1C[C@H](N(C)Cc2ccc3ccccc3c2)CC[N@H+]1C ZINC000123342684 1128410606 /nfs/dbraw/zinc/41/06/06/1128410606.db2.gz VDUVNDUAWYGGFI-DNVCBOLYSA-N 1 3 282.431 3.754 20 0 CHADHO Cc1c2ccccc2oc1[C@@H](C)[NH2+]CC(C)(C)CN(C)C ZINC000037197126 1128421872 /nfs/dbraw/zinc/42/18/72/1128421872.db2.gz NLFIGPUQQGATNO-CQSZACIVSA-N 1 3 288.435 3.980 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCc1ccc(-c2ccc(F)cc2)s1 ZINC000563135060 1128451575 /nfs/dbraw/zinc/45/15/75/1128451575.db2.gz DSYJWRHZALBCNI-NEPJUHHUSA-N 1 3 292.423 3.770 20 0 CHADHO Cc1cccc2c1CC[C@@H]2[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000125752707 1128452809 /nfs/dbraw/zinc/45/28/09/1128452809.db2.gz LDRFNBYFVLPZLI-APWZRJJASA-N 1 3 286.463 3.692 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H]2c3ccccc3C[C@H]2C)C1 ZINC000125814180 1128454152 /nfs/dbraw/zinc/45/41/52/1128454152.db2.gz PMMKVJYJQKVAGS-GJYPPUQNSA-N 1 3 286.463 3.630 20 0 CHADHO CC(C)[N@@H+]1CCC[C@@H](CN[C@@H]2c3ccccc3C[C@H]2C)C1 ZINC000125814180 1128454153 /nfs/dbraw/zinc/45/41/53/1128454153.db2.gz PMMKVJYJQKVAGS-GJYPPUQNSA-N 1 3 286.463 3.630 20 0 CHADHO CC(C)[N@H+]1CCC[C@@H](CN[C@@H]2c3ccccc3C[C@H]2C)C1 ZINC000125814180 1128454154 /nfs/dbraw/zinc/45/41/54/1128454154.db2.gz PMMKVJYJQKVAGS-GJYPPUQNSA-N 1 3 286.463 3.630 20 0 CHADHO Cc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)CC2 ZINC000125909375 1128456535 /nfs/dbraw/zinc/45/65/35/1128456535.db2.gz GAOZNJKUVURGDN-VQIMIIECSA-N 1 3 286.463 3.692 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCc1ccc(F)c(-c2cccs2)c1 ZINC000564084361 1128492721 /nfs/dbraw/zinc/49/27/21/1128492721.db2.gz JXAZRTWVXKETIK-VXGBXAGGSA-N 1 3 292.423 3.770 20 0 CHADHO CC1=C[C@@H](C)C[C@@H](C[N@@H+]2CCCC23CCN(C)CC3)C1 ZINC000565140317 1128520505 /nfs/dbraw/zinc/52/05/05/1128520505.db2.gz LIZCCAWBCBUXHL-NVXWUHKLSA-N 1 3 276.468 3.539 20 0 CHADHO CC1=C[C@@H](C)C[C@@H](C[N@H+]2CCCC23CCN(C)CC3)C1 ZINC000565140317 1128520508 /nfs/dbraw/zinc/52/05/08/1128520508.db2.gz LIZCCAWBCBUXHL-NVXWUHKLSA-N 1 3 276.468 3.539 20 0 CHADHO CC1=C[C@H](C)C[C@H](C[N@@H+]2CCCC23CCN(C)CC3)C1 ZINC000565140318 1128520839 /nfs/dbraw/zinc/52/08/39/1128520839.db2.gz LIZCCAWBCBUXHL-RDJZCZTQSA-N 1 3 276.468 3.539 20 0 CHADHO CC1=C[C@H](C)C[C@H](C[N@H+]2CCCC23CCN(C)CC3)C1 ZINC000565140318 1128520842 /nfs/dbraw/zinc/52/08/42/1128520842.db2.gz LIZCCAWBCBUXHL-RDJZCZTQSA-N 1 3 276.468 3.539 20 0 CHADHO CC1=C[C@H](C)C[C@@H](C[N@@H+]2CCCC23CCN(C)CC3)C1 ZINC000565140316 1128521084 /nfs/dbraw/zinc/52/10/84/1128521084.db2.gz LIZCCAWBCBUXHL-DOTOQJQBSA-N 1 3 276.468 3.539 20 0 CHADHO CC1=C[C@H](C)C[C@@H](C[N@H+]2CCCC23CCN(C)CC3)C1 ZINC000565140316 1128521086 /nfs/dbraw/zinc/52/10/86/1128521086.db2.gz LIZCCAWBCBUXHL-DOTOQJQBSA-N 1 3 276.468 3.539 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1C[NH2+]C1CCN(C2CCCC2)CC1 ZINC000152615999 1128548204 /nfs/dbraw/zinc/54/82/04/1128548204.db2.gz AHSYFXUSEXFXJU-LPHOPBHVSA-N 1 3 290.495 3.975 20 0 CHADHO C[C@@H]1CCC[C@H](N2CCC([NH2+][C@@H]3CCC[C@H](F)C3)CC2)C1 ZINC000567048018 1128556989 /nfs/dbraw/zinc/55/69/89/1128556989.db2.gz HCJLOTMEFCAOKZ-ATLSCFEFSA-N 1 3 296.474 3.900 20 0 CHADHO CCC[NH2+][C@H](C)c1ccc(OC)c(CN2CCCCC2)c1 ZINC000043814581 1128609860 /nfs/dbraw/zinc/60/98/60/1128609860.db2.gz KBOJYOSRLLTWBA-OAHLLOKOSA-N 1 3 290.451 3.742 20 0 CHADHO c1ccc(C2CCC(C[N@@H+]3C[C@@H]4CCCN[C@@H]4C3)CC2)cc1 ZINC000570858573 1128633300 /nfs/dbraw/zinc/63/33/00/1128633300.db2.gz CZCJSZZMEIWVIL-DXBWTPJFSA-N 1 3 298.474 3.644 20 0 CHADHO c1ccc(C2CCC(C[N@H+]3C[C@@H]4CCCN[C@@H]4C3)CC2)cc1 ZINC000570858573 1128633301 /nfs/dbraw/zinc/63/33/01/1128633301.db2.gz CZCJSZZMEIWVIL-DXBWTPJFSA-N 1 3 298.474 3.644 20 0 CHADHO CC(C)CCCC[NH2+]C1CCN(C2CCCC2)CC1 ZINC000157071102 1128646770 /nfs/dbraw/zinc/64/67/70/1128646770.db2.gz FGIIVZBNNGYZQY-UHFFFAOYSA-N 1 3 266.473 3.809 20 0 CHADHO CC(C)CN1CCC([NH2+]CC2(CC3CCC3)CC2)CC1 ZINC001258008568 1128672888 /nfs/dbraw/zinc/67/28/88/1128672888.db2.gz XAXYHKJRGQXLMN-UHFFFAOYSA-N 1 3 278.484 3.667 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H]2CCCCC23CCCC3)C1 ZINC000578650183 1128725371 /nfs/dbraw/zinc/72/53/71/1128725371.db2.gz GSZOFDCRRDRDQM-DLBZAZTESA-N 1 3 278.484 3.811 20 0 CHADHO Cc1cccc(C[C@@H]([NH2+][C@H]2CCNC3(CCC3)C2)C2CC2)c1 ZINC000643546030 1117792797 /nfs/dbraw/zinc/79/27/97/1117792797.db2.gz HFMBKHICEVFQEO-RBUKOAKNSA-N 1 3 298.474 3.580 20 0 CHADHO C[N@@H+]1CC[C@H](N[C@H](c2cccs2)C2CC2)CC1(C)C ZINC000623345210 1117836774 /nfs/dbraw/zinc/83/67/74/1117836774.db2.gz WFGYCVLEQSXIGU-ZFWWWQNUSA-N 1 3 278.465 3.662 20 0 CHADHO C[N@H+]1CC[C@H](N[C@H](c2cccs2)C2CC2)CC1(C)C ZINC000623345210 1117836782 /nfs/dbraw/zinc/83/67/82/1117836782.db2.gz WFGYCVLEQSXIGU-ZFWWWQNUSA-N 1 3 278.465 3.662 20 0 CHADHO C[N@@H+]1CC[C@H](N[C@@H](c2ccccc2)C2CC2)CC1(C)C ZINC000623344914 1117837871 /nfs/dbraw/zinc/83/78/71/1117837871.db2.gz IFWAWAZDODBSLU-IRXDYDNUSA-N 1 3 272.436 3.600 20 0 CHADHO C[N@H+]1CC[C@H](N[C@@H](c2ccccc2)C2CC2)CC1(C)C ZINC000623344914 1117837873 /nfs/dbraw/zinc/83/78/73/1117837873.db2.gz IFWAWAZDODBSLU-IRXDYDNUSA-N 1 3 272.436 3.600 20 0 CHADHO Cc1cccc([C@H](C)N[C@H]2CC[N@H+](C)C(C)(C)C2)c1C ZINC000623420815 1117853941 /nfs/dbraw/zinc/85/39/41/1117853941.db2.gz PGELICKWPCGAII-HOTGVXAUSA-N 1 3 274.452 3.827 20 0 CHADHO Cc1cccc([C@H](C)N[C@H]2CC[N@@H+](C)C(C)(C)C2)c1C ZINC000623420815 1117853947 /nfs/dbraw/zinc/85/39/47/1117853947.db2.gz PGELICKWPCGAII-HOTGVXAUSA-N 1 3 274.452 3.827 20 0 CHADHO CN1CC[C@@H]([NH2+]Cc2ccc(C(F)F)cc2)CC1(C)C ZINC000623493686 1117861977 /nfs/dbraw/zinc/86/19/77/1117861977.db2.gz OFQUDCKORXOVPK-CQSZACIVSA-N 1 3 282.378 3.587 20 0 CHADHO CN1CC[C@@H]([NH2+]Cc2ccc(C(C)(F)F)cc2)CC1(C)C ZINC000623532354 1117869038 /nfs/dbraw/zinc/86/90/38/1117869038.db2.gz OHSONNSFCZEHAB-OAHLLOKOSA-N 1 3 296.405 3.761 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccc(Cl)cc1 ZINC000623657059 1117885045 /nfs/dbraw/zinc/88/50/45/1117885045.db2.gz IZWVFUJEYCZIKE-KBPBESRZSA-N 1 3 280.843 3.723 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CCc2c[nH]c3ccccc23)CC1 ZINC000178093412 1117885457 /nfs/dbraw/zinc/88/54/57/1117885457.db2.gz SUYGHTVFTURSSD-UHFFFAOYSA-N 1 3 299.462 3.563 20 0 CHADHO CC(C)Oc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCCN2C)cc1 ZINC000179535535 1117907824 /nfs/dbraw/zinc/90/78/24/1117907824.db2.gz YINPIIHMLYDOKZ-WBVHZDCISA-N 1 3 290.451 3.609 20 0 CHADHO CC/C=C\CC[N@@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001208729312 1117920481 /nfs/dbraw/zinc/92/04/81/1117920481.db2.gz SMNOEDAGSKDWDJ-CWIOURORSA-N 1 3 264.457 3.683 20 0 CHADHO CCC[NH+]1CCC(NC2(c3ccccc3)CCC2)CC1 ZINC000180350447 1117927573 /nfs/dbraw/zinc/92/75/73/1117927573.db2.gz BJPVTJCXVQIXME-UHFFFAOYSA-N 1 3 272.436 3.530 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N[C@@H]1CCCc2scnc21 ZINC000623848856 1117943072 /nfs/dbraw/zinc/94/30/72/1117943072.db2.gz NFJRSPRTAOYESN-UONOGXRCSA-N 1 3 295.496 3.621 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1cccc(Cl)c1 ZINC000624119845 1117983708 /nfs/dbraw/zinc/98/37/08/1117983708.db2.gz KVUBKYNHKHFSEE-KGLIPLIRSA-N 1 3 280.843 3.723 20 0 CHADHO Cc1ccc(CC[C@@H](C)[NH2+]C[C@H]2CCCCN(C)C2)cc1 ZINC000624120854 1117985129 /nfs/dbraw/zinc/98/51/29/1117985129.db2.gz IMCATEHOGOLJDT-IEBWSBKVSA-N 1 3 288.479 3.638 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1nccc2ccccc21 ZINC000624123569 1117987327 /nfs/dbraw/zinc/98/73/27/1117987327.db2.gz OGXPHMDXKJZKOF-HZPDHXFCSA-N 1 3 297.446 3.617 20 0 CHADHO C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCCN(C)C2)c2ccccc21 ZINC000624123331 1117987594 /nfs/dbraw/zinc/98/75/94/1117987594.db2.gz JYONPNPOVWKHCG-RKVPGOIHSA-N 1 3 272.436 3.556 20 0 CHADHO CCCC[C@@H](CC)CN1CCC([NH2+]C(C)C)CC1 ZINC000183637465 1118047553 /nfs/dbraw/zinc/04/75/53/1118047553.db2.gz PEIISTNHNJYNRH-OAHLLOKOSA-N 1 3 254.462 3.665 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H](C)CCC(C)(C)C)C1 ZINC000579620816 1128753299 /nfs/dbraw/zinc/75/32/99/1128753299.db2.gz CXMCFARMQMXPBY-HOTGVXAUSA-N 1 3 268.489 3.911 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)c1cccc2ccccc21)CN(C)C ZINC000380423377 1118069746 /nfs/dbraw/zinc/06/97/46/1118069746.db2.gz IJAJHGKORJTMSV-CABCVRRESA-N 1 3 270.420 3.688 20 0 CHADHO C[C@@H](NC[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000076446146 1118071840 /nfs/dbraw/zinc/07/18/40/1118071840.db2.gz QDMKBJFKYUIRML-IEBWSBKVSA-N 1 3 294.442 3.859 20 0 CHADHO C[C@@H](NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000076446146 1118071845 /nfs/dbraw/zinc/07/18/45/1118071845.db2.gz QDMKBJFKYUIRML-IEBWSBKVSA-N 1 3 294.442 3.859 20 0 CHADHO C[C@H](NC[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000076446141 1118072571 /nfs/dbraw/zinc/07/25/71/1118072571.db2.gz QDMKBJFKYUIRML-PKOBYXMFSA-N 1 3 294.442 3.859 20 0 CHADHO C[C@H](NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000076446141 1118072576 /nfs/dbraw/zinc/07/25/76/1118072576.db2.gz QDMKBJFKYUIRML-PKOBYXMFSA-N 1 3 294.442 3.859 20 0 CHADHO C[C@@H]1C[C@@H](N[C@H]2CCCc3c(Cl)cccc32)CC[N@@H+]1C ZINC000542662798 1118194831 /nfs/dbraw/zinc/19/48/31/1118194831.db2.gz LLAXWOFCNRUDHE-IGCXYCKISA-N 1 3 292.854 3.790 20 0 CHADHO C[C@@H]1C[C@@H](N[C@H]2CCCc3c(Cl)cccc32)CC[N@H+]1C ZINC000542662798 1118194833 /nfs/dbraw/zinc/19/48/33/1118194833.db2.gz LLAXWOFCNRUDHE-IGCXYCKISA-N 1 3 292.854 3.790 20 0 CHADHO CCCCCC[C@H](C)[NH2+][C@H]1CCC[C@H](N(C)C)C1 ZINC000715508939 1118307580 /nfs/dbraw/zinc/30/75/80/1118307580.db2.gz LTKUUMCWXPKYHH-JYJNAYRXSA-N 1 3 254.462 3.808 20 0 CHADHO CC[C@H](C)C[N@H+](Cc1ccc(Cl)cc1)C1CCNCC1 ZINC001236453462 1128771398 /nfs/dbraw/zinc/77/13/98/1128771398.db2.gz ROSILYUVZDXTGI-AWEZNQCLSA-N 1 3 294.870 3.940 20 0 CHADHO CC[C@H](C)C[N@@H+](Cc1ccc(Cl)cc1)C1CCNCC1 ZINC001236453462 1128771400 /nfs/dbraw/zinc/77/14/00/1128771400.db2.gz ROSILYUVZDXTGI-AWEZNQCLSA-N 1 3 294.870 3.940 20 0 CHADHO C[NH+](C)CC[C@H](NCc1ccc2cnccc2c1)C(C)(C)C ZINC000683773072 1118354665 /nfs/dbraw/zinc/35/46/65/1118354665.db2.gz VLOMVYDKQHCAHU-SFHVURJKSA-N 1 3 299.462 3.691 20 0 CHADHO NC[C@H]1CCCC[C@H]1[NH2+]C1CCC(c2ccccc2)CC1 ZINC000089141227 1118528896 /nfs/dbraw/zinc/52/88/96/1118528896.db2.gz RKDZTDLYCRFSIM-JWHDQAAXSA-N 1 3 286.463 3.820 20 0 CHADHO C[C@@H](c1cccs1)N(C)Cc1cccc2c1CC[NH2+]C2 ZINC000123935276 1118577943 /nfs/dbraw/zinc/57/79/43/1118577943.db2.gz VXMJLVMRNVMSDH-ZDUSSCGKSA-N 1 3 286.444 3.587 20 0 CHADHO C[C@@H](N[C@@H](C)C1CC[NH+](C)CC1)c1c(F)cccc1Cl ZINC000090180457 1118623077 /nfs/dbraw/zinc/62/30/77/1118623077.db2.gz JEVFBZXAFWFQSY-NWDGAFQWSA-N 1 3 298.833 3.860 20 0 CHADHO C[C@H](N[C@@H](C)C1CC[NH+](C)CC1)c1c(F)cccc1Cl ZINC000090180456 1118623174 /nfs/dbraw/zinc/62/31/74/1118623174.db2.gz JEVFBZXAFWFQSY-RYUDHWBXSA-N 1 3 298.833 3.860 20 0 CHADHO CC[C@@H]1CC[C@H](C)C[C@H]1[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000430722602 1118765406 /nfs/dbraw/zinc/76/54/06/1118765406.db2.gz QRTDRHYQPMWSCY-WNRNVDISSA-N 1 3 280.500 3.911 20 0 CHADHO C[C@H](C[NH2+]C1CCC2(CCCC2)CC1)CN1CCCC1 ZINC000129385711 1118809965 /nfs/dbraw/zinc/80/99/65/1118809965.db2.gz ODGDJWADLFFLDJ-MRXNPFEDSA-N 1 3 278.484 3.811 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCCc3cc(F)ccc32)C1 ZINC000341719567 1118813727 /nfs/dbraw/zinc/81/37/27/1118813727.db2.gz CJNHZWPFNRDGFO-JZXOWHBKSA-N 1 3 290.426 3.666 20 0 CHADHO C[N@H+](C[C@H]1CCCNC1)C1CCC(c2ccccc2)CC1 ZINC000226436668 1118927586 /nfs/dbraw/zinc/92/75/86/1118927586.db2.gz ZHWDRPBYAZTIFR-IVMQYODDSA-N 1 3 286.463 3.644 20 0 CHADHO C[N@@H+](C[C@H]1CCCNC1)C1CCC(c2ccccc2)CC1 ZINC000226436668 1118927587 /nfs/dbraw/zinc/92/75/87/1118927587.db2.gz ZHWDRPBYAZTIFR-IVMQYODDSA-N 1 3 286.463 3.644 20 0 CHADHO C([NH2+][C@H]1CCC[C@@H](C2CC2)C1)[C@@H]1CCCN(CC2CC2)C1 ZINC000663472153 1119157985 /nfs/dbraw/zinc/15/79/85/1119157985.db2.gz ZBZWEOLRCHMUJR-UHOSZYNNSA-N 1 3 290.495 3.667 20 0 CHADHO C([NH2+]C1CCN(C2CCCCC2)CC1)[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000657657082 1119229316 /nfs/dbraw/zinc/22/93/16/1119229316.db2.gz NWEDLUGBNPIDJN-GJYPPUQNSA-N 1 3 290.495 3.809 20 0 CHADHO CCSc1ccc([C@@H](C)NC[C@@H]2CCC[N@@H+]2CC)cc1 ZINC000535990247 1119337643 /nfs/dbraw/zinc/33/76/43/1119337643.db2.gz WZEUNXLWQFYYIT-ZBFHGGJFSA-N 1 3 292.492 3.934 20 0 CHADHO CCSc1ccc([C@@H](C)NC[C@@H]2CCC[N@H+]2CC)cc1 ZINC000535990247 1119337647 /nfs/dbraw/zinc/33/76/47/1119337647.db2.gz WZEUNXLWQFYYIT-ZBFHGGJFSA-N 1 3 292.492 3.934 20 0 CHADHO CCSc1ccc([C@@H](C)NC[C@H]2CCC[N@@H+]2CC)cc1 ZINC000535990244 1119337731 /nfs/dbraw/zinc/33/77/31/1119337731.db2.gz WZEUNXLWQFYYIT-GDBMZVCRSA-N 1 3 292.492 3.934 20 0 CHADHO CCSc1ccc([C@@H](C)NC[C@H]2CCC[N@H+]2CC)cc1 ZINC000535990244 1119337732 /nfs/dbraw/zinc/33/77/32/1119337732.db2.gz WZEUNXLWQFYYIT-GDBMZVCRSA-N 1 3 292.492 3.934 20 0 CHADHO CCC[C@H](NC[C@H]1CC[N@H+](CCC)C1)c1ccccc1 ZINC000151094498 1119393161 /nfs/dbraw/zinc/39/31/61/1119393161.db2.gz NWRGRGQINNVIRD-AEFFLSMTSA-N 1 3 274.452 3.849 20 0 CHADHO CCC[C@H](NC[C@H]1CC[N@@H+](CCC)C1)c1ccccc1 ZINC000151094498 1119393163 /nfs/dbraw/zinc/39/31/63/1119393163.db2.gz NWRGRGQINNVIRD-AEFFLSMTSA-N 1 3 274.452 3.849 20 0 CHADHO CCC[C@H]([NH2+]C[C@H]1CCN(CCC)C1)c1ccccc1 ZINC000151094498 1119393165 /nfs/dbraw/zinc/39/31/65/1119393165.db2.gz NWRGRGQINNVIRD-AEFFLSMTSA-N 1 3 274.452 3.849 20 0 CHADHO c1coc(CCCNC2CC[NH+](C3CCCCC3)CC2)c1 ZINC000657782690 1119394449 /nfs/dbraw/zinc/39/44/49/1119394449.db2.gz MXEHEGPARDNNBM-UHFFFAOYSA-N 1 3 290.451 3.599 20 0 CHADHO c1coc(CCC[NH2+]C2CCN(C3CCCCC3)CC2)c1 ZINC000657782690 1119394452 /nfs/dbraw/zinc/39/44/52/1119394452.db2.gz MXEHEGPARDNNBM-UHFFFAOYSA-N 1 3 290.451 3.599 20 0 CHADHO CCC[C@@H](NCc1ccc(C[NH3+])cc1F)c1ccccc1 ZINC000650752144 1119408392 /nfs/dbraw/zinc/40/83/92/1119408392.db2.gz KGRRNOKELCMWMA-GOSISDBHSA-N 1 3 286.394 3.915 20 0 CHADHO C[C@@H]1CC([N@@H+]2CCC[C@H]2C2CCCCC2)C[C@@H](C)N1 ZINC000708386416 1119423893 /nfs/dbraw/zinc/42/38/93/1119423893.db2.gz MIINRQHBYMWJFW-CPUCHLNUSA-N 1 3 264.457 3.560 20 0 CHADHO C[C@@H]1CC([N@H+]2CCC[C@H]2C2CCCCC2)C[C@@H](C)N1 ZINC000708386416 1119423895 /nfs/dbraw/zinc/42/38/95/1119423895.db2.gz MIINRQHBYMWJFW-CPUCHLNUSA-N 1 3 264.457 3.560 20 0 CHADHO Clc1cccc(C2CCN(C[C@@H]3CCC[NH2+]C3)CC2)c1 ZINC000261805730 1119440428 /nfs/dbraw/zinc/44/04/28/1119440428.db2.gz HILPYIQCROMDPF-CQSZACIVSA-N 1 3 292.854 3.519 20 0 CHADHO C[C@H]1CC[N@@H+](C2CCC(C(C)(C)C)CC2)C[C@H]1CN ZINC000253189697 1119460315 /nfs/dbraw/zinc/46/03/15/1119460315.db2.gz KLJXZITYCNEUGT-QRNKSROTSA-N 1 3 266.473 3.508 20 0 CHADHO C[C@H]1CC[N@H+](C2CCC(C(C)(C)C)CC2)C[C@H]1CN ZINC000253189697 1119460317 /nfs/dbraw/zinc/46/03/17/1119460317.db2.gz KLJXZITYCNEUGT-QRNKSROTSA-N 1 3 266.473 3.508 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H](N(C)C)C2)c2ccccc21 ZINC000343593407 1119464350 /nfs/dbraw/zinc/46/43/50/1119464350.db2.gz AWVWCPSNVSOOTD-BSXFFOKHSA-N 1 3 272.436 3.697 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCCC[C@H]1C)C(C)(C)C(F)F ZINC000657824545 1119468411 /nfs/dbraw/zinc/46/84/11/1119468411.db2.gz UOCTXSGOHRWBDX-CHWSQXEVSA-N 1 3 276.415 3.520 20 0 CHADHO C[C@H](NCCC[N@H+](C)C1CCCCC1)C(C)(C)C(F)F ZINC000657829769 1119478255 /nfs/dbraw/zinc/47/82/55/1119478255.db2.gz HZIANESCIFCFPF-ZDUSSCGKSA-N 1 3 290.442 3.910 20 0 CHADHO C[C@H](NCCC[N@@H+](C)C1CCCCC1)C(C)(C)C(F)F ZINC000657829769 1119478256 /nfs/dbraw/zinc/47/82/56/1119478256.db2.gz HZIANESCIFCFPF-ZDUSSCGKSA-N 1 3 290.442 3.910 20 0 CHADHO CCCCC[C@H](C)[NH2+]CCCN1CCCC[C@H]1C ZINC000250819678 1119497878 /nfs/dbraw/zinc/49/78/78/1119497878.db2.gz KRHOFVWLKKLGMJ-JKSUJKDBSA-N 1 3 254.462 3.809 20 0 CHADHO CCCc1ccc(CN2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)cc1 ZINC000538691836 1119591997 /nfs/dbraw/zinc/59/19/97/1119591997.db2.gz QTHGGHOQNYBGDM-RBUKOAKNSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1ccc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc1 ZINC000538691836 1119592000 /nfs/dbraw/zinc/59/20/00/1119592000.db2.gz QTHGGHOQNYBGDM-RBUKOAKNSA-N 1 3 286.463 3.555 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1cc([O-])cc(F)c1 ZINC000924526486 1119693860 /nfs/dbraw/zinc/69/38/60/1119693860.db2.gz GAEWHAUVKZQWHB-ZIAGYGMSSA-N 1 3 296.430 3.692 20 0 CHADHO C[C@@H]1CCCC[C@H]1[NH+]1CCC(NCCC(C)(C)F)CC1 ZINC000658192277 1119699732 /nfs/dbraw/zinc/69/97/32/1119699732.db2.gz FDOWPJODDSEUQH-GDBMZVCRSA-N 1 3 284.463 3.757 20 0 CHADHO CC(C)c1ccc(C[N@@H+]2CCC[C@H]3CN(C)CC[C@H]32)cc1 ZINC000570320068 1119819694 /nfs/dbraw/zinc/81/96/94/1119819694.db2.gz YCUDVRHGEFXMQP-RBUKOAKNSA-N 1 3 286.463 3.726 20 0 CHADHO CC(C)c1ccc(C[N@H+]2CCC[C@H]3CN(C)CC[C@H]32)cc1 ZINC000570320068 1119819697 /nfs/dbraw/zinc/81/96/97/1119819697.db2.gz YCUDVRHGEFXMQP-RBUKOAKNSA-N 1 3 286.463 3.726 20 0 CHADHO CC(C)c1ccc(CN2CCC[C@H]3C[N@H+](C)CC[C@H]32)cc1 ZINC000570320068 1119819701 /nfs/dbraw/zinc/81/97/01/1119819701.db2.gz YCUDVRHGEFXMQP-RBUKOAKNSA-N 1 3 286.463 3.726 20 0 CHADHO CC(C)c1ccc(CN2CCC[C@H]3C[N@@H+](C)CC[C@H]32)cc1 ZINC000570320068 1119819705 /nfs/dbraw/zinc/81/97/05/1119819705.db2.gz YCUDVRHGEFXMQP-RBUKOAKNSA-N 1 3 286.463 3.726 20 0 CHADHO C[C@@H](N[C@@H](C)c1cccc(C[NH+](C)C)c1)c1cccnc1 ZINC000924565013 1119862008 /nfs/dbraw/zinc/86/20/08/1119862008.db2.gz QVFQALKEHRMISB-LSDHHAIUSA-N 1 3 283.419 3.555 20 0 CHADHO c1ccc2c(c1)CC[C@H]2C[NH2+]C1CCN(C2CCCC2)CC1 ZINC000161000137 1119964610 /nfs/dbraw/zinc/96/46/10/1119964610.db2.gz GGHZVCZRYNEAHC-KRWDZBQOSA-N 1 3 298.474 3.713 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)[C@@H]1CC2CCC1CC2)CN1CCCC1 ZINC000381595016 1128882075 /nfs/dbraw/zinc/88/20/75/1128882075.db2.gz FGKGJMKDJRKTJN-VGAKTEPXSA-N 1 3 278.484 3.523 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@@H]2CCc3c2cccc3Cl)C1 ZINC000624121148 1120075709 /nfs/dbraw/zinc/07/57/09/1120075709.db2.gz PFJWVGCUEKBJEA-CXAGYDPISA-N 1 3 292.854 3.649 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+]C2CCC3(CCCC3)CC2)C1 ZINC000715578299 1120131440 /nfs/dbraw/zinc/13/14/40/1120131440.db2.gz FCWHCYHALBZGCK-IAGOWNOFSA-N 1 3 278.484 3.952 20 0 CHADHO c1csc([C@H](N[C@H]2CCC[NH2+]CC2)C2CCCC2)c1 ZINC000129085562 1120253185 /nfs/dbraw/zinc/25/31/85/1120253185.db2.gz AAUHJEGRQOQEBZ-GOEBONIOSA-N 1 3 278.465 3.711 20 0 CHADHO C[NH+](C)Cc1ccc(CN[C@@H]2CCc3ccc(F)cc32)cc1 ZINC000106478223 1120267790 /nfs/dbraw/zinc/26/77/90/1120267790.db2.gz CDRAJQKLJAWRNJ-LJQANCHMSA-N 1 3 298.405 3.664 20 0 CHADHO CCC(F)(F)C(C)(C)CN[C@@H](Cc1ccccc1)[C@@H](C)[NH3+] ZINC000629531341 1128914211 /nfs/dbraw/zinc/91/42/11/1128914211.db2.gz HWPGDHITNWKFED-HIFRSBDPSA-N 1 3 298.421 3.606 20 0 CHADHO C[C@H]1CC[NH2+]CC[C@H]1N[C@@H]1CCCc2ccc(Cl)cc21 ZINC000629556422 1128915663 /nfs/dbraw/zinc/91/56/63/1128915663.db2.gz PJMHHRMLMGUKKA-JCURWCKSSA-N 1 3 292.854 3.695 20 0 CHADHO N[C@@H]1C[C@@H]([NH2+]CC2(C(F)(F)F)CCCC2)c2ccccc21 ZINC000629551982 1128915864 /nfs/dbraw/zinc/91/58/64/1128915864.db2.gz ZCALOSOFEMLKPB-ZIAGYGMSSA-N 1 3 298.352 3.844 20 0 CHADHO CC(C)=CCC[NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000660257017 1120470004 /nfs/dbraw/zinc/47/00/04/1120470004.db2.gz PWZCBOHDTKVYQG-JKSUJKDBSA-N 1 3 264.457 3.585 20 0 CHADHO CC(C)=CCC[NH2+][C@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000660257014 1120470086 /nfs/dbraw/zinc/47/00/86/1120470086.db2.gz PWZCBOHDTKVYQG-CVEARBPZSA-N 1 3 264.457 3.585 20 0 CHADHO Cc1c2[nH]cnc2ccc1NCCC[N@H+]1CCCC[C@@H]1C ZINC001167752923 1120545854 /nfs/dbraw/zinc/54/58/54/1120545854.db2.gz IYQIOSXOQOASNJ-ZDUSSCGKSA-N 1 3 286.423 3.548 20 0 CHADHO Cc1c2[nH]cnc2ccc1NCCC[N@@H+]1CCCC[C@@H]1C ZINC001167752923 1120545855 /nfs/dbraw/zinc/54/58/55/1120545855.db2.gz IYQIOSXOQOASNJ-ZDUSSCGKSA-N 1 3 286.423 3.548 20 0 CHADHO CC[N@@H+]1CCC[C@H]1CN[C@@H](C)c1ccc(SC)cc1 ZINC000019960915 1120553966 /nfs/dbraw/zinc/55/39/66/1120553966.db2.gz UEIBCRSWBMYJRH-ZFWWWQNUSA-N 1 3 278.465 3.543 20 0 CHADHO CC[N@H+]1CCC[C@H]1CN[C@@H](C)c1ccc(SC)cc1 ZINC000019960915 1120553970 /nfs/dbraw/zinc/55/39/70/1120553970.db2.gz UEIBCRSWBMYJRH-ZFWWWQNUSA-N 1 3 278.465 3.543 20 0 CHADHO Cc1cc([C@@H](C)[NH2+]CCCN2CCCCC2)c(C)s1 ZINC000019996640 1120559791 /nfs/dbraw/zinc/55/97/91/1120559791.db2.gz MQSJYUVCJSPAGG-CQSZACIVSA-N 1 3 280.481 3.892 20 0 CHADHO C[C@@H]1C[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)CCS1 ZINC000922836464 1120607624 /nfs/dbraw/zinc/60/76/24/1120607624.db2.gz CIXCVFQDAGWFRZ-GDBMZVCRSA-N 1 3 296.524 3.657 20 0 CHADHO CC(C)c1ccc([C@@H](C)N2CC[C@]3(CC[NH2+]C3)C2)cc1 ZINC000257709777 1120742642 /nfs/dbraw/zinc/74/26/42/1120742642.db2.gz NMFDGRWHHCXPOB-QAPCUYQASA-N 1 3 272.436 3.556 20 0 CHADHO CC(C)C[C@H](N[C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(F)cc1 ZINC000652154379 1120792392 /nfs/dbraw/zinc/79/23/92/1120792392.db2.gz DDHAOJHSKNJQGL-JLSDUUJJSA-N 1 3 292.442 3.985 20 0 CHADHO CC(C)C[C@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(F)cc1 ZINC000652154379 1120792395 /nfs/dbraw/zinc/79/23/95/1120792395.db2.gz DDHAOJHSKNJQGL-JLSDUUJJSA-N 1 3 292.442 3.985 20 0 CHADHO Cc1ccccc1C1(NC2CC[NH+](C(C)C)CC2)CCC1 ZINC000652218222 1120800864 /nfs/dbraw/zinc/80/08/64/1120800864.db2.gz BWYPJEGJBGPZDZ-UHFFFAOYSA-N 1 3 286.463 3.837 20 0 CHADHO Cc1cc(NCC[NH+]2CCC(C)CC2)c2ccccc2n1 ZINC000040444344 1120834852 /nfs/dbraw/zinc/83/48/52/1120834852.db2.gz SYDOATLQEAHMPO-UHFFFAOYSA-N 1 3 283.419 3.687 20 0 CHADHO COc1ccc2cc([C@H](C)NCCC(C)(C)[NH3+])ccc2c1 ZINC000925741443 1120857955 /nfs/dbraw/zinc/85/79/55/1120857955.db2.gz RBVIFRXVWQQYRE-ZDUSSCGKSA-N 1 3 286.419 3.626 20 0 CHADHO Cc1ccc([C@H](C)NCc2cccc3c2CC[NH2+]C3)cc1F ZINC000662280839 1120917197 /nfs/dbraw/zinc/91/71/97/1120917197.db2.gz GGZGSYQMUUNIRJ-AWEZNQCLSA-N 1 3 298.405 3.631 20 0 CHADHO c1ccc(C2CC([NH2+]C[C@@H]3CCCN(CC4CC4)C3)C2)cc1 ZINC000663467430 1120981814 /nfs/dbraw/zinc/98/18/14/1120981814.db2.gz FUWLDHHEVFPXNN-KKXNLOMOSA-N 1 3 298.474 3.644 20 0 CHADHO CC[C@@H](NC[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccccc1 ZINC000663470182 1120984451 /nfs/dbraw/zinc/98/44/51/1120984451.db2.gz SSKHBUYHOKMJMM-PKOBYXMFSA-N 1 3 286.463 3.849 20 0 CHADHO CC[C@@H](NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1 ZINC000663470182 1120984454 /nfs/dbraw/zinc/98/44/54/1120984454.db2.gz SSKHBUYHOKMJMM-PKOBYXMFSA-N 1 3 286.463 3.849 20 0 CHADHO C[C@H](Cc1coc2ccccc12)[NH2+][C@@H]1CCNC2(CCC2)C1 ZINC000643548127 1121012142 /nfs/dbraw/zinc/01/21/42/1121012142.db2.gz MVDOYRHRNPNIOH-GDBMZVCRSA-N 1 3 298.430 3.628 20 0 CHADHO C[C@H](Cc1coc2ccccc12)N[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643548127 1121012146 /nfs/dbraw/zinc/01/21/46/1121012146.db2.gz MVDOYRHRNPNIOH-GDBMZVCRSA-N 1 3 298.430 3.628 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N1CCC[C@H]1c1nccs1 ZINC001167836459 1121038172 /nfs/dbraw/zinc/03/81/72/1121038172.db2.gz DTEDEJYDGJMQRG-GJZGRUSLSA-N 1 3 295.496 3.791 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](CC2CCC2)c2ccccc2)C1 ZINC000344035135 1121062124 /nfs/dbraw/zinc/06/21/24/1121062124.db2.gz PYQHZNZKUQRKSI-HKUYNNGSSA-N 1 3 286.463 3.849 20 0 CHADHO Cc1cc(C)c(CN(C)[C@@H]2CC[N@H+](C)[C@H](C)C2)cc1C ZINC000093643620 1128966730 /nfs/dbraw/zinc/96/67/30/1128966730.db2.gz NKUYYGHEQJMJIO-SJLPKXTDSA-N 1 3 274.452 3.526 20 0 CHADHO Cc1cc(C)c(CN(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1C ZINC000093643620 1128966733 /nfs/dbraw/zinc/96/67/33/1128966733.db2.gz NKUYYGHEQJMJIO-SJLPKXTDSA-N 1 3 274.452 3.526 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCCCC1)c1cc2ccccc2o1 ZINC000021801766 1121215618 /nfs/dbraw/zinc/21/56/18/1121215618.db2.gz AIDLDLWUXAKQOU-OAHLLOKOSA-N 1 3 286.419 3.959 20 0 CHADHO CC[C@@H](N)C[NH2+][C@H](C)c1ccc(OCc2ccccc2)cc1 ZINC000231439092 1121238271 /nfs/dbraw/zinc/23/82/71/1121238271.db2.gz PXFIUZYKQAQFJV-CRAIPNDOSA-N 1 3 298.430 3.654 20 0 CHADHO CN(C)C1(C)CC[NH+](C[C@H]2CCCCC2(C)C)CC1 ZINC001175398177 1121292403 /nfs/dbraw/zinc/29/24/03/1121292403.db2.gz ARBNDPQLIPMSCN-OAHLLOKOSA-N 1 3 266.473 3.619 20 0 CHADHO C[NH+](C)CCOc1ccc(Nc2ccnc(C3CC3)c2)cc1 ZINC001176229658 1121581961 /nfs/dbraw/zinc/58/19/61/1121581961.db2.gz MWWXBMAZVTWBNN-UHFFFAOYSA-N 1 3 297.402 3.643 20 0 CHADHO Cc1cccc(CNCCCC[NH+]2CCC(C)CC2)c1F ZINC001177293909 1121721194 /nfs/dbraw/zinc/72/11/94/1121721194.db2.gz BAYNDAAKMSSTMV-UHFFFAOYSA-N 1 3 292.442 3.736 20 0 CHADHO C(C1CCCCC1)N1CCC([NH2+]C2CCSCC2)CC1 ZINC001177581569 1121739902 /nfs/dbraw/zinc/73/99/02/1121739902.db2.gz MRASUNSMUQVOIV-UHFFFAOYSA-N 1 3 296.524 3.516 20 0 CHADHO Cc1ccccc1[C@H](N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)C(C)C ZINC000166584549 1121748384 /nfs/dbraw/zinc/74/83/84/1121748384.db2.gz UBCVYNHCWBTWGB-ZHALLVOQSA-N 1 3 286.463 3.909 20 0 CHADHO Cc1ccccc1[C@H](N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)C(C)C ZINC000166584549 1121748389 /nfs/dbraw/zinc/74/83/89/1121748389.db2.gz UBCVYNHCWBTWGB-ZHALLVOQSA-N 1 3 286.463 3.909 20 0 CHADHO CC[C@H](c1ccccc1)N1C[C@@H](c2ccccc2)[C@H]([NH3+])C1 ZINC000261886440 1129008369 /nfs/dbraw/zinc/00/83/69/1129008369.db2.gz ZCQKKPXKQGUOBG-IPMKNSEASA-N 1 3 280.415 3.564 20 0 CHADHO CC(C)(CCN1CCCC[C@](F)(C[NH3+])C1)c1ccccc1 ZINC001206337295 1121801931 /nfs/dbraw/zinc/80/19/31/1121801931.db2.gz SDMBVWSYYRELND-SFHVURJKSA-N 1 3 292.442 3.507 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@@H]1CC[C@H](c2ccccc2)C1 ZINC000436283365 1121835688 /nfs/dbraw/zinc/83/56/88/1121835688.db2.gz UUHBLQLMKRDMPY-ZWKOTPCHSA-N 1 3 274.452 3.643 20 0 CHADHO C[C@H](CC[NH2+]C1CCC2(CCCCC2)CC1)N(C)C ZINC001179266519 1121866826 /nfs/dbraw/zinc/86/68/26/1121866826.db2.gz PCIOMEBKVUYTNS-OAHLLOKOSA-N 1 3 266.473 3.809 20 0 CHADHO Cc1cc(C)c(/C=C/CN[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@@H]23)c(C)c1 ZINC001179817260 1121912300 /nfs/dbraw/zinc/91/23/00/1121912300.db2.gz PHTVTKIWLOQGPE-DUFRMZEJSA-N 1 3 298.474 3.555 20 0 CHADHO Cc1cc(C)c(/C=C/CN[C@@H]2CC[C@@H]3C[N@H+](C)C[C@@H]23)c(C)c1 ZINC001179817260 1121912306 /nfs/dbraw/zinc/91/23/06/1121912306.db2.gz PHTVTKIWLOQGPE-DUFRMZEJSA-N 1 3 298.474 3.555 20 0 CHADHO CCCCN1CCC([NH2+]C/C(C)=C\c2ccccc2)CC1 ZINC000501378863 1121974244 /nfs/dbraw/zinc/97/42/44/1121974244.db2.gz TWNAKZPVXAHVIR-ICFOKQHNSA-N 1 3 286.463 3.944 20 0 CHADHO CCN(CC[C@H]1CCC[NH2+]C1)Cc1ccccc1Cl ZINC000420302917 1121997328 /nfs/dbraw/zinc/99/73/28/1121997328.db2.gz JZSHSGQAWKUYPG-CQSZACIVSA-N 1 3 280.843 3.552 20 0 CHADHO NCCC[N@H+](CCCCC(F)(F)F)CC1CCCC1 ZINC000420313422 1121999390 /nfs/dbraw/zinc/99/93/90/1121999390.db2.gz JUPAMVGSZHWLSB-UHFFFAOYSA-N 1 3 280.378 3.560 20 0 CHADHO NCCC[N@@H+](CCCCC(F)(F)F)CC1CCCC1 ZINC000420313422 1121999397 /nfs/dbraw/zinc/99/93/97/1121999397.db2.gz JUPAMVGSZHWLSB-UHFFFAOYSA-N 1 3 280.378 3.560 20 0 CHADHO CCCc1ccc([C@H](NC[C@H]2CC[NH2+]C2)C(C)C)cc1 ZINC000420376577 1122004976 /nfs/dbraw/zinc/00/49/76/1122004976.db2.gz QUJUBBUEFBZLIC-FUHWJXTLSA-N 1 3 274.452 3.535 20 0 CHADHO C[C@]12C[C@H]1CCC[C@@H]2[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000502241508 1122062349 /nfs/dbraw/zinc/06/23/49/1122062349.db2.gz MFRNUKKTIPVFGN-MNEFBYGVSA-N 1 3 290.495 3.952 20 0 CHADHO C[C@H](CN(C)C)[C@H]1CCCC[N@@H+]1Cc1cc2ccccc2[nH]1 ZINC001183065552 1122205006 /nfs/dbraw/zinc/20/50/06/1122205006.db2.gz LXRYGCQTCXCVQC-DNVCBOLYSA-N 1 3 299.462 3.720 20 0 CHADHO C[C@H](CN(C)C)[C@H]1CCCC[N@H+]1Cc1cc2ccccc2[nH]1 ZINC001183065552 1122205011 /nfs/dbraw/zinc/20/50/11/1122205011.db2.gz LXRYGCQTCXCVQC-DNVCBOLYSA-N 1 3 299.462 3.720 20 0 CHADHO CC[C@@H](CN1CCC(CC)([NH+](C)C)CC1)c1ccccc1 ZINC001183196724 1122210060 /nfs/dbraw/zinc/21/00/60/1122210060.db2.gz HOOMNDWOHOHZAC-KRWDZBQOSA-N 1 3 288.479 3.986 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CC[C@@H](C)[C@H](CN)C1 ZINC001205295748 1122273194 /nfs/dbraw/zinc/27/31/94/1122273194.db2.gz BOAJNTJZHARPFS-OSNZYPHYSA-N 1 3 266.473 3.820 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CC[C@@H](C)[C@H](CN)C1 ZINC001205295748 1122273197 /nfs/dbraw/zinc/27/31/97/1122273197.db2.gz BOAJNTJZHARPFS-OSNZYPHYSA-N 1 3 266.473 3.820 20 0 CHADHO CCN(CC)CC[C@@H](C)[NH2+][C@H](C)Cc1cccc(C)c1 ZINC001184418878 1122275721 /nfs/dbraw/zinc/27/57/21/1122275721.db2.gz SXOWRGYYRWCWAB-IAGOWNOFSA-N 1 3 276.468 3.636 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+]C1CC(c2ccccc2C)C1 ZINC001184418957 1122276460 /nfs/dbraw/zinc/27/64/60/1122276460.db2.gz WMTCRPQKBANUHA-AOCRQIFASA-N 1 3 288.479 3.951 20 0 CHADHO CC[C@H]([NH2+]CC[C@H]1CCCCN1C)c1ccccc1OC ZINC000775077163 1122418169 /nfs/dbraw/zinc/41/81/69/1122418169.db2.gz KIRIHQRCAJANIJ-WBVHZDCISA-N 1 3 290.451 3.610 20 0 CHADHO CCN(Cc1cc(C)nc2ccccc12)[C@@H]1CCC[NH2+]CC1 ZINC000435611908 1122478498 /nfs/dbraw/zinc/47/84/98/1122478498.db2.gz DAYMPSZUIPWMIA-QGZVFWFLSA-N 1 3 297.446 3.507 20 0 CHADHO CCCC[NH2+][C@H](C)c1ccc(OC)c(CN(CC)CC)c1 ZINC000775366638 1122529116 /nfs/dbraw/zinc/52/91/16/1122529116.db2.gz ZGOPPTWTTFGUGQ-OAHLLOKOSA-N 1 3 292.467 3.988 20 0 CHADHO CC[C@H](C)[C@H](C)[N@@H+]1CCC[C@@H](CN2CCC(C)CC2)C1 ZINC001190652314 1122550607 /nfs/dbraw/zinc/55/06/07/1122550607.db2.gz ZOHACQNJSADUPV-BZSNNMDCSA-N 1 3 280.500 3.865 20 0 CHADHO CC[C@H](C)[C@H](C)[N@H+]1CCC[C@@H](CN2CCC(C)CC2)C1 ZINC001190652314 1122550611 /nfs/dbraw/zinc/55/06/11/1122550611.db2.gz ZOHACQNJSADUPV-BZSNNMDCSA-N 1 3 280.500 3.865 20 0 CHADHO Cc1oc2ccccc2c1[C@@H](C)NC[C@H]1CCC[N@H+](C)C1 ZINC000925009408 1122563352 /nfs/dbraw/zinc/56/33/52/1122563352.db2.gz HGOJCAPVDYQGDY-UKRRQHHQSA-N 1 3 286.419 3.734 20 0 CHADHO Cc1oc2ccccc2c1[C@@H](C)NC[C@H]1CCC[N@@H+](C)C1 ZINC000925009408 1122563354 /nfs/dbraw/zinc/56/33/54/1122563354.db2.gz HGOJCAPVDYQGDY-UKRRQHHQSA-N 1 3 286.419 3.734 20 0 CHADHO CC[C@H](C[NH2+]C[C@H]1CCN(C(C)C)C1)c1ccccc1 ZINC000516099460 1122567825 /nfs/dbraw/zinc/56/78/25/1122567825.db2.gz BHIPUAVXBWXVPA-IAGOWNOFSA-N 1 3 274.452 3.500 20 0 CHADHO C[C@@H](C[N@@H+]1CC[C@@H](CN2CCCCC2)C1)CC(C)(C)C ZINC001191070332 1122568606 /nfs/dbraw/zinc/56/86/06/1122568606.db2.gz KNKPQHFHGSOPHW-SJORKVTESA-N 1 3 280.500 3.867 20 0 CHADHO C[C@@H](C[N@H+]1CC[C@@H](CN2CCCCC2)C1)CC(C)(C)C ZINC001191070332 1122568608 /nfs/dbraw/zinc/56/86/08/1122568608.db2.gz KNKPQHFHGSOPHW-SJORKVTESA-N 1 3 280.500 3.867 20 0 CHADHO CC(C)=CCCN1CCC[C@@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC001191048444 1122571330 /nfs/dbraw/zinc/57/13/30/1122571330.db2.gz OBCIDHVQFFGDGK-ZWKOTPCHSA-N 1 3 278.484 3.929 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]C2CCN([C@@H]3CCC[C@H](C)C3)CC2)C1 ZINC000437052931 1122605347 /nfs/dbraw/zinc/60/53/47/1122605347.db2.gz XOVWBXXTRPZMHB-CIRFHOKZSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@@H]1CCC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C1 ZINC001167962031 1122632823 /nfs/dbraw/zinc/63/28/23/1122632823.db2.gz SNWVWBVTEMCMAT-HHAVVXDTSA-N 1 3 276.468 3.560 20 0 CHADHO C[C@H](C[NH2+][C@H](c1ccccc1)C1CCCC1)CN(C)C ZINC000425932358 1122663730 /nfs/dbraw/zinc/66/37/30/1122663730.db2.gz PVMUJPBXFBGCEG-CRAIPNDOSA-N 1 3 274.452 3.705 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1)CN(C)C ZINC000425947213 1122675978 /nfs/dbraw/zinc/67/59/78/1122675978.db2.gz RQTWKKWQFBPTSW-MNOVXSKESA-N 1 3 289.250 3.842 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H](C)c2cc3ccccc3[nH]2)C1 ZINC000775626779 1122829895 /nfs/dbraw/zinc/82/98/95/1122829895.db2.gz JNDOUINVPDDDOB-JKSUJKDBSA-N 1 3 299.462 3.939 20 0 CHADHO C[C@H]1CCC[C@H](C)[NH+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167981677 1122896609 /nfs/dbraw/zinc/89/66/09/1122896609.db2.gz DXAWVZRGGNWNKI-KSTANIPCSA-N 1 3 276.468 3.655 20 0 CHADHO CC1CCN(CC[C@H]2CCC[N@@H+]2[C@H]2C=CCCC2)CC1 ZINC001196936131 1122940555 /nfs/dbraw/zinc/94/05/55/1122940555.db2.gz PYTIUGZNYKESQD-ZWKOTPCHSA-N 1 3 276.468 3.682 20 0 CHADHO CC1CCN(CC[C@H]2CCC[N@H+]2[C@H]2C=CCCC2)CC1 ZINC001196936131 1122940558 /nfs/dbraw/zinc/94/05/58/1122940558.db2.gz PYTIUGZNYKESQD-ZWKOTPCHSA-N 1 3 276.468 3.682 20 0 CHADHO CC1CC[NH+](CC[C@H]2CCCN2[C@H]2C=CCCC2)CC1 ZINC001196936131 1122940563 /nfs/dbraw/zinc/94/05/63/1122940563.db2.gz PYTIUGZNYKESQD-ZWKOTPCHSA-N 1 3 276.468 3.682 20 0 CHADHO CCC[C@H](C)CCCN1CCN(c2cc[nH+]cc2)C[C@H]1C ZINC001197931066 1122973798 /nfs/dbraw/zinc/97/37/98/1122973798.db2.gz UXFZCQTVRBSLEJ-DLBZAZTESA-N 1 3 289.467 3.809 20 0 CHADHO CCC[C@H](C)CCC[N@@H+]1CCN(c2ccncc2)C[C@H]1C ZINC001197931066 1122973799 /nfs/dbraw/zinc/97/37/99/1122973799.db2.gz UXFZCQTVRBSLEJ-DLBZAZTESA-N 1 3 289.467 3.809 20 0 CHADHO CCC[C@H](C)CCC[N@H+]1CCN(c2ccncc2)C[C@H]1C ZINC001197931066 1122973801 /nfs/dbraw/zinc/97/38/01/1122973801.db2.gz UXFZCQTVRBSLEJ-DLBZAZTESA-N 1 3 289.467 3.809 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)N1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000647970010 1123057402 /nfs/dbraw/zinc/05/74/02/1123057402.db2.gz RHIXHSKSKOHNSW-CJNGLKHVSA-N 1 3 292.854 3.723 20 0 CHADHO Cc1cc(C)cc(C[N@@H+](C)CC[C@H]2CCCCN2C)c1 ZINC000441371938 1123082515 /nfs/dbraw/zinc/08/25/15/1123082515.db2.gz NSBNTAFDDBINMT-GOSISDBHSA-N 1 3 274.452 3.610 20 0 CHADHO Cc1cc(C)cc(C[N@H+](C)CC[C@H]2CCCCN2C)c1 ZINC000441371938 1123082519 /nfs/dbraw/zinc/08/25/19/1123082519.db2.gz NSBNTAFDDBINMT-GOSISDBHSA-N 1 3 274.452 3.610 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@@H+]1C[C@@H]1CC=CCC1 ZINC001201423674 1123098437 /nfs/dbraw/zinc/09/84/37/1123098437.db2.gz RKHFGWQSRIHNPJ-FGTMMUONSA-N 1 3 276.468 3.682 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@H+]1C[C@@H]1CC=CCC1 ZINC001201423674 1123098441 /nfs/dbraw/zinc/09/84/41/1123098441.db2.gz RKHFGWQSRIHNPJ-FGTMMUONSA-N 1 3 276.468 3.682 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1C[C@@H]1CC=CCC1 ZINC001201423746 1123098890 /nfs/dbraw/zinc/09/88/90/1123098890.db2.gz RKHFGWQSRIHNPJ-SQNIBIBYSA-N 1 3 276.468 3.682 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@H+]1C[C@@H]1CC=CCC1 ZINC001201423746 1123098895 /nfs/dbraw/zinc/09/88/95/1123098895.db2.gz RKHFGWQSRIHNPJ-SQNIBIBYSA-N 1 3 276.468 3.682 20 0 CHADHO CC1(C)CC[NH+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001167995394 1123105355 /nfs/dbraw/zinc/10/53/55/1123105355.db2.gz DIVLIQMOWMRISJ-SJPCQFCGSA-N 1 3 276.468 3.514 20 0 CHADHO C[C@H](CC[NH2+][C@H]1CC[C@@H](C)[C@@H](C)C1)N1CCCCC1 ZINC001201954001 1123162255 /nfs/dbraw/zinc/16/22/55/1123162255.db2.gz CTLCLIPLHKTQJU-TWMKSMIVSA-N 1 3 266.473 3.665 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@@H+]1CCC(C)(C)C ZINC001202096768 1123175604 /nfs/dbraw/zinc/17/56/04/1123175604.db2.gz ROSXROUIPYGBEB-JKSUJKDBSA-N 1 3 266.473 3.761 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@H+]1CCC(C)(C)C ZINC001202096768 1123175607 /nfs/dbraw/zinc/17/56/07/1123175607.db2.gz ROSXROUIPYGBEB-JKSUJKDBSA-N 1 3 266.473 3.761 20 0 CHADHO CC(C)C1CCC([NH2+]CC(C)(C)CN2CCCC2)CC1 ZINC001202233251 1123191552 /nfs/dbraw/zinc/19/15/52/1123191552.db2.gz KOVLWUKVFSSSPI-UHFFFAOYSA-N 1 3 280.500 3.913 20 0 CHADHO Cc1ccc(CCN[C@@H]2C[C@H]([NH3+])c3ccccc32)cc1C ZINC000665245284 1123252215 /nfs/dbraw/zinc/25/22/15/1123252215.db2.gz DJZLGFCVOVPHDN-RBUKOAKNSA-N 1 3 280.415 3.580 20 0 CHADHO NC1(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)CCCC1 ZINC000665247654 1123256230 /nfs/dbraw/zinc/25/62/30/1123256230.db2.gz HEMRTCGRIIPLFA-OAHLLOKOSA-N 1 3 278.827 3.652 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]CC2CCC(C)(C)CC2)C1 ZINC000311570773 1129110313 /nfs/dbraw/zinc/11/03/13/1129110313.db2.gz MJYAMUQSLJSADO-MRXNPFEDSA-N 1 3 266.473 3.523 20 0 CHADHO [NH3+][C@@H]1C[C@H](N[C@@H]2CC[C@@H]2c2ccccc2)c2ccccc21 ZINC000665274152 1123302929 /nfs/dbraw/zinc/30/29/29/1123302929.db2.gz KZJGZEJSXOKWHM-AXUOBQJMSA-N 1 3 278.399 3.667 20 0 CHADHO CCC[C@H](NCC[C@@H]([NH3+])C(C)C)c1ccsc1 ZINC000665281495 1123313729 /nfs/dbraw/zinc/31/37/29/1123313729.db2.gz FERCWUOTMQETBH-KGLIPLIRSA-N 1 3 254.443 3.552 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@@H](C)C1CCCCC1 ZINC000665284048 1123315965 /nfs/dbraw/zinc/31/59/65/1123315965.db2.gz ZMNBZCMGQYYFSN-KGLIPLIRSA-N 1 3 289.467 3.716 20 0 CHADHO C[C@H](CC[NH2+][C@@H]1CCC12CCCC2)N1CCCCC1 ZINC000474046015 1123400171 /nfs/dbraw/zinc/40/01/71/1123400171.db2.gz RMIJSDTXJYZDSD-HZPDHXFCSA-N 1 3 264.457 3.563 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)C1CCC(F)(F)CC1 ZINC000474059247 1123406679 /nfs/dbraw/zinc/40/66/79/1123406679.db2.gz NYKUSFRUWIUPKP-AEGPPILISA-N 1 3 288.426 3.663 20 0 CHADHO CCC1([NH+]2CCC2)CCN(C[C@@H]2C[C@@H]2c2ccccc2)CC1 ZINC000895827022 1123516760 /nfs/dbraw/zinc/51/67/60/1123516760.db2.gz BBLXCLMBQQPAAD-RBUKOAKNSA-N 1 3 298.474 3.740 20 0 CHADHO CCC1(N2CCC2)CC[NH+](C[C@@H]2C[C@@H]2c2ccccc2)CC1 ZINC000895827022 1123516763 /nfs/dbraw/zinc/51/67/63/1123516763.db2.gz BBLXCLMBQQPAAD-RBUKOAKNSA-N 1 3 298.474 3.740 20 0 CHADHO CCCC[C@@H](CC)C[N@@H+]1CCC[C@@H](N(C)C)CC1 ZINC000429524784 1123537789 /nfs/dbraw/zinc/53/77/89/1123537789.db2.gz AYNAHWMKXDBQGS-HZPDHXFCSA-N 1 3 254.462 3.619 20 0 CHADHO CCCC[C@@H](CC)C[N@H+]1CCC[C@@H](N(C)C)CC1 ZINC000429524784 1123537792 /nfs/dbraw/zinc/53/77/92/1123537792.db2.gz AYNAHWMKXDBQGS-HZPDHXFCSA-N 1 3 254.462 3.619 20 0 CHADHO CC(C)[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCCN(C(C)C)C2)C1 ZINC000474710300 1123575820 /nfs/dbraw/zinc/57/58/20/1123575820.db2.gz IVPZWGCTLWWHRW-KZNAEPCWSA-N 1 3 280.500 3.911 20 0 CHADHO Cc1cccc([C@H](C)N2CCC[C@@H]([C@H]3CCC[NH2+]3)C2)c1 ZINC000389354868 1123639611 /nfs/dbraw/zinc/63/96/11/1123639611.db2.gz TZYRBSXRNQDPBR-CGTJXYLNSA-N 1 3 272.436 3.520 20 0 CHADHO CC(C)[C@H]([NH3+])CCN(C)Cc1cccc(-c2cccnc2)c1 ZINC000346692907 1123706642 /nfs/dbraw/zinc/70/66/42/1123706642.db2.gz JRRQVRLEUOPGQQ-LJQANCHMSA-N 1 3 297.446 3.554 20 0 CHADHO CC[C@H](NC[C@H]1CCC[N@H+](C)C1)c1ccc(Cl)s1 ZINC000158244196 1129142063 /nfs/dbraw/zinc/14/20/63/1129142063.db2.gz MVMOLLFHIYSQQX-NEPJUHHUSA-N 1 3 286.872 3.784 20 0 CHADHO CC[C@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccc(Cl)s1 ZINC000158244196 1129142064 /nfs/dbraw/zinc/14/20/64/1129142064.db2.gz MVMOLLFHIYSQQX-NEPJUHHUSA-N 1 3 286.872 3.784 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)CC(C)(C)c2ccccc2)C1 ZINC000037644505 1129154819 /nfs/dbraw/zinc/15/48/19/1129154819.db2.gz YYVXTJHGSQVJDT-DLBZAZTESA-N 1 3 288.479 3.674 20 0 CHADHO CC(C)[NH+]1CCC(CCNCc2ccc(Cl)o2)CC1 ZINC000865715059 1124007950 /nfs/dbraw/zinc/00/79/50/1124007950.db2.gz IFHYUJFDQFVNRG-UHFFFAOYSA-N 1 3 284.831 3.533 20 0 CHADHO C[C@H]1CC[C@@H](C[NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000475567565 1124014403 /nfs/dbraw/zinc/01/44/03/1124014403.db2.gz CZXPNOHPHAWIND-JKSUJKDBSA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)[NH+](CCCN[C@H](C)CCc1cccnc1)C(C)C ZINC000866276630 1124046740 /nfs/dbraw/zinc/04/67/40/1124046740.db2.gz BQMRSXDQUSJTNB-QGZVFWFLSA-N 1 3 291.483 3.501 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)CCc2ccc(Cl)cc2)C[C@H]1C ZINC000445209749 1124076315 /nfs/dbraw/zinc/07/63/15/1124076315.db2.gz HADYZFVIYSCSPC-RHSMWYFYSA-N 1 3 294.870 3.687 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)CCc2ccc(Cl)cc2)C[C@H]1C ZINC000445209749 1124076319 /nfs/dbraw/zinc/07/63/19/1124076319.db2.gz HADYZFVIYSCSPC-RHSMWYFYSA-N 1 3 294.870 3.687 20 0 CHADHO Cc1cc([C@@H](C)NCc2cccc3c2CC[NH2+]C3)cs1 ZINC000635009662 1129170047 /nfs/dbraw/zinc/17/00/47/1129170047.db2.gz JXZBWPMTUWEMDY-CYBMUJFWSA-N 1 3 286.444 3.553 20 0 CHADHO c1cc2c(cccc2CN[C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)[nH]1 ZINC000635011985 1129170432 /nfs/dbraw/zinc/17/04/32/1129170432.db2.gz IOXCMPBXMKVRIN-BHIYHBOVSA-N 1 3 297.446 3.568 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]C[C@H](C)c2ccc(F)cc2)C1 ZINC000526118970 1124511446 /nfs/dbraw/zinc/51/14/46/1124511446.db2.gz BYFRQMNAFSGTPR-HOTGVXAUSA-N 1 3 292.442 3.639 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC000526988884 1124537881 /nfs/dbraw/zinc/53/78/81/1124537881.db2.gz QRDMDAYBGLDZHB-HUUCEWRRSA-N 1 3 282.378 3.587 20 0 CHADHO CCCCN1CCC([NH2+]Cc2cccc3ccoc32)CC1 ZINC000449102368 1124647753 /nfs/dbraw/zinc/64/77/53/1124647753.db2.gz YMRLOPSDQUAEKP-UHFFFAOYSA-N 1 3 286.419 3.787 20 0 CHADHO C[C@@H]([NH2+]CC1CC(C)(C)C1)[C@@H]1CCCN(C2CCC2)C1 ZINC000528439829 1124666886 /nfs/dbraw/zinc/66/68/86/1124666886.db2.gz IWYCXAUMWLMRHY-GDBMZVCRSA-N 1 3 278.484 3.665 20 0 CHADHO CCc1ccc2nccc(N3CC[C@H](C[N@@H+](C)CC)C3)c2c1 ZINC000450359733 1124999373 /nfs/dbraw/zinc/99/93/73/1124999373.db2.gz IBHKQIAPQTWHNQ-MRXNPFEDSA-N 1 3 297.446 3.575 20 0 CHADHO CCc1ccc2nccc(N3CC[C@H](C[N@H+](C)CC)C3)c2c1 ZINC000450359733 1124999378 /nfs/dbraw/zinc/99/93/78/1124999378.db2.gz IBHKQIAPQTWHNQ-MRXNPFEDSA-N 1 3 297.446 3.575 20 0 CHADHO CSC(C)(C)CC[NH2+]C1CCN(C2CCCC2)CC1 ZINC000877084188 1125008969 /nfs/dbraw/zinc/00/89/69/1125008969.db2.gz QBDQCJPFRIHJPX-UHFFFAOYSA-N 1 3 284.513 3.515 20 0 CHADHO CC[C@@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cc(C)ccc1C ZINC000530223079 1125132913 /nfs/dbraw/zinc/13/29/13/1125132913.db2.gz MLMGROKLQCDGHY-IXEWLPCDSA-N 1 3 272.436 3.627 20 0 CHADHO CC1([NH+]2CCC2)CCN([C@@H]2CCCc3ccccc32)CC1 ZINC000880472826 1125276972 /nfs/dbraw/zinc/27/69/72/1125276972.db2.gz DVTGYLKPGXMAAM-GOSISDBHSA-N 1 3 284.447 3.624 20 0 CHADHO C[C@@H](c1cccc(Cl)c1)N(C)C[C@@H]1CCC[N@H+](C)C1 ZINC000152364364 1125306279 /nfs/dbraw/zinc/30/62/79/1125306279.db2.gz YWIWBGHRGGAXPR-UONOGXRCSA-N 1 3 280.843 3.675 20 0 CHADHO C[C@@H](c1cccc(Cl)c1)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000152364364 1125306281 /nfs/dbraw/zinc/30/62/81/1125306281.db2.gz YWIWBGHRGGAXPR-UONOGXRCSA-N 1 3 280.843 3.675 20 0 CHADHO CC1CCC([NH+]2C(C)(C)CC(N)CC2(C)C)CC1 ZINC001168200536 1125391931 /nfs/dbraw/zinc/39/19/31/1125391931.db2.gz JBNQVKUWJAJQMB-UHFFFAOYSA-N 1 3 252.446 3.545 20 0 CHADHO CC[C@H]([NH2+]C1CCN(C2CCCC2)CC1)c1ccncc1 ZINC000163783978 1129204132 /nfs/dbraw/zinc/20/41/32/1129204132.db2.gz DMBKQDWTYKWLFQ-SFHVURJKSA-N 1 3 287.451 3.529 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](NCc2cc(-c3ccccc3)cs2)C1 ZINC000414933430 1129206249 /nfs/dbraw/zinc/20/62/49/1129206249.db2.gz WWNRUBAJVLJXEM-HZPDHXFCSA-N 1 3 286.444 3.775 20 0 CHADHO CC[C@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc(C)c1 ZINC000295845824 1129219948 /nfs/dbraw/zinc/21/99/48/1129219948.db2.gz ATPOCOQFUXODEK-FBVQUNGASA-N 1 3 272.436 3.661 20 0 CHADHO CC[C@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(C)c1 ZINC000295845824 1129219951 /nfs/dbraw/zinc/21/99/51/1129219951.db2.gz ATPOCOQFUXODEK-FBVQUNGASA-N 1 3 272.436 3.661 20 0 CHADHO CCC[NH+]1CCC(N(C)Cc2cccc3ncccc23)CC1 ZINC000637955168 1129238313 /nfs/dbraw/zinc/23/83/13/1129238313.db2.gz DNAJIHKIVHSOMR-UHFFFAOYSA-N 1 3 297.446 3.541 20 0 CHADHO CCCC[C@H]1C[C@@H]([NH2+]C2CCC(CC)CC2)CCN1 ZINC001246169236 1131371408 /nfs/dbraw/zinc/37/14/08/1131371408.db2.gz BTJYNGUIOYQLFC-GQGLESIBSA-N 1 3 266.473 3.856 20 0 CHADHO CC[C@H]([NH2+][C@@H](C)c1ccc(CN)nc1C)C1CCCCC1 ZINC000643462356 1129442448 /nfs/dbraw/zinc/44/24/48/1129442448.db2.gz FBELGJNWJQDOSE-KSSFIOAISA-N 1 3 289.467 3.858 20 0 CHADHO [NH3+]CCC[C@H](N[C@@H]1CCCc2cccnc21)c1ccccc1 ZINC000643543724 1129445416 /nfs/dbraw/zinc/44/54/16/1129445416.db2.gz YEVUBDAZXVNYKP-ZWKOTPCHSA-N 1 3 295.430 3.529 20 0 CHADHO CC1(C)CC[C@H]([NH+]2C(C)(C)CC(N)CC2(C)C)C1 ZINC001258595443 1129451140 /nfs/dbraw/zinc/45/11/40/1129451140.db2.gz WGBRBJKGNUWTPR-ZDUSSCGKSA-N 1 3 252.446 3.545 20 0 CHADHO Clc1cscc1CNCCCCC[NH+]1CCCC1 ZINC000645198561 1129492029 /nfs/dbraw/zinc/49/20/29/1129492029.db2.gz VMHHKLWEBXWNAN-UHFFFAOYSA-N 1 3 286.872 3.757 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CN(C)C[C@H]2c2ccccc2)o1 ZINC000647344371 1129571575 /nfs/dbraw/zinc/57/15/75/1129571575.db2.gz PFDRLWMLYWVWCZ-NXHRZFHOSA-N 1 3 298.430 3.584 20 0 CHADHO CC[C@@H]1C[N@@H+]([C@@H]2CC[C@](C)(c3ccccc3)C2)CC[C@@H]1N ZINC000647497298 1129579156 /nfs/dbraw/zinc/57/91/56/1129579156.db2.gz BXVRCVRNGWELTL-YSHGAJCASA-N 1 3 286.463 3.556 20 0 CHADHO CC[C@@H]1C[N@H+]([C@@H]2CC[C@](C)(c3ccccc3)C2)CC[C@@H]1N ZINC000647497298 1129579158 /nfs/dbraw/zinc/57/91/58/1129579158.db2.gz BXVRCVRNGWELTL-YSHGAJCASA-N 1 3 286.463 3.556 20 0 CHADHO c1ccc2c(c1)cccc2C1CCN(C[C@H]2CC[NH2+]C2)CC1 ZINC000647882997 1129587387 /nfs/dbraw/zinc/58/73/87/1129587387.db2.gz YMPFWNQPKMYGBU-INIZCTEOSA-N 1 3 294.442 3.629 20 0 CHADHO CC(C)C[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC001169090657 1129700182 /nfs/dbraw/zinc/70/01/82/1129700182.db2.gz KEBYDGAQFKFIGX-AKHDSKFASA-N 1 3 286.463 3.989 20 0 CHADHO CC(C)C[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC001169090657 1129700185 /nfs/dbraw/zinc/70/01/85/1129700185.db2.gz KEBYDGAQFKFIGX-AKHDSKFASA-N 1 3 286.463 3.989 20 0 CHADHO Cc1ccc2c(c1)[C@H](N[C@H]1C[C@H]3CC[C@@H](C1)[N@H+]3C)CCC2 ZINC001169124369 1129701685 /nfs/dbraw/zinc/70/16/85/1129701685.db2.gz QNLAMVSBSRTBSE-SFNKJDCFSA-N 1 3 284.447 3.587 20 0 CHADHO Cc1ccc2c(c1)[C@H](N[C@H]1C[C@H]3CC[C@@H](C1)[N@@H+]3C)CCC2 ZINC001169124369 1129701687 /nfs/dbraw/zinc/70/16/87/1129701687.db2.gz QNLAMVSBSRTBSE-SFNKJDCFSA-N 1 3 284.447 3.587 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@H](NCc1cccc3sccc31)C2 ZINC001169107880 1129703559 /nfs/dbraw/zinc/70/35/59/1129703559.db2.gz MAIWEVDDOFJLMQ-QKDCVEJESA-N 1 3 286.444 3.616 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](NCc1cccc3sccc31)C2 ZINC001169107880 1129703561 /nfs/dbraw/zinc/70/35/61/1129703561.db2.gz MAIWEVDDOFJLMQ-QKDCVEJESA-N 1 3 286.444 3.616 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@H](N1CCC[C@@H]1c1cccc(F)c1)C2 ZINC001169142443 1129704487 /nfs/dbraw/zinc/70/44/87/1129704487.db2.gz USYUIFQTQFKZET-XMTFNYHQSA-N 1 3 288.410 3.588 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](N1CCC[C@@H]1c1cccc(F)c1)C2 ZINC001169142443 1129704490 /nfs/dbraw/zinc/70/44/90/1129704490.db2.gz USYUIFQTQFKZET-XMTFNYHQSA-N 1 3 288.410 3.588 20 0 CHADHO CC[NH+]1CCC(NC(C)(C)c2ccc(Cl)cc2)CC1 ZINC001169225345 1129710506 /nfs/dbraw/zinc/71/05/06/1129710506.db2.gz TWAMYIWNIFVFBL-UHFFFAOYSA-N 1 3 280.843 3.649 20 0 CHADHO CC[C@@H](NCc1ccccc1C[NH2+]C)c1ccc(F)cc1 ZINC000650758250 1129722140 /nfs/dbraw/zinc/72/21/40/1129722140.db2.gz LUHGVSVNQFWKSB-GOSISDBHSA-N 1 3 286.394 3.786 20 0 CHADHO CCc1cc(N2CCC[C@@H]([NH3+])c3cc(C)ccc32)ccn1 ZINC001169689419 1129746729 /nfs/dbraw/zinc/74/67/29/1129746729.db2.gz JCACFMKRTTXDBQ-QGZVFWFLSA-N 1 3 281.403 3.884 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@@H]1CCC=CCCC1 ZINC000902456651 1130012532 /nfs/dbraw/zinc/01/25/32/1130012532.db2.gz PYFRHRQMEGUWRY-GOEBONIOSA-N 1 3 287.451 3.636 20 0 CHADHO C[C@H]1CC[C@H]([NH2+]C2CCN(CC3CCCCC3)CC2)C1 ZINC001170112326 1130264324 /nfs/dbraw/zinc/26/43/24/1130264324.db2.gz JBOXTHIIWFMBJV-YJBOKZPZSA-N 1 3 278.484 3.809 20 0 CHADHO c1ccc2c(c1)cccc2CCN[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000677237044 1130297104 /nfs/dbraw/zinc/29/71/04/1130297104.db2.gz ZFSMNINRYARVEO-OALUTQOASA-N 1 3 294.442 3.599 20 0 CHADHO c1ccc2c(c1)cccc2CCN[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000677237044 1130297107 /nfs/dbraw/zinc/29/71/07/1130297107.db2.gz ZFSMNINRYARVEO-OALUTQOASA-N 1 3 294.442 3.599 20 0 CHADHO c1ccc([C@H](N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)C2CCC2)cc1 ZINC000677242387 1130298175 /nfs/dbraw/zinc/29/81/75/1130298175.db2.gz ZQCXVNPGQPAENM-QYZOEREBSA-N 1 3 284.447 3.744 20 0 CHADHO c1ccc([C@H](N[C@@H]2CC[N@H+]3CCC[C@H]3C2)C2CCC2)cc1 ZINC000677242387 1130298178 /nfs/dbraw/zinc/29/81/78/1130298178.db2.gz ZQCXVNPGQPAENM-QYZOEREBSA-N 1 3 284.447 3.744 20 0 CHADHO CC(C)[N@H+](CCC1CCCCC1)[C@H]1CCCNCC1 ZINC001206579917 1130488730 /nfs/dbraw/zinc/48/87/30/1130488730.db2.gz AXBCAWKFNMHERG-KRWDZBQOSA-N 1 3 266.473 3.809 20 0 CHADHO CC(C)[N@@H+](CCC1CCCCC1)[C@H]1CCCNCC1 ZINC001206579917 1130488733 /nfs/dbraw/zinc/48/87/33/1130488733.db2.gz AXBCAWKFNMHERG-KRWDZBQOSA-N 1 3 266.473 3.809 20 0 CHADHO CCC(CC)(CC)C[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000679840901 1130559399 /nfs/dbraw/zinc/55/93/99/1130559399.db2.gz PXYBYNUWFVYNFG-INIZCTEOSA-N 1 3 268.489 3.913 20 0 CHADHO CC(C)c1ccccc1CN1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001235041019 1130705850 /nfs/dbraw/zinc/70/58/50/1130705850.db2.gz WIYHQXGMPVKIJB-LJQANCHMSA-N 1 3 286.463 3.918 20 0 CHADHO [NH3+]C[C@@H]1CCCN(Cc2ccc(-c3cccs3)cc2)C1 ZINC001235673749 1130765711 /nfs/dbraw/zinc/76/57/11/1130765711.db2.gz CZJSRJWLMYDBQF-HNNXBMFYSA-N 1 3 286.444 3.586 20 0 CHADHO C[C@@H](C[N@@H+]1CCC[C@@H](CN)C1)c1cccc2ccccc21 ZINC001235675320 1130766036 /nfs/dbraw/zinc/76/60/36/1130766036.db2.gz VQKGUASDKMXFAQ-HOTGVXAUSA-N 1 3 282.431 3.614 20 0 CHADHO C[C@@H](C[N@H+]1CCC[C@@H](CN)C1)c1cccc2ccccc21 ZINC001235675320 1130766041 /nfs/dbraw/zinc/76/60/41/1130766041.db2.gz VQKGUASDKMXFAQ-HOTGVXAUSA-N 1 3 282.431 3.614 20 0 CHADHO Cc1ccc([C@@H]2CCCN2CC[C@H]2CCCC[NH2+]2)cc1 ZINC001235679043 1130767669 /nfs/dbraw/zinc/76/76/69/1130767669.db2.gz OFJJMJOVAMCLLW-MSOLQXFVSA-N 1 3 272.436 3.664 20 0 CHADHO Cc1c(F)ccc(CN(C)CCC2CC[NH2+]CC2)c1Cl ZINC001235718045 1130771344 /nfs/dbraw/zinc/77/13/44/1130771344.db2.gz SRXQKZTWUPGNPM-UHFFFAOYSA-N 1 3 298.833 3.609 20 0 CHADHO CC[N@H+](Cc1c(C)sc2ccccc21)C1CCNCC1 ZINC001235762274 1130776277 /nfs/dbraw/zinc/77/62/77/1130776277.db2.gz REYSPTPIOZORIU-UHFFFAOYSA-N 1 3 288.460 3.784 20 0 CHADHO CCN(Cc1c(C)sc2ccccc21)C1CC[NH2+]CC1 ZINC001235762274 1130776272 /nfs/dbraw/zinc/77/62/72/1130776272.db2.gz REYSPTPIOZORIU-UHFFFAOYSA-N 1 3 288.460 3.784 20 0 CHADHO CC[N@@H+](Cc1c(C)sc2ccccc21)C1CCNCC1 ZINC001235762274 1130776282 /nfs/dbraw/zinc/77/62/82/1130776282.db2.gz REYSPTPIOZORIU-UHFFFAOYSA-N 1 3 288.460 3.784 20 0 CHADHO CN(CCC1C[NH2+]C1)Cc1sc2ccccc2c1Cl ZINC001235947464 1130812947 /nfs/dbraw/zinc/81/29/47/1130812947.db2.gz BWHMAFXLEJVRNG-UHFFFAOYSA-N 1 3 294.851 3.596 20 0 CHADHO Cc1c(C)c(C)c(CN(C)C[C@@H]2CCC[NH2+]C2)c(C)c1C ZINC001235956789 1130816027 /nfs/dbraw/zinc/81/60/27/1130816027.db2.gz IIGHFORZUHHXKV-GOSISDBHSA-N 1 3 288.479 3.660 20 0 CHADHO Cc1ccc(-c2ccc(C[N@@H+]3C[C@@H]4CC[C@@]4(N)C3)cc2)cc1 ZINC001235995468 1130825044 /nfs/dbraw/zinc/82/50/44/1130825044.db2.gz VYRWCVVVYZONEA-VQTJNVASSA-N 1 3 292.426 3.585 20 0 CHADHO Cc1ccc(-c2ccc(C[N@H+]3C[C@@H]4CC[C@@]4(N)C3)cc2)cc1 ZINC001235995468 1130825048 /nfs/dbraw/zinc/82/50/48/1130825048.db2.gz VYRWCVVVYZONEA-VQTJNVASSA-N 1 3 292.426 3.585 20 0 CHADHO C[C@H](CN)C[N@H+](Cc1ccccc1)[C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170731500 1130836181 /nfs/dbraw/zinc/83/61/81/1130836181.db2.gz RAXJLVXHJIHRDK-DDBAPUKQSA-N 1 3 286.463 3.518 20 0 CHADHO C[C@H](CN)C[N@@H+](Cc1ccccc1)[C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170731500 1130836184 /nfs/dbraw/zinc/83/61/84/1130836184.db2.gz RAXJLVXHJIHRDK-DDBAPUKQSA-N 1 3 286.463 3.518 20 0 CHADHO CC1(C)[C@@H]2C[C@@H]([NH2+]C3CCN(C4CCCCC4)CC3)C[C@@H]21 ZINC001170731035 1130836810 /nfs/dbraw/zinc/83/68/10/1130836810.db2.gz NTKVDKVVXZSHEP-XGWQRUHWSA-N 1 3 290.495 3.808 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@@H+]1C[C@H](C)C[C@@H](N)C1 ZINC001236049859 1130839260 /nfs/dbraw/zinc/83/92/60/1130839260.db2.gz QZIOGPIHUXMEIT-CRAIPNDOSA-N 1 3 294.442 3.831 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@H+]1C[C@H](C)C[C@@H](N)C1 ZINC001236049859 1130839265 /nfs/dbraw/zinc/83/92/65/1130839265.db2.gz QZIOGPIHUXMEIT-CRAIPNDOSA-N 1 3 294.442 3.831 20 0 CHADHO C[C@H]1C[N@H+](Cc2ccc(-c3ccc(F)cc3)cc2)CCCN1 ZINC001236095342 1130860065 /nfs/dbraw/zinc/86/00/65/1130860065.db2.gz QUYAFIBCEQHNBL-HNNXBMFYSA-N 1 3 298.405 3.677 20 0 CHADHO C[C@H]1C[N@@H+](Cc2ccc(-c3ccc(F)cc3)cc2)CCCN1 ZINC001236095342 1130860071 /nfs/dbraw/zinc/86/00/71/1130860071.db2.gz QUYAFIBCEQHNBL-HNNXBMFYSA-N 1 3 298.405 3.677 20 0 CHADHO C[N@H+](Cc1c[nH]c2ccc(Cl)cc12)[C@H]1CCCC[C@H]1N ZINC001236212959 1130890519 /nfs/dbraw/zinc/89/05/19/1130890519.db2.gz MWCLREHYNDGFBT-ZBFHGGJFSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@@H+](Cc1c[nH]c2ccc(Cl)cc12)[C@H]1CCCC[C@H]1N ZINC001236212959 1130890528 /nfs/dbraw/zinc/89/05/28/1130890528.db2.gz MWCLREHYNDGFBT-ZBFHGGJFSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@H+](Cc1cccc2sccc21)[C@H]1CCCC[C@@H]1N ZINC001236214545 1130891612 /nfs/dbraw/zinc/89/16/12/1130891612.db2.gz FSPQWLVATJOUPH-GJZGRUSLSA-N 1 3 274.433 3.603 20 0 CHADHO C[N@@H+](Cc1cccc2sccc21)[C@H]1CCCC[C@@H]1N ZINC001236214545 1130891618 /nfs/dbraw/zinc/89/16/18/1130891618.db2.gz FSPQWLVATJOUPH-GJZGRUSLSA-N 1 3 274.433 3.603 20 0 CHADHO C[N@H+](Cc1c[nH]c2cc(Cl)ccc12)[C@@H]1CCCC[C@@H]1N ZINC001236217390 1130893433 /nfs/dbraw/zinc/89/34/33/1130893433.db2.gz OUSOCJBSSISPIC-GOEBONIOSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@@H+](Cc1c[nH]c2cc(Cl)ccc12)[C@@H]1CCCC[C@@H]1N ZINC001236217390 1130893438 /nfs/dbraw/zinc/89/34/38/1130893438.db2.gz OUSOCJBSSISPIC-GOEBONIOSA-N 1 3 291.826 3.523 20 0 CHADHO CSc1cccc(Cl)c1CN(C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236223509 1130897495 /nfs/dbraw/zinc/89/74/95/1130897495.db2.gz ODWPQGYDZQJEEQ-HAQNSBGRSA-N 1 3 298.883 3.764 20 0 CHADHO CCN(CCCCC[NH3+])Cc1ccc(Cl)cc1Cl ZINC001236266557 1130909625 /nfs/dbraw/zinc/90/96/25/1130909625.db2.gz TYSDDKSWXNMWQU-UHFFFAOYSA-N 1 3 289.250 3.944 20 0 CHADHO Cc1ccccc1C[N@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236372788 1130922556 /nfs/dbraw/zinc/92/25/56/1130922556.db2.gz DMECJPZOTWTJQD-KRWDZBQOSA-N 1 3 286.463 3.739 20 0 CHADHO Cc1ccccc1C[N@@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236372788 1130922562 /nfs/dbraw/zinc/92/25/62/1130922562.db2.gz DMECJPZOTWTJQD-KRWDZBQOSA-N 1 3 286.463 3.739 20 0 CHADHO CCN(Cc1ccccc1-c1ccccc1)C[C@@H]1CC[NH2+]C1 ZINC001236407442 1130930945 /nfs/dbraw/zinc/93/09/45/1130930945.db2.gz FKTMOAVZPBNWCR-QGZVFWFLSA-N 1 3 294.442 3.785 20 0 CHADHO CCN(Cc1cccc(-c2ccccc2)c1)C[C@@H]1CC[NH2+]C1 ZINC001236407149 1130931623 /nfs/dbraw/zinc/93/16/23/1130931623.db2.gz CNSLYAMWVOKJHM-GOSISDBHSA-N 1 3 294.442 3.785 20 0 CHADHO CC(C)=CCCC1=CC[C@H](CN2CC[C@@](F)(C[NH3+])C2)CC1 ZINC001236433770 1130941068 /nfs/dbraw/zinc/94/10/68/1130941068.db2.gz IKTXJMDWUYMVND-ZWKOTPCHSA-N 1 3 294.458 3.832 20 0 CHADHO CCc1cccc(C[N@H+](CC(C)(C)C)C2CCNCC2)c1 ZINC001236457325 1130946694 /nfs/dbraw/zinc/94/66/94/1130946694.db2.gz MDUWIKRMANLOSE-UHFFFAOYSA-N 1 3 288.479 3.849 20 0 CHADHO CCc1cccc(C[N@@H+](CC(C)(C)C)C2CCNCC2)c1 ZINC001236457325 1130946696 /nfs/dbraw/zinc/94/66/96/1130946696.db2.gz MDUWIKRMANLOSE-UHFFFAOYSA-N 1 3 288.479 3.849 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@H+](C[C@H]1CCCNC1)C1CC1 ZINC001236584861 1130980378 /nfs/dbraw/zinc/98/03/78/1130980378.db2.gz XKYXBPYHPWJYTK-SJORKVTESA-N 1 3 278.484 3.833 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@@H+](C[C@H]1CCCNC1)C1CC1 ZINC001236584861 1130980383 /nfs/dbraw/zinc/98/03/83/1130980383.db2.gz XKYXBPYHPWJYTK-SJORKVTESA-N 1 3 278.484 3.833 20 0 CHADHO Cc1cc(CN(C2CCC2)C2CC[NH2+]CC2)ccc1Cl ZINC001236637508 1130986587 /nfs/dbraw/zinc/98/65/87/1130986587.db2.gz QXCDBWHYFIGVBR-UHFFFAOYSA-N 1 3 292.854 3.755 20 0 CHADHO Cc1cc(C[N@H+](C2CCC2)C2CCNCC2)ccc1Cl ZINC001236637508 1130986592 /nfs/dbraw/zinc/98/65/92/1130986592.db2.gz QXCDBWHYFIGVBR-UHFFFAOYSA-N 1 3 292.854 3.755 20 0 CHADHO Cc1cc(C[N@@H+](C2CCC2)C2CCNCC2)ccc1Cl ZINC001236637508 1130986595 /nfs/dbraw/zinc/98/65/95/1130986595.db2.gz QXCDBWHYFIGVBR-UHFFFAOYSA-N 1 3 292.854 3.755 20 0 CHADHO CCCN(Cc1ccc(CC(C)C)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236843476 1131020323 /nfs/dbraw/zinc/02/03/23/1131020323.db2.gz OZIGJFGCFLLQMA-LJQANCHMSA-N 1 3 288.479 3.707 20 0 CHADHO CCCN(Cc1ccccc1C(C)C)C[C@H]1CC[NH2+]C1 ZINC001236844190 1131021838 /nfs/dbraw/zinc/02/18/38/1131021838.db2.gz UVUYIZKMBVKDGW-INIZCTEOSA-N 1 3 274.452 3.632 20 0 CHADHO CCCN(Cc1cc(C)cc(SC)c1)C[C@H]1CC[NH2+]C1 ZINC001236843955 1131021980 /nfs/dbraw/zinc/02/19/80/1131021980.db2.gz NQEFRNJDANUPBE-HNNXBMFYSA-N 1 3 292.492 3.538 20 0 CHADHO CC(C)CCCN1CCC2(CC1)[NH2+]CCc1ccccc12 ZINC001237274410 1131076406 /nfs/dbraw/zinc/07/64/06/1131076406.db2.gz CAFAYCKRLYYWND-UHFFFAOYSA-N 1 3 286.463 3.560 20 0 CHADHO CCCCCC[N@@H+]1Cc2ccccc2C12CCNCC2 ZINC001237300850 1131081288 /nfs/dbraw/zinc/08/12/88/1131081288.db2.gz PWSHPYIHSGQHCO-UHFFFAOYSA-N 1 3 272.436 3.661 20 0 CHADHO CCCCCC[N@H+]1Cc2ccccc2C12CCNCC2 ZINC001237300850 1131081295 /nfs/dbraw/zinc/08/12/95/1131081295.db2.gz PWSHPYIHSGQHCO-UHFFFAOYSA-N 1 3 272.436 3.661 20 0 CHADHO c1ccc(C2(CN3CC[C@@H]4[NH2+]CCC[C@H]4C3)CCCC2)cc1 ZINC001237381234 1131092604 /nfs/dbraw/zinc/09/26/04/1131092604.db2.gz IIISACWTQMMXLP-HKUYNNGSSA-N 1 3 298.474 3.572 20 0 CHADHO [NH3+]CCc1ccc(CN[C@@H]2CCSc3ccccc32)cc1 ZINC000817946970 1131189226 /nfs/dbraw/zinc/18/92/26/1131189226.db2.gz IXOZAOJZLFPPMF-QGZVFWFLSA-N 1 3 298.455 3.515 20 0 CHADHO CC1(C)Cc2occc2[C@H](NCc2ccc(CC[NH3+])cc2)C1 ZINC000817947271 1131189765 /nfs/dbraw/zinc/18/97/65/1131189765.db2.gz AYWXYODTGFXMBB-QGZVFWFLSA-N 1 3 298.430 3.584 20 0 CHADHO CC(C)[C@@H](N)C[NH2+][C@H](C)c1ccc(SC(F)F)cc1 ZINC000817959180 1131192851 /nfs/dbraw/zinc/19/28/51/1131192851.db2.gz PXBVLSOJFYFFRP-MFKMUULPSA-N 1 3 288.407 3.635 20 0 CHADHO CC1(C)C[C@H]([NH2+]CCC2CCCCCCC2)CCN1 ZINC001246236471 1131422060 /nfs/dbraw/zinc/42/20/60/1131422060.db2.gz KSKQGKAQXDCBSI-MRXNPFEDSA-N 1 3 266.473 3.857 20 0 CHADHO CCCC[C@H]1C[C@@H]([NH2+]CCCC2CCCC2)CCN1 ZINC001246239295 1131422960 /nfs/dbraw/zinc/42/29/60/1131422960.db2.gz MNYJCTBRKYPQHY-IRXDYDNUSA-N 1 3 266.473 3.857 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CCN[C@H](C(C)(C)C)C1)C1CCCCC1 ZINC001246243681 1131430366 /nfs/dbraw/zinc/43/03/66/1131430366.db2.gz HIQDODYKGCOLKY-BMFZPTHFSA-N 1 3 266.473 3.712 20 0 CHADHO CCCC[C@H]1C[C@H]([NH2+]C2CCC(C)(C)CC2)CCN1 ZINC001246308139 1131458209 /nfs/dbraw/zinc/45/82/09/1131458209.db2.gz JCBPLUBQTZWWTD-JKSUJKDBSA-N 1 3 266.473 3.856 20 0 CHADHO CC(C)(C)[C@H]1C[C@@H]([NH2+]C2CCC(C)(C)CC2)CCN1 ZINC001246313368 1131462020 /nfs/dbraw/zinc/46/20/20/1131462020.db2.gz YSHRFFVBJXOZFU-LSDHHAIUSA-N 1 3 266.473 3.712 20 0 CHADHO CCC[C@@H](C)CC[C@@H](C)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246332886 1131472124 /nfs/dbraw/zinc/47/21/24/1131472124.db2.gz NQMJIPPDWVARKE-MTSZKFMLSA-N 1 3 266.473 3.854 20 0 CHADHO CCc1cccc2c(C[N@H+](C)CCCN3CCCC3)c[nH]c21 ZINC001138362327 1131495297 /nfs/dbraw/zinc/49/52/97/1131495297.db2.gz XMPKITHOLJUCER-UHFFFAOYSA-N 1 3 299.462 3.648 20 0 CHADHO CCc1cccc2c(C[N@@H+](C)CCCN3CCCC3)c[nH]c21 ZINC001138362327 1131495298 /nfs/dbraw/zinc/49/52/98/1131495298.db2.gz XMPKITHOLJUCER-UHFFFAOYSA-N 1 3 299.462 3.648 20 0 CHADHO CCCC[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCC(F)(F)C2)CCN1 ZINC001246437778 1131500836 /nfs/dbraw/zinc/50/08/36/1131500836.db2.gz VVSHSTJPRIDGKE-ZNMIVQPWSA-N 1 3 288.426 3.712 20 0 CHADHO CSC(C)(C)C[C@@H](C)[NH2+]C1(CC2CCC2)CCNCC1 ZINC001246448428 1131502788 /nfs/dbraw/zinc/50/27/88/1131502788.db2.gz UJSKKKOKDOYONI-CQSZACIVSA-N 1 3 298.540 3.809 20 0 CHADHO CCCCCC[C@H](CCCC)[NH2+][C@H]1C[C@@](C)(N)C1 ZINC001246461361 1131511508 /nfs/dbraw/zinc/51/15/08/1131511508.db2.gz PHXQJXMMKQJEDU-HRCADAONSA-N 1 3 254.462 3.985 20 0 CHADHO CCCC(C[NH3+])(CCC)N[C@H]1CSc2ccccc2C1 ZINC001246504319 1131534083 /nfs/dbraw/zinc/53/40/83/1131534083.db2.gz PKJQGIYWUOXLCE-OAHLLOKOSA-N 1 3 292.492 3.591 20 0 CHADHO CCCN(CCC[NH+](C)C)Cc1ccc(-n2cccc2)cc1 ZINC001144251441 1131607387 /nfs/dbraw/zinc/60/73/87/1131607387.db2.gz GHTQNFUIJOHWNZ-UHFFFAOYSA-N 1 3 299.462 3.641 20 0 CHADHO C[C@@H]1CC[N@@H+]([C@@H]2CCCC3(CCCCC3)C2)C[C@@H]1CN ZINC001246554291 1131612582 /nfs/dbraw/zinc/61/25/82/1131612582.db2.gz UYYHFKDVZLCTJU-IXDOHACOSA-N 1 3 278.484 3.796 20 0 CHADHO C[C@@H]1CC[N@H+]([C@@H]2CCCC3(CCCCC3)C2)C[C@@H]1CN ZINC001246554291 1131612588 /nfs/dbraw/zinc/61/25/88/1131612588.db2.gz UYYHFKDVZLCTJU-IXDOHACOSA-N 1 3 278.484 3.796 20 0 CHADHO CN(C)CCC[N@H+](C)Cc1ccc2oc3ccccc3c2c1 ZINC001139751707 1131634049 /nfs/dbraw/zinc/63/40/49/1131634049.db2.gz ZWZXNBQGMXMXLM-UHFFFAOYSA-N 1 3 296.414 3.970 20 0 CHADHO CN(C)CCC[N@@H+](C)Cc1ccc2oc3ccccc3c2c1 ZINC001139751707 1131634052 /nfs/dbraw/zinc/63/40/52/1131634052.db2.gz ZWZXNBQGMXMXLM-UHFFFAOYSA-N 1 3 296.414 3.970 20 0 CHADHO C[C@@H]1CCC[N@@H+]([C@@H]2CCN[C@H](C(C)(C)C)C2)C[C@@H]1C ZINC001246574958 1131660907 /nfs/dbraw/zinc/66/09/07/1131660907.db2.gz OZKVDFHKJLEFOX-QXSJWSMHSA-N 1 3 266.473 3.521 20 0 CHADHO C[C@@H]1CCC[N@H+]([C@@H]2CCN[C@H](C(C)(C)C)C2)C[C@@H]1C ZINC001246574958 1131660910 /nfs/dbraw/zinc/66/09/10/1131660910.db2.gz OZKVDFHKJLEFOX-QXSJWSMHSA-N 1 3 266.473 3.521 20 0 CHADHO C1CN([C@H]2CCCC3(CCCCC3)C2)[C@@]2(C1)CC[NH2+]C2 ZINC001246646526 1131774349 /nfs/dbraw/zinc/77/43/49/1131774349.db2.gz FRHKVRHVDWRAGA-WMZOPIPTSA-N 1 3 276.468 3.707 20 0 CHADHO CCCN(Cc1ccccc1)[C@@H]1CC[NH2+][C@@H](C(C)C)C1 ZINC001246776629 1131780987 /nfs/dbraw/zinc/78/09/87/1131780987.db2.gz LITAGRPVHPVJCC-QZTJIDSGSA-N 1 3 274.452 3.675 20 0 CHADHO CCCCC[C@H](CCC)[N@@H+]1CC[C@@]2(C1)CNCC[C@@H]2F ZINC001246693716 1131782005 /nfs/dbraw/zinc/78/20/05/1131782005.db2.gz QGRVIHYNLIELSU-ULQDDVLXSA-N 1 3 284.463 3.759 20 0 CHADHO CCCCC[C@H](CCC)[N@H+]1CC[C@@]2(C1)CNCC[C@@H]2F ZINC001246693716 1131782012 /nfs/dbraw/zinc/78/20/12/1131782012.db2.gz QGRVIHYNLIELSU-ULQDDVLXSA-N 1 3 284.463 3.759 20 0 CHADHO CCCC[C@@H]1C[C@H]([NH+]2CCC(C(C)C)CC2)CCN1 ZINC001246843481 1131788974 /nfs/dbraw/zinc/78/89/74/1131788974.db2.gz CSMFLXZXOGCQNT-IAGOWNOFSA-N 1 3 266.473 3.665 20 0 CHADHO C1=C[C@H](C[NH2+][C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)CC1 ZINC000716694223 1132029404 /nfs/dbraw/zinc/02/94/04/1132029404.db2.gz RXQMHMAWRPAOLN-FFGOWVMKSA-N 1 3 296.458 3.595 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@@H]2CCCC(F)(F)C2)CC1(C)C ZINC001171623008 1132066945 /nfs/dbraw/zinc/06/69/45/1132066945.db2.gz GMGMYCKKAPVXHZ-GFCCVEGCSA-N 1 3 288.426 3.805 20 0 CHADHO C[C@H]1CCN1[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171975471 1132117434 /nfs/dbraw/zinc/11/74/34/1132117434.db2.gz DCWFEUXTHBFQFX-RDJZCZTQSA-N 1 3 272.436 3.524 20 0 CHADHO C[C@H]1CCN1[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171975471 1132117439 /nfs/dbraw/zinc/11/74/39/1132117439.db2.gz DCWFEUXTHBFQFX-RDJZCZTQSA-N 1 3 272.436 3.524 20 0 CHADHO C[C@@H]1CCN1[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171975472 1132117633 /nfs/dbraw/zinc/11/76/33/1132117633.db2.gz DCWFEUXTHBFQFX-WBVHZDCISA-N 1 3 272.436 3.524 20 0 CHADHO C[C@@H]1CCN1[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171975472 1132117635 /nfs/dbraw/zinc/11/76/35/1132117635.db2.gz DCWFEUXTHBFQFX-WBVHZDCISA-N 1 3 272.436 3.524 20 0 CHADHO CC[C@@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001172101630 1132123500 /nfs/dbraw/zinc/12/35/00/1132123500.db2.gz GNWNGZXDABSILH-ZJPYXAASSA-N 1 3 290.426 3.882 20 0 CHADHO CC[C@@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001172101630 1132123502 /nfs/dbraw/zinc/12/35/02/1132123502.db2.gz GNWNGZXDABSILH-ZJPYXAASSA-N 1 3 290.426 3.882 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC3(CC[C@H](F)C3)CC1)C2 ZINC001172129050 1132128447 /nfs/dbraw/zinc/12/84/47/1132128447.db2.gz VUTYLZNIYAFSHU-NXOAAHMSSA-N 1 3 294.458 3.606 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]C2CCN(C3CCCC3)CC2)C[C@H]1C ZINC001172370797 1132195866 /nfs/dbraw/zinc/19/58/66/1132195866.db2.gz XRKAFZNONNYEJZ-INMHGKMJSA-N 1 3 278.484 3.808 20 0 CHADHO CC[C@@H](CC(C)C)[NH2+]CCCN1CCCC[C@H]1C ZINC001172390242 1132214530 /nfs/dbraw/zinc/21/45/30/1132214530.db2.gz SIGCFIWFZNPWEU-CVEARBPZSA-N 1 3 254.462 3.665 20 0 CHADHO CC(C)[N@H+](CCCN)[C@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172531849 1132245508 /nfs/dbraw/zinc/24/55/08/1132245508.db2.gz BPGVDPNUNNRIFN-MSOLQXFVSA-N 1 3 274.452 3.772 20 0 CHADHO CC(C)[N@@H+](CCCN)[C@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172531849 1132245515 /nfs/dbraw/zinc/24/55/15/1132245515.db2.gz BPGVDPNUNNRIFN-MSOLQXFVSA-N 1 3 274.452 3.772 20 0 CHADHO CC1([NH3+])CCN([C@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001172541399 1132277572 /nfs/dbraw/zinc/27/75/72/1132277572.db2.gz XNSYAXDEFOLXIV-SJORKVTESA-N 1 3 272.436 3.526 20 0 CHADHO CCCCCC[C@H](C)[NH2+][C@@H]1CCNC2(CCC2)C1 ZINC000841090206 1132326820 /nfs/dbraw/zinc/32/68/20/1132326820.db2.gz MODVEYCUZPZZRM-LSDHHAIUSA-N 1 3 252.446 3.610 20 0 CHADHO C[N@H+](Cc1cc2cnccc2[nH]1)[C@@H]1CCc2ccccc21 ZINC001232018917 1132412665 /nfs/dbraw/zinc/41/26/65/1132412665.db2.gz QWTVYTSRYWDUGC-GOSISDBHSA-N 1 3 277.371 3.682 20 0 CHADHO C[N@@H+](Cc1cc2cnccc2[nH]1)[C@@H]1CCc2ccccc21 ZINC001232018917 1132412667 /nfs/dbraw/zinc/41/26/67/1132412667.db2.gz QWTVYTSRYWDUGC-GOSISDBHSA-N 1 3 277.371 3.682 20 0 CHADHO C[C@H](CN)C[NH2+][C@H](C)CC(c1ccccc1)c1ccccc1 ZINC001173209967 1132416236 /nfs/dbraw/zinc/41/62/36/1132416236.db2.gz HRULUHCAPBBVPF-IAGOWNOFSA-N 1 3 296.458 3.782 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@@H+]2CC[C@H]3CCC[C@H]3C2)c1 ZINC001232145226 1132427200 /nfs/dbraw/zinc/42/72/00/1132427200.db2.gz YQIMIRWMOGEAKI-SJORKVTESA-N 1 3 290.426 3.509 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@H+]2CC[C@H]3CCC[C@H]3C2)c1 ZINC001232145226 1132427202 /nfs/dbraw/zinc/42/72/02/1132427202.db2.gz YQIMIRWMOGEAKI-SJORKVTESA-N 1 3 290.426 3.509 20 0 CHADHO CN(C)Cc1cc(F)cc(C[NH+]2C[C@@H]3CCCC[C@H]3C2)c1 ZINC001232145116 1132427227 /nfs/dbraw/zinc/42/72/27/1132427227.db2.gz VRPCUBUYOOYKTG-IRXDYDNUSA-N 1 3 290.426 3.509 20 0 CHADHO CC[C@H]1CC[C@H]([NH+]2CCC(N3CCCCC3)CC2)C1 ZINC001173272909 1132438052 /nfs/dbraw/zinc/43/80/52/1132438052.db2.gz LDZOIASLTWYLQO-RDJZCZTQSA-N 1 3 264.457 3.515 20 0 CHADHO CC[C@H]1CC[C@H](N2CCC([NH+]3CCCCC3)CC2)C1 ZINC001173272909 1132438054 /nfs/dbraw/zinc/43/80/54/1132438054.db2.gz LDZOIASLTWYLQO-RDJZCZTQSA-N 1 3 264.457 3.515 20 0 CHADHO CC[C@H]1CC[C@H](N2CCC(C)([NH+]3CCCC3)CC2)C1 ZINC001173281661 1132454974 /nfs/dbraw/zinc/45/49/74/1132454974.db2.gz ATQPGSNQCHZYNM-HOTGVXAUSA-N 1 3 264.457 3.515 20 0 CHADHO CC(C)C[C@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)c1ccncc1 ZINC000842847922 1132469451 /nfs/dbraw/zinc/46/94/51/1132469451.db2.gz DUWLYJKPLNVDGW-BZSNNMDCSA-N 1 3 289.467 3.631 20 0 CHADHO CC(C)(C)c1cc(Nc2cccc(C[NH3+])c2)ccn1 ZINC001159648953 1132883391 /nfs/dbraw/zinc/88/33/91/1132883391.db2.gz IWMZYDZASSJUGI-UHFFFAOYSA-N 1 3 255.365 3.581 20 0 CHADHO Cc1ccc2c(N[C@@H]3CNCc4ccsc43)cc[nH+]c2c1 ZINC001163235465 1133140146 /nfs/dbraw/zinc/14/01/46/1133140146.db2.gz BLRHGEUEXITFFJ-MRXNPFEDSA-N 1 3 295.411 3.861 20 0 CHADHO C[C@H](CC[NH2+]Cc1ccc(-c2cccs2)cc1)N(C)C ZINC001203271642 1133309336 /nfs/dbraw/zinc/30/93/36/1133309336.db2.gz VKASMOACULRPMT-CQSZACIVSA-N 1 3 288.460 3.845 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](CN2CC[C@@](C)([NH3+])C2)CC1 ZINC001204763188 1133481566 /nfs/dbraw/zinc/48/15/66/1133481566.db2.gz HUIJEJVLZDPZDD-QZTJIDSGSA-N 1 3 276.468 3.882 20 0 CHADHO CC(C)=CCCC1=CC[C@H](CN2CC[C@](C)([NH3+])C2)CC1 ZINC001204763189 1133482069 /nfs/dbraw/zinc/48/20/69/1133482069.db2.gz HUIJEJVLZDPZDD-ROUUACIJSA-N 1 3 276.468 3.882 20 0 CHADHO C[C@H]1CC[C@@H](C[NH3+])N1Cc1cccc2c3ccccc3oc21 ZINC001205068622 1133522947 /nfs/dbraw/zinc/52/29/47/1133522947.db2.gz KUPXUVMPDFAFMT-ZFWWWQNUSA-N 1 3 294.398 3.898 20 0 CHADHO CC(C)(C)Oc1cccc(CN2CCC[C@](C)([NH3+])CC2)c1 ZINC001205288523 1133554230 /nfs/dbraw/zinc/55/42/30/1133554230.db2.gz KYQDARXQWBZPHQ-SFHVURJKSA-N 1 3 290.451 3.567 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@@H+]1CC[C@@H](C)[C@@H](CN)C1 ZINC001205296200 1133555506 /nfs/dbraw/zinc/55/55/06/1133555506.db2.gz ITFUAHIOUPJRRA-BBWFWOEESA-N 1 3 298.515 3.525 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@H+]1CC[C@@H](C)[C@@H](CN)C1 ZINC001205296200 1133555510 /nfs/dbraw/zinc/55/55/10/1133555510.db2.gz ITFUAHIOUPJRRA-BBWFWOEESA-N 1 3 298.515 3.525 20 0 CHADHO C[C@H]1CCNCC[N@@H+]1Cc1ccccc1-c1ccc(F)cc1 ZINC001205332848 1133563162 /nfs/dbraw/zinc/56/31/62/1133563162.db2.gz UUAUKJVIRRTLBD-HNNXBMFYSA-N 1 3 298.405 3.677 20 0 CHADHO C[C@H]1CCNCC[N@H+]1Cc1ccccc1-c1ccc(F)cc1 ZINC001205332848 1133563166 /nfs/dbraw/zinc/56/31/66/1133563166.db2.gz UUAUKJVIRRTLBD-HNNXBMFYSA-N 1 3 298.405 3.677 20 0 CHADHO CC[C@H](C)[C@H](CNC(C)(C)CC[NH+]1CCCCCC1)OC ZINC001205470624 1133580019 /nfs/dbraw/zinc/58/00/19/1133580019.db2.gz AYVKASDWAGAVSL-IRXDYDNUSA-N 1 3 298.515 3.682 20 0 CHADHO Cc1cc(CN2CC[C@H](C)[C@@H](C[NH3+])CC2)c(F)cc1Cl ZINC001205655155 1133599740 /nfs/dbraw/zinc/59/97/40/1133599740.db2.gz YWUNKUZPALJATG-WCQYABFASA-N 1 3 298.833 3.594 20 0 CHADHO C[C@@H]1CC[C@@H](CN)[N@H+](Cc2ccc(F)c3ccccc23)C1 ZINC001205816514 1133618452 /nfs/dbraw/zinc/61/84/52/1133618452.db2.gz NFUAEXDQSPEQOH-HIFRSBDPSA-N 1 3 286.394 3.538 20 0 CHADHO C[C@@H]1CC[C@@H](CN)[N@@H+](Cc2ccc(F)c3ccccc23)C1 ZINC001205816514 1133618455 /nfs/dbraw/zinc/61/84/55/1133618455.db2.gz NFUAEXDQSPEQOH-HIFRSBDPSA-N 1 3 286.394 3.538 20 0 CHADHO C[C@@H]1[C@H](CN)CCC[N@@H+]1CC1(c2ccccc2)CCCC1 ZINC001205901782 1133628619 /nfs/dbraw/zinc/62/86/19/1133628619.db2.gz GFRWADXMHYEEQF-SJORKVTESA-N 1 3 286.463 3.558 20 0 CHADHO C[C@@H]1[C@H](CN)CCC[N@H+]1CC1(c2ccccc2)CCCC1 ZINC001205901782 1133628620 /nfs/dbraw/zinc/62/86/20/1133628620.db2.gz GFRWADXMHYEEQF-SJORKVTESA-N 1 3 286.463 3.558 20 0 CHADHO C[C@H](CC[N@@H+]1CCC[C@@H](CN)[C@H]1C)CC(C)(C)C ZINC001205905164 1133628662 /nfs/dbraw/zinc/62/86/62/1133628662.db2.gz ZDNHALHDCWEQCT-KFWWJZLASA-N 1 3 254.462 3.508 20 0 CHADHO C[C@H](CC[N@H+]1CCC[C@@H](CN)[C@H]1C)CC(C)(C)C ZINC001205905164 1133628664 /nfs/dbraw/zinc/62/86/64/1133628664.db2.gz ZDNHALHDCWEQCT-KFWWJZLASA-N 1 3 254.462 3.508 20 0 CHADHO C[C@@H]1[C@H](C[NH3+])CCCN1Cc1cccc2c(F)cccc12 ZINC001205914489 1133630480 /nfs/dbraw/zinc/63/04/80/1133630480.db2.gz MMHVVNJVTHOLCH-KGLIPLIRSA-N 1 3 286.394 3.538 20 0 CHADHO Cc1ccc(F)c(CN2CCC[C@@H](C[NH3+])[C@@H](C)C2)c1Cl ZINC001205992092 1133638836 /nfs/dbraw/zinc/63/88/36/1133638836.db2.gz DKHSBJHTCABDMH-STQMWFEESA-N 1 3 298.833 3.594 20 0 CHADHO Cc1cc(CN2CCC[C@H](C[NH3+])[C@@H](C)C2)c(F)cc1Cl ZINC001206027280 1133644308 /nfs/dbraw/zinc/64/43/08/1133644308.db2.gz VRVMXNSBHWCDBK-QWHCGFSZSA-N 1 3 298.833 3.594 20 0 CHADHO CSc1cc(C)cc(CN2CCCC[C@@](C)(C[NH3+])C2)c1 ZINC001206574150 1133720984 /nfs/dbraw/zinc/72/09/84/1133720984.db2.gz PRHJTYBJLYFAJO-KRWDZBQOSA-N 1 3 292.492 3.668 20 0 CHADHO Cc1ccc2[nH]c(CN(C(C)C)[C@H]3CCC[NH2+]CC3)cc2c1 ZINC001206591290 1133723319 /nfs/dbraw/zinc/72/33/19/1133723319.db2.gz QOGXXSYTFXNIBV-SFHVURJKSA-N 1 3 299.462 3.829 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@@H+]1CCCC[C@H](CN)C1 ZINC001206606579 1133726857 /nfs/dbraw/zinc/72/68/57/1133726857.db2.gz PYWPPOWDSWDBMO-DLBZAZTESA-N 1 3 298.515 3.669 20 0 CHADHO CC[C@@H]1c2ccccc2CCN1CC(C)(C)C[NH+](C)C ZINC001207287820 1133789360 /nfs/dbraw/zinc/78/93/60/1133789360.db2.gz GMPVJYFVMBSKSF-QGZVFWFLSA-N 1 3 274.452 3.584 20 0 CHADHO CC1=C[C@H](C)[C@H](CN2CCC([NH+]3CCCC3)CC2)CC1 ZINC001208166059 1133892988 /nfs/dbraw/zinc/89/29/88/1133892988.db2.gz VDIJEBPCFJUJKE-IRXDYDNUSA-N 1 3 276.468 3.539 20 0 CHADHO CC1=C[C@H](C)[C@H](C[NH+]2CCC(N3CCCC3)CC2)CC1 ZINC001208166059 1133892994 /nfs/dbraw/zinc/89/29/94/1133892994.db2.gz VDIJEBPCFJUJKE-IRXDYDNUSA-N 1 3 276.468 3.539 20 0 CHADHO c1ccc(C[N@H+]2CC[C@H](CN3CC[C@@H]4CCC[C@@H]4C3)C2)cc1 ZINC001208943218 1133965636 /nfs/dbraw/zinc/96/56/36/1133965636.db2.gz SAPYMXCAWBJYSB-SLFFLAALSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(C[N@@H+]2CC[C@H](CN3CC[C@@H]4CCC[C@@H]4C3)C2)cc1 ZINC001208943218 1133965639 /nfs/dbraw/zinc/96/56/39/1133965639.db2.gz SAPYMXCAWBJYSB-SLFFLAALSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(CN2CC[C@H](C[N@@H+]3CC[C@@H]4CCC[C@@H]4C3)C2)cc1 ZINC001208943218 1133965644 /nfs/dbraw/zinc/96/56/44/1133965644.db2.gz SAPYMXCAWBJYSB-SLFFLAALSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(CN2CC[C@H](C[N@H+]3CC[C@@H]4CCC[C@@H]4C3)C2)cc1 ZINC001208943218 1133965647 /nfs/dbraw/zinc/96/56/47/1133965647.db2.gz SAPYMXCAWBJYSB-SLFFLAALSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(CN2CCC[C@@H](C[N@@H+]3CC4CCC3CC4)C2)cc1 ZINC001208940638 1133968254 /nfs/dbraw/zinc/96/82/54/1133968254.db2.gz UAUYYKSIWPWLFF-IOJLRTSASA-N 1 3 298.474 3.773 20 0 CHADHO c1ccc(CN2CCC[C@@H](C[N@H+]3CC4CCC3CC4)C2)cc1 ZINC001208940638 1133968257 /nfs/dbraw/zinc/96/82/57/1133968257.db2.gz UAUYYKSIWPWLFF-IOJLRTSASA-N 1 3 298.474 3.773 20 0 CHADHO Cc1c(C[N@@H+]2CCN[C@@H](C)CC2)cccc1-c1ccccc1 ZINC001210518621 1134238348 /nfs/dbraw/zinc/23/83/48/1134238348.db2.gz GYUDNMHDURBOTG-INIZCTEOSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1c(C[N@H+]2CCN[C@@H](C)CC2)cccc1-c1ccccc1 ZINC001210518621 1134238353 /nfs/dbraw/zinc/23/83/53/1134238353.db2.gz GYUDNMHDURBOTG-INIZCTEOSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1c[nH+]ccc1Nc1cccc(CN2CCCCC2)c1F ZINC001215676076 1134658743 /nfs/dbraw/zinc/65/87/43/1134658743.db2.gz OJEJEQMJQVPVNB-UHFFFAOYSA-N 1 3 299.393 3.681 20 0 CHADHO C[C@H](c1cccc(O[C@@H]2CNCc3ccccc32)c1)[NH+](C)C ZINC001218487961 1135114846 /nfs/dbraw/zinc/11/48/46/1135114846.db2.gz LECCXGKNGLPTRE-AUUYWEPGSA-N 1 3 296.414 3.533 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)C1 ZINC000309931836 1135119406 /nfs/dbraw/zinc/11/94/06/1135119406.db2.gz WPFPVZLIVCWSDY-QDGKJQRMSA-N 1 3 298.474 3.675 20 0 CHADHO C[C@H]1CCN(Cc2ccc(-c3ccccc3)cc2)C[C@@H]1C[NH3+] ZINC000317926501 1135175827 /nfs/dbraw/zinc/17/58/27/1135175827.db2.gz PFMAPLDZXNPKBZ-JXFKEZNVSA-N 1 3 294.442 3.770 20 0 CHADHO Cc1ccc(CN2CCCC[C@]3(CCCC[NH2+]C3)C2)s1 ZINC001222161618 1135203317 /nfs/dbraw/zinc/20/33/17/1135203317.db2.gz QGUVKSFUAOHCSK-KRWDZBQOSA-N 1 3 292.492 3.802 20 0 CHADHO C[C@@H](CC[N@@H+]1CCC[C@]12CCCNC2)CC(C)(C)C ZINC001222232322 1135211776 /nfs/dbraw/zinc/21/17/76/1135211776.db2.gz UXMSJFJFCIHRBD-RDJZCZTQSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@@H](CC[N@H+]1CCC[C@]12CCCNC2)CC(C)(C)C ZINC001222232322 1135211779 /nfs/dbraw/zinc/21/17/79/1135211779.db2.gz UXMSJFJFCIHRBD-RDJZCZTQSA-N 1 3 266.473 3.667 20 0 CHADHO CC(C)(CC[N@@H+]1CC[C@]2(C1)CCCCN2)c1ccccc1 ZINC001222420823 1135239572 /nfs/dbraw/zinc/23/95/72/1135239572.db2.gz HCXZZHQPGPLCEY-IBGZPJMESA-N 1 3 286.463 3.572 20 0 CHADHO CC(C)(CC[N@H+]1CC[C@]2(C1)CCCCN2)c1ccccc1 ZINC001222420823 1135239574 /nfs/dbraw/zinc/23/95/74/1135239574.db2.gz HCXZZHQPGPLCEY-IBGZPJMESA-N 1 3 286.463 3.572 20 0 CHADHO C[NH2+]CCC1CCN([C@@H](C)c2ccccc2Cl)CC1 ZINC000070188990 260154217 /nfs/dbraw/zinc/15/42/17/260154217.db2.gz RVWZOIZCRBRJOX-ZDUSSCGKSA-N 1 3 280.843 3.723 20 0 CHADHO C[C@@H](N)C[C@H](C)[NH2+]CCCc1c(Cl)cccc1Cl ZINC000574205146 335000511 /nfs/dbraw/zinc/00/05/11/335000511.db2.gz UAMDMXBDSDDKSK-MNOVXSKESA-N 1 3 289.250 3.641 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCCCc1c(Cl)cccc1Cl ZINC000574205146 335000512 /nfs/dbraw/zinc/00/05/12/335000512.db2.gz UAMDMXBDSDDKSK-MNOVXSKESA-N 1 3 289.250 3.641 20 0 CHADHO CC[C@H](NC1CC[NH+](C(C)C)CC1)c1ccccc1 ZINC000020189067 171054278 /nfs/dbraw/zinc/05/42/78/171054278.db2.gz MFCFJUWXUAZMMD-KRWDZBQOSA-N 1 3 260.425 3.600 20 0 CHADHO C[N@H+](CCCN[C@H]1CCc2ccccc21)Cc1ccccc1 ZINC000020827448 171274250 /nfs/dbraw/zinc/27/42/50/171274250.db2.gz LFZPLXNZMQWMDU-FQEVSTJZSA-N 1 3 294.442 3.786 20 0 CHADHO C[N@@H+](CCCN[C@H]1CCc2ccccc21)Cc1ccccc1 ZINC000020827448 171274251 /nfs/dbraw/zinc/27/42/51/171274251.db2.gz LFZPLXNZMQWMDU-FQEVSTJZSA-N 1 3 294.442 3.786 20 0 CHADHO C[C@H](C[NH2+]CCCN1CCC(C)CC1)c1ccccc1 ZINC000021787834 171322868 /nfs/dbraw/zinc/32/28/68/171322868.db2.gz NRNIHPCLOGIGLE-QGZVFWFLSA-N 1 3 274.452 3.502 20 0 CHADHO CCCC(CCC)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000021788456 171323512 /nfs/dbraw/zinc/32/35/12/171323512.db2.gz IWAFNWSTDRIWBL-UHFFFAOYSA-N 1 3 254.462 3.854 20 0 CHADHO C[C@H](C[NH2+]Cc1ccc2occc2c1)CN1CCCCC1 ZINC000352781623 227217731 /nfs/dbraw/zinc/21/77/31/227217731.db2.gz SXZIATMQEQLGRI-OAHLLOKOSA-N 1 3 286.419 3.644 20 0 CHADHO Cc1oc2ccccc2c1CN[C@@H]1CC[N@@H+](C)[C@H]2CCC[C@@H]21 ZINC000353679007 228143663 /nfs/dbraw/zinc/14/36/63/228143663.db2.gz FRHKATPLFHUVEH-NXHRZFHOSA-N 1 3 298.430 3.704 20 0 CHADHO Cc1oc2ccccc2c1CN[C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21 ZINC000353679007 228143664 /nfs/dbraw/zinc/14/36/64/228143664.db2.gz FRHKATPLFHUVEH-NXHRZFHOSA-N 1 3 298.430 3.704 20 0 CHADHO Cc1oc2ccccc2c1C[NH2+][C@@H]1CCN(C)[C@H]2CCC[C@@H]21 ZINC000353679007 228143665 /nfs/dbraw/zinc/14/36/65/228143665.db2.gz FRHKATPLFHUVEH-NXHRZFHOSA-N 1 3 298.430 3.704 20 0 CHADHO CCC[C@@H](C)[N@H+](C)CCC1CCN(c2ccncc2)CC1 ZINC000187723882 260167022 /nfs/dbraw/zinc/16/70/22/260167022.db2.gz RYMDOEQSAZBUMR-MRXNPFEDSA-N 1 3 289.467 3.809 20 0 CHADHO CCC[C@@H](C)[N@@H+](C)CCC1CCN(c2ccncc2)CC1 ZINC000187723882 260167024 /nfs/dbraw/zinc/16/70/24/260167024.db2.gz RYMDOEQSAZBUMR-MRXNPFEDSA-N 1 3 289.467 3.809 20 0 CHADHO C[C@@H]1CCC[C@H](C[NH2+]C2CCN(C(C)(C)C)CC2)C1 ZINC000089608409 260190109 /nfs/dbraw/zinc/19/01/09/260190109.db2.gz SQIDHMBLBXWCFR-CABCVRRESA-N 1 3 266.473 3.665 20 0 CHADHO CCN(CC)CCC[NH2+][C@H](C)Cc1ccc(Cl)cc1 ZINC000223011774 260257761 /nfs/dbraw/zinc/25/77/61/260257761.db2.gz HWYKTMRWQWNIRD-CQSZACIVSA-N 1 3 282.859 3.593 20 0 CHADHO CC[NH+](CC)CCCN[C@H](C)Cc1ccc(Cl)cc1 ZINC000223011774 260257762 /nfs/dbraw/zinc/25/77/62/260257762.db2.gz HWYKTMRWQWNIRD-CQSZACIVSA-N 1 3 282.859 3.593 20 0 CHADHO CC[C@@H]([NH2+]C1CCN(C2CCCC2)CC1)C1CCC1 ZINC000449180911 260282312 /nfs/dbraw/zinc/28/23/12/260282312.db2.gz CXICJFNYVRIGDW-QGZVFWFLSA-N 1 3 264.457 3.562 20 0 CHADHO CC(C)c1ccc(CN[C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000093453003 260286074 /nfs/dbraw/zinc/28/60/74/260286074.db2.gz QGITZKOZNBXKOV-GBESFXJTSA-N 1 3 286.463 3.820 20 0 CHADHO CO[C@@H](C)[C@H](C)NC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449272291 260337282 /nfs/dbraw/zinc/33/72/82/260337282.db2.gz VNXOQSAKAAWGON-GJZGRUSLSA-N 1 3 298.515 3.679 20 0 CHADHO C[C@@H](N[C@@H]1CCC[NH2+]CC1)c1cccc2ccccc21 ZINC000133580131 260522227 /nfs/dbraw/zinc/52/22/27/260522227.db2.gz NMVUHZHQIPSGTL-GDBMZVCRSA-N 1 3 268.404 3.633 20 0 CHADHO CC[C@@H](c1ccc(F)cc1)N(C)C[C@@H]1CCC[N@H+](C)C1 ZINC000152467652 261064456 /nfs/dbraw/zinc/06/44/56/261064456.db2.gz RBDBHVOXEIJBHP-PBHICJAKSA-N 1 3 278.415 3.550 20 0 CHADHO CC[C@@H](c1ccc(F)cc1)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000152467652 261064458 /nfs/dbraw/zinc/06/44/58/261064458.db2.gz RBDBHVOXEIJBHP-PBHICJAKSA-N 1 3 278.415 3.550 20 0 CHADHO CCCCN1CCC([NH2+][C@@H](C)c2sccc2OC)CC1 ZINC000186136175 262081149 /nfs/dbraw/zinc/08/11/49/262081149.db2.gz SQDFTNWYESUZNG-ZDUSSCGKSA-N 1 3 296.480 3.672 20 0 CHADHO CCC[NH2+][C@@H]1CCCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000514085701 262160070 /nfs/dbraw/zinc/16/00/70/262160070.db2.gz WQXFPZSTEQYWJL-IPMKNSEASA-N 1 3 286.463 3.677 20 0 CHADHO CC(C)=CCN[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000188443857 262296629 /nfs/dbraw/zinc/29/66/29/262296629.db2.gz FAPVVGIBZKFGJF-WMZOPIPTSA-N 1 3 272.436 3.595 20 0 CHADHO CC(C)=CCN[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000188443857 262296631 /nfs/dbraw/zinc/29/66/31/262296631.db2.gz FAPVVGIBZKFGJF-WMZOPIPTSA-N 1 3 272.436 3.595 20 0 CHADHO CC[C@H](N[C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000221934232 262328484 /nfs/dbraw/zinc/32/84/84/262328484.db2.gz OKKDMGPFEUHTQZ-RCBQFDQVSA-N 1 3 280.843 3.863 20 0 CHADHO CC[C@H](N[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000221934232 262328485 /nfs/dbraw/zinc/32/84/85/262328485.db2.gz OKKDMGPFEUHTQZ-RCBQFDQVSA-N 1 3 280.843 3.863 20 0 CHADHO CC1CCN(CCC[NH2+][C@H]2CCCc3sccc32)CC1 ZINC000061325291 262394281 /nfs/dbraw/zinc/39/42/81/262394281.db2.gz FJHBOPQHCZDIOY-INIZCTEOSA-N 1 3 292.492 3.837 20 0 CHADHO C[C@@H]([NH2+]CC1CCN(Cc2cccs2)CC1)[C@H]1C[C@H]1C ZINC000414085153 262802766 /nfs/dbraw/zinc/80/27/66/262802766.db2.gz XZSKNTOWAWUNNB-CPUCHLNUSA-N 1 3 292.492 3.594 20 0 CHADHO C[C@H]1C[C@@H](CN)C[N@@H+]1CC1CCC(c2ccccc2)CC1 ZINC000414661611 263023794 /nfs/dbraw/zinc/02/37/94/263023794.db2.gz OXVFWZMKFASTBX-WPZCVXBKSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@H]1C[C@@H](CN)C[N@H+]1CC1CCC(c2ccccc2)CC1 ZINC000414661611 263023795 /nfs/dbraw/zinc/02/37/95/263023795.db2.gz OXVFWZMKFASTBX-WPZCVXBKSA-N 1 3 286.463 3.630 20 0 CHADHO CNC[C@H]1CC[N@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC000414662995 263024211 /nfs/dbraw/zinc/02/42/11/263024211.db2.gz AHDYKCFXCFBBTR-TVRKMHQQSA-N 1 3 286.463 3.502 20 0 CHADHO CNC[C@H]1CC[N@@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC000414662995 263024212 /nfs/dbraw/zinc/02/42/12/263024212.db2.gz AHDYKCFXCFBBTR-TVRKMHQQSA-N 1 3 286.463 3.502 20 0 CHADHO CCN(Cc1ccc(Cl)c(C)c1)[C@H]1CCC[NH2+]CC1 ZINC000414714716 263034020 /nfs/dbraw/zinc/03/40/20/263034020.db2.gz MGGULZYMDALRMN-HNNXBMFYSA-N 1 3 280.843 3.612 20 0 CHADHO [NH3+]C[C@@H]1CCCC[C@H]1NCc1cc2ccccc2s1 ZINC000414795721 263050180 /nfs/dbraw/zinc/05/01/80/263050180.db2.gz HACJDQFFWKPUSF-DZGCQCFKSA-N 1 3 274.433 3.508 20 0 CHADHO NC[C@@H]1CCCC[C@H]1[NH2+]Cc1cc2ccccc2s1 ZINC000414795721 263050181 /nfs/dbraw/zinc/05/01/81/263050181.db2.gz HACJDQFFWKPUSF-DZGCQCFKSA-N 1 3 274.433 3.508 20 0 CHADHO CC(C)C[C@H](Cc1cccc(Cl)c1)NCC(C)(C)[NH3+] ZINC000414797437 263050557 /nfs/dbraw/zinc/05/05/57/263050557.db2.gz DDOYCAUDKIZKCT-OAHLLOKOSA-N 1 3 282.859 3.624 20 0 CHADHO CCC[C@H](Cc1ccccc1)NCC([NH3+])(CC)CC ZINC000414815446 263053939 /nfs/dbraw/zinc/05/39/39/263053939.db2.gz XPUNHYICRAIILD-MRXNPFEDSA-N 1 3 262.441 3.505 20 0 CHADHO Cc1ccc(CNCc2ccc([C@H](C)[NH3+])cc2)cc1Cl ZINC000414817020 263054346 /nfs/dbraw/zinc/05/43/46/263054346.db2.gz RLGVEDVDULZFDR-ZDUSSCGKSA-N 1 3 288.822 3.958 20 0 CHADHO CC[C@H](Cc1ccc(Cl)cc1Cl)NCC[C@H](C)[NH3+] ZINC000414823056 263055472 /nfs/dbraw/zinc/05/54/72/263055472.db2.gz ODAMGUWEEHEYDC-GXFFZTMASA-N 1 3 289.250 3.641 20 0 CHADHO CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+]CC[C@H](C)N ZINC000414823056 263055473 /nfs/dbraw/zinc/05/54/73/263055473.db2.gz ODAMGUWEEHEYDC-GXFFZTMASA-N 1 3 289.250 3.641 20 0 CHADHO C[C@@H](C[NH3+])CNCc1ccc(-c2ccccc2Cl)s1 ZINC000414879604 263094847 /nfs/dbraw/zinc/09/48/47/263094847.db2.gz PYYHEGGDQAWUHO-NSHDSACASA-N 1 3 294.851 3.753 20 0 CHADHO CCC[C@@H](C[NH2+]C[C@@]1(C)CCCNC1)c1ccccc1 ZINC000414903800 263111347 /nfs/dbraw/zinc/11/13/47/263111347.db2.gz MFLAODPAZXKJMM-ROUUACIJSA-N 1 3 274.452 3.550 20 0 CHADHO [NH3+][C@H]1CCC[C@H](CNCc2cccc(Cl)c2Cl)C1 ZINC000414985936 263183076 /nfs/dbraw/zinc/18/30/76/263183076.db2.gz BWJQMCXDPQAUIH-JQWIXIFHSA-N 1 3 287.234 3.601 20 0 CHADHO [NH3+][C@H]1CCC[C@H](CNCc2ccc(Cl)cc2Cl)C1 ZINC000414992500 263188867 /nfs/dbraw/zinc/18/88/67/263188867.db2.gz KORQASDGHBJVRG-GWCFXTLKSA-N 1 3 287.234 3.601 20 0 CHADHO CCn1c2ccccc2c2cc(C[NH2+][C@@H](C)[C@H](C)N)ccc21 ZINC000415006637 263218809 /nfs/dbraw/zinc/21/88/09/263218809.db2.gz KUFHYLQQAPKPCE-KBPBESRZSA-N 1 3 295.430 3.640 20 0 CHADHO C[C@H](N[C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccccc1 ZINC000415078719 263268051 /nfs/dbraw/zinc/26/80/51/263268051.db2.gz GVLNCSFTFZLYJS-IPELMVKDSA-N 1 3 280.415 3.831 20 0 CHADHO C[C@H](N[C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccccc1 ZINC000415078727 263268309 /nfs/dbraw/zinc/26/83/09/263268309.db2.gz GVLNCSFTFZLYJS-ZYSHUDEJSA-N 1 3 280.415 3.831 20 0 CHADHO Cc1cccc([C@@H](NC[C@H]2CCC[NH2+]C2)C(C)(C)C)c1 ZINC000415086905 263271262 /nfs/dbraw/zinc/27/12/62/263271262.db2.gz VHRVVASSLIQBKB-DOTOQJQBSA-N 1 3 274.452 3.671 20 0 CHADHO Cc1cccc([C@@H]([NH2+]C[C@H]2CCCNC2)C(C)(C)C)c1 ZINC000415086905 263271264 /nfs/dbraw/zinc/27/12/64/263271264.db2.gz VHRVVASSLIQBKB-DOTOQJQBSA-N 1 3 274.452 3.671 20 0 CHADHO C[C@H](C[C@@H]1CCC[NH2+]1)NCCc1csc2ccccc12 ZINC000415090735 263272561 /nfs/dbraw/zinc/27/25/61/263272561.db2.gz ZKPHAYJELKZCKO-HIFRSBDPSA-N 1 3 288.460 3.564 20 0 CHADHO CCSc1ccc([C@H](C)[NH2+]C[C@H](C)CN(C)C)cc1 ZINC000425932502 263915030 /nfs/dbraw/zinc/91/50/30/263915030.db2.gz QKTOJQWQZNNOSR-KBPBESRZSA-N 1 3 280.481 3.647 20 0 CHADHO CC[NH+](CC)Cc1ccccc1CN[C@H]1CC[C@@H]1SC ZINC000425359362 264140762 /nfs/dbraw/zinc/14/07/62/264140762.db2.gz PSTROJXOLSFHQS-IRXDYDNUSA-N 1 3 292.492 3.512 20 0 CHADHO CC[C@@H](N[C@@H]1CCC[NH2+]CC1)c1cccc(Cl)c1 ZINC000128965614 264313122 /nfs/dbraw/zinc/31/31/22/264313122.db2.gz ZLIRQICGGLWRHV-HUUCEWRRSA-N 1 3 266.816 3.523 20 0 CHADHO CCCc1cccc(CN2CCC[C@H]3C[N@H+](C)CC[C@@H]32)c1 ZINC000518837994 265122332 /nfs/dbraw/zinc/12/23/32/265122332.db2.gz GPHVFNSDAQVLRX-OALUTQOASA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1cccc(CN2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)c1 ZINC000518837994 265122333 /nfs/dbraw/zinc/12/23/33/265122333.db2.gz GPHVFNSDAQVLRX-OALUTQOASA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1cccc(C[N@@H+]2CCC[C@H]3CN(C)CC[C@@H]32)c1 ZINC000518837994 265122335 /nfs/dbraw/zinc/12/23/35/265122335.db2.gz GPHVFNSDAQVLRX-OALUTQOASA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1cccc(C[N@H+]2CCC[C@H]3CN(C)CC[C@@H]32)c1 ZINC000518837994 265122336 /nfs/dbraw/zinc/12/23/36/265122336.db2.gz GPHVFNSDAQVLRX-OALUTQOASA-N 1 3 286.463 3.555 20 0 CHADHO CCN1CC[C@@H]([N@H+](C)Cc2ccc(SC)s2)C[C@@H]1C ZINC000356130770 266056524 /nfs/dbraw/zinc/05/65/24/266056524.db2.gz DYGTUPBKBGXNRM-QWHCGFSZSA-N 1 3 298.521 3.775 20 0 CHADHO CCN1CC[C@@H]([N@@H+](C)Cc2ccc(SC)s2)C[C@@H]1C ZINC000356130770 266056527 /nfs/dbraw/zinc/05/65/27/266056527.db2.gz DYGTUPBKBGXNRM-QWHCGFSZSA-N 1 3 298.521 3.775 20 0 CHADHO CC[C@@H](NCC[C@@H]1CCCC[N@@H+]1C)c1ccc(C)cc1 ZINC000356818652 266179634 /nfs/dbraw/zinc/17/96/34/266179634.db2.gz WLKQQXMKSDSMRC-ZWKOTPCHSA-N 1 3 274.452 3.910 20 0 CHADHO CC[C@@H](NCC[C@@H]1CCCC[N@H+]1C)c1ccc(C)cc1 ZINC000356818652 266179637 /nfs/dbraw/zinc/17/96/37/266179637.db2.gz WLKQQXMKSDSMRC-ZWKOTPCHSA-N 1 3 274.452 3.910 20 0 CHADHO CC[C@H]([NH2+]CC(C)(C)CN(C)C)c1cc(C)ccc1OC ZINC000357800287 266366157 /nfs/dbraw/zinc/36/61/57/266366157.db2.gz VEVVMBCBVFRHKK-INIZCTEOSA-N 1 3 292.467 3.632 20 0 CHADHO CC[C@@H]([NH2+]CC(C)(C)CN(C)C)c1cc(C)ccc1OC ZINC000357800296 266366399 /nfs/dbraw/zinc/36/63/99/266366399.db2.gz VEVVMBCBVFRHKK-MRXNPFEDSA-N 1 3 292.467 3.632 20 0 CHADHO c1ccc([C@@H]2CC[C@H]([NH2+][C@H]3CCN4CCC[C@H]4C3)C2)cc1 ZINC000374481486 267794286 /nfs/dbraw/zinc/79/42/86/267794286.db2.gz NBGCQYJOAMOBMY-XWSJACJDSA-N 1 3 284.447 3.539 20 0 CHADHO c1ccc([C@@H]2CC[C@H](N[C@H]3CC[N@@H+]4CCC[C@H]4C3)C2)cc1 ZINC000374481486 267794289 /nfs/dbraw/zinc/79/42/89/267794289.db2.gz NBGCQYJOAMOBMY-XWSJACJDSA-N 1 3 284.447 3.539 20 0 CHADHO c1ccc([C@@H]2CC[C@H](N[C@H]3CC[N@H+]4CCC[C@H]4C3)C2)cc1 ZINC000374481486 267794291 /nfs/dbraw/zinc/79/42/91/267794291.db2.gz NBGCQYJOAMOBMY-XWSJACJDSA-N 1 3 284.447 3.539 20 0 CHADHO CC1(CC[NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000377074199 268045311 /nfs/dbraw/zinc/04/53/11/268045311.db2.gz RNRFSMHDCZCJJB-UHFFFAOYSA-N 1 3 264.457 3.563 20 0 CHADHO CCC[NH+]1CCC(N[C@H](C)c2ccc(CC)s2)CC1 ZINC000041203144 328030091 /nfs/dbraw/zinc/03/00/91/328030091.db2.gz GRUATQAODUSWIH-CYBMUJFWSA-N 1 3 280.481 3.836 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1NCc1cc2ccccc2s1 ZINC000268796423 328186168 /nfs/dbraw/zinc/18/61/68/328186168.db2.gz IKZLYWXIZNZKEZ-WWGRRREGSA-N 1 3 288.460 3.720 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1NCc1cc2ccccc2s1 ZINC000268796423 328186170 /nfs/dbraw/zinc/18/61/70/328186170.db2.gz IKZLYWXIZNZKEZ-WWGRRREGSA-N 1 3 288.460 3.720 20 0 CHADHO C[C@@H]1C[N@H+](CC2CCC(c3ccccc3)CC2)CC[C@H]1N ZINC000414652041 328208314 /nfs/dbraw/zinc/20/83/14/328208314.db2.gz CYLLPXKSRWQUTH-JVGQSUMCSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@@H]1C[N@@H+](CC2CCC(c3ccccc3)CC2)CC[C@H]1N ZINC000414652041 328208316 /nfs/dbraw/zinc/20/83/16/328208316.db2.gz CYLLPXKSRWQUTH-JVGQSUMCSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@@H]1CN(CC2CCC(c3ccccc3)CC2)CC[C@H]1[NH3+] ZINC000414652041 328208318 /nfs/dbraw/zinc/20/83/18/328208318.db2.gz CYLLPXKSRWQUTH-JVGQSUMCSA-N 1 3 286.463 3.630 20 0 CHADHO CC(C)[C@H]([NH3+])CN[C@H]1CCC[C@H]1c1ccccc1Cl ZINC000414789136 328225717 /nfs/dbraw/zinc/22/57/17/328225717.db2.gz FBKWTFCMBGRBPM-IMJJTQAJSA-N 1 3 280.843 3.549 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000414794247 328229134 /nfs/dbraw/zinc/22/91/34/328229134.db2.gz FMZNOHHLRNATFA-OKYOBFRVSA-N 1 3 286.463 3.505 20 0 CHADHO C[C@H]([NH2+]CC1(CN(C)C)CCCC1)c1ccsc1 ZINC000183952147 329254892 /nfs/dbraw/zinc/25/48/92/329254892.db2.gz YUWQYDBBHYHIMY-ZDUSSCGKSA-N 1 3 266.454 3.521 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000414946065 328279086 /nfs/dbraw/zinc/27/90/86/328279086.db2.gz SJSOQGHUOAGXIL-VZEFYGNVSA-N 1 3 292.854 3.564 20 0 CHADHO CC[C@@H](C)[NH2+]CC1CCN(Cc2ccccc2Cl)CC1 ZINC000531975323 328363870 /nfs/dbraw/zinc/36/38/70/328363870.db2.gz RZBQLLNDJQXLOD-CQSZACIVSA-N 1 3 294.870 3.940 20 0 CHADHO C[C@@H]1C[C@@H](N[C@@H]2CCCc3ccc(Cl)cc32)CC[N@@H+]1C ZINC000534972174 328372400 /nfs/dbraw/zinc/37/24/00/328372400.db2.gz LIZKAWCPXGJDBL-ISTRZQFTSA-N 1 3 292.854 3.790 20 0 CHADHO C[C@@H]1C[C@@H](N[C@@H]2CCCc3ccc(Cl)cc32)CC[N@H+]1C ZINC000534972174 328372401 /nfs/dbraw/zinc/37/24/01/328372401.db2.gz LIZKAWCPXGJDBL-ISTRZQFTSA-N 1 3 292.854 3.790 20 0 CHADHO C[C@@H]([NH2+]CC[C@@H]1CCCCN1C)c1cccc(Cl)c1 ZINC000049856215 328380417 /nfs/dbraw/zinc/38/04/17/328380417.db2.gz CXKZMWZXURBDKU-CJNGLKHVSA-N 1 3 280.843 3.865 20 0 CHADHO CCCC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000558419118 327092622 /nfs/dbraw/zinc/09/26/22/327092622.db2.gz IAYGWNXIBULGGZ-GVDBMIGSSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)CC(C)(C)C[NH3+] ZINC000093872948 327145793 /nfs/dbraw/zinc/14/57/93/327145793.db2.gz LOGWMIUDRHCOTL-NSHDSACASA-N 1 3 288.357 3.683 20 0 CHADHO C[C@@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)CC(C)(C)CN ZINC000093872948 327145794 /nfs/dbraw/zinc/14/57/94/327145794.db2.gz LOGWMIUDRHCOTL-NSHDSACASA-N 1 3 288.357 3.683 20 0 CHADHO C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)CC(C)(C)CN ZINC000093872948 327145797 /nfs/dbraw/zinc/14/57/97/327145797.db2.gz LOGWMIUDRHCOTL-NSHDSACASA-N 1 3 288.357 3.683 20 0 CHADHO CCN1CCC[C@H](C[NH2+]Cc2ccc(C3CCC3)cc2)C1 ZINC000559259461 327151322 /nfs/dbraw/zinc/15/13/22/327151322.db2.gz YNUMLLCOCLRQFP-QGZVFWFLSA-N 1 3 286.463 3.776 20 0 CHADHO FC(F)c1cccc(CN2CCC([C@@H]3CCC[NH2+]3)CC2)c1 ZINC000131981785 327166789 /nfs/dbraw/zinc/16/67/89/327166789.db2.gz DFDNNWZGHLYIMW-INIZCTEOSA-N 1 3 294.389 3.588 20 0 CHADHO CCCN1CCC([N@H+](C)Cc2ccc(F)c(Cl)c2)CC1 ZINC000092165470 327187243 /nfs/dbraw/zinc/18/72/43/327187243.db2.gz NQGWQQNQKQMNOW-UHFFFAOYSA-N 1 3 298.833 3.785 20 0 CHADHO CCCN1CCC([N@@H+](C)Cc2ccc(F)c(Cl)c2)CC1 ZINC000092165470 327187244 /nfs/dbraw/zinc/18/72/44/327187244.db2.gz NQGWQQNQKQMNOW-UHFFFAOYSA-N 1 3 298.833 3.785 20 0 CHADHO CC(C)C[C@@H](C)C[NH2+]C[C@H]1CCCN(CC(C)C)C1 ZINC000584258735 327202628 /nfs/dbraw/zinc/20/26/28/327202628.db2.gz FUMCIRSWFPGIAX-IAGOWNOFSA-N 1 3 268.489 3.626 20 0 CHADHO CC(C)(C)N1CCC([NH2+]C[C@@H]2CCCC2(C)C)CC1 ZINC000559919853 327271702 /nfs/dbraw/zinc/27/17/02/327271702.db2.gz QAJCWGAWBKGZSD-AWEZNQCLSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@@H](c1ccc2ccccc2c1)N1CC[C@]2(CC[NH2+]C2)C1 ZINC000261807951 327353005 /nfs/dbraw/zinc/35/30/05/327353005.db2.gz ZKODUUBDZUYHMX-KXBFYZLASA-N 1 3 280.415 3.586 20 0 CHADHO C[C@@H]1CCC[C@H](N[C@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC000261573617 327384930 /nfs/dbraw/zinc/38/49/30/327384930.db2.gz VTMIVTFQRSATCS-GFOFROLCSA-N 1 3 258.409 3.690 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@H](c2ccccc2)C1)[C@@H]1CCCNC1 ZINC000582600293 329113943 /nfs/dbraw/zinc/11/39/43/329113943.db2.gz OMVWTSBWRDODDV-GDAAHCPNSA-N 1 3 286.463 3.691 20 0 CHADHO C[C@@H](NC1CCC([NH3+])CC1)c1cc(Cl)sc1Cl ZINC000235182302 329436381 /nfs/dbraw/zinc/43/63/81/329436381.db2.gz UNDOUOXDUFEMRI-AFPNSQJFSA-N 1 3 293.263 3.975 20 0 CHADHO C[C@@H](NCC[C@H]1CC[NH2+]C1)c1ccc(Cl)cc1Cl ZINC000420364419 329762037 /nfs/dbraw/zinc/76/20/37/329762037.db2.gz CVUSBCULXZZLFX-GHMZBOCLSA-N 1 3 287.234 3.644 20 0 CHADHO C[C@@H](NCC[C@@H]1CC[NH2+]C1)c1ccc(Cl)cc1Cl ZINC000420364421 329762318 /nfs/dbraw/zinc/76/23/18/329762318.db2.gz CVUSBCULXZZLFX-MNOVXSKESA-N 1 3 287.234 3.644 20 0 CHADHO CCN(C)C[C@H]1CC[N@@H+]([C@H](C)c2ccc3c(c2)CCC3)C1 ZINC000445403228 330110915 /nfs/dbraw/zinc/11/09/15/330110915.db2.gz MNPHHXDUKMVVEZ-HZPDHXFCSA-N 1 3 286.463 3.510 20 0 CHADHO CCN(C)C[C@H]1CC[N@H+]([C@H](C)c2ccc3c(c2)CCC3)C1 ZINC000445403228 330110916 /nfs/dbraw/zinc/11/09/16/330110916.db2.gz MNPHHXDUKMVVEZ-HZPDHXFCSA-N 1 3 286.463 3.510 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@H]1NCC1(c2ccc(Cl)cc2)CC1 ZINC000422704000 330151153 /nfs/dbraw/zinc/15/11/53/330151153.db2.gz OKKCLIDEBKUKMZ-HZPDHXFCSA-N 1 3 292.854 3.621 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H]1CCC[C@H](C(C)C)C1 ZINC000422712560 330151366 /nfs/dbraw/zinc/15/13/66/330151366.db2.gz IOCDNTOOJSOMOT-BPUTZDHNSA-N 1 3 289.467 3.714 20 0 CHADHO Cc1[nH]c2ccc(C[NH2+][C@@H]3CCCCC[C@@H]3N)cc2c1C ZINC000422724780 330152488 /nfs/dbraw/zinc/15/24/88/330152488.db2.gz WOIPYZHCVJLRAH-FUHWJXTLSA-N 1 3 285.435 3.534 20 0 CHADHO N[C@H]1CCCCC[C@H]1[NH2+]Cc1csc2ccccc12 ZINC000422752365 330153459 /nfs/dbraw/zinc/15/34/59/330153459.db2.gz DYARFAJJHVTURQ-LSDHHAIUSA-N 1 3 274.433 3.651 20 0 CHADHO CCCC1CCC([NH2+][C@@H](C)c2ccc(CN)nc2C)CC1 ZINC000422751931 330153467 /nfs/dbraw/zinc/15/34/67/330153467.db2.gz DHRLLDFFCMAOFQ-JEYLPNPQSA-N 1 3 289.467 3.858 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H](C)CCC(C)(C)C ZINC000422749884 330153473 /nfs/dbraw/zinc/15/34/73/330153473.db2.gz BHZYQFRUYOMGIK-STQMWFEESA-N 1 3 277.456 3.714 20 0 CHADHO C[C@@H](N[C@@H](C)c1cccc2ccccc21)[C@H]1CCC[NH2+]C1 ZINC000422769028 330154169 /nfs/dbraw/zinc/15/41/69/330154169.db2.gz UHKDRIYIZCVQJV-VYDXJSESSA-N 1 3 282.431 3.879 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)c1cccc2ccccc21)[C@H]1CCCNC1 ZINC000422769028 330154171 /nfs/dbraw/zinc/15/41/71/330154171.db2.gz UHKDRIYIZCVQJV-VYDXJSESSA-N 1 3 282.431 3.879 20 0 CHADHO C[C@H](CCC[NH3+])N[C@@H](C)c1cc(Cl)ccc1Cl ZINC000422780588 330155013 /nfs/dbraw/zinc/15/50/13/330155013.db2.gz KKOJTZUHKNSGDQ-ZJUUUORDSA-N 1 3 275.223 3.771 20 0 CHADHO CC(C)C[C@H]([NH2+]C1CCNCC1)c1ccc(Cl)cc1 ZINC000422791667 330155241 /nfs/dbraw/zinc/15/52/41/330155241.db2.gz WKKTXLDDNHMNEZ-INIZCTEOSA-N 1 3 280.843 3.769 20 0 CHADHO CC(C)[C@@H](N[C@@H](C)C[C@H](C)[NH3+])c1ccc(Cl)cc1 ZINC000422787897 330155267 /nfs/dbraw/zinc/15/52/67/330155267.db2.gz AKEWWBQHOOUQGZ-SLEUVZQESA-N 1 3 268.832 3.753 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@H](c1ccccc1)C(C)C ZINC000422792779 330155614 /nfs/dbraw/zinc/15/56/14/330155614.db2.gz WLAGRTKTTIONFP-BEFAXECRSA-N 1 3 297.446 3.897 20 0 CHADHO CC(C)[C@@H](N[C@H](C)C1C[NH2+]C1)c1ccc(C(C)(C)C)cc1 ZINC000422793642 330155618 /nfs/dbraw/zinc/15/56/18/330155618.db2.gz XFXJQRIMCIEFID-RDTXWAMCSA-N 1 3 288.479 3.879 20 0 CHADHO CC(C)[C@@H]([NH2+][C@H](C)C1CNC1)c1ccc(C(C)(C)C)cc1 ZINC000422793642 330155619 /nfs/dbraw/zinc/15/56/19/330155619.db2.gz XFXJQRIMCIEFID-RDTXWAMCSA-N 1 3 288.479 3.879 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCc1ccc(OC2CCCCC2)cc1 ZINC000422847413 330157604 /nfs/dbraw/zinc/15/76/04/330157604.db2.gz ICZUTDGZVMGLQA-LSDHHAIUSA-N 1 3 290.451 3.614 20 0 CHADHO C[C@H](CCC[NH3+])N[C@H](c1ccccc1)c1cccc(F)c1 ZINC000422873311 330158624 /nfs/dbraw/zinc/15/86/24/330158624.db2.gz KZECMQNLYUMCGO-RDTXWAMCSA-N 1 3 286.394 3.632 20 0 CHADHO C[C@@H](CCC[NH3+])N[C@@H](c1ccccc1)c1cccc(F)c1 ZINC000422873310 330158638 /nfs/dbraw/zinc/15/86/38/330158638.db2.gz KZECMQNLYUMCGO-KSSFIOAISA-N 1 3 286.394 3.632 20 0 CHADHO NC[C@@H]1CCC[C@@H]1[NH2+]CCc1cccc(-c2ccccc2)c1 ZINC000422887932 330159271 /nfs/dbraw/zinc/15/92/71/330159271.db2.gz LSRAMLLUBDQCPU-PMACEKPBSA-N 1 3 294.442 3.613 20 0 CHADHO [NH3+][C@@H]1C[C@@H](N[C@H](Cc2ccccc2)C2CC2)c2ccccc21 ZINC000422914707 330160240 /nfs/dbraw/zinc/16/02/40/330160240.db2.gz VOVLXUFSVDZBOG-VAMGGRTRSA-N 1 3 292.426 3.742 20 0 CHADHO C[C@@H]1C[C@@H]1[C@H]([NH2+][C@@H]1CCC[C@@H]1N)c1ccc(Cl)cc1 ZINC000422926813 330160962 /nfs/dbraw/zinc/16/09/62/330160962.db2.gz XOCZDNWHGHARLZ-NVAJDRRBSA-N 1 3 278.827 3.507 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)C[C@H](C)N)C(c1ccccc1)c1ccccc1 ZINC000422934098 330161260 /nfs/dbraw/zinc/16/12/60/330161260.db2.gz FHGUYWWUKMLJBN-YESZJQIVSA-N 1 3 296.458 3.922 20 0 CHADHO CC1(C)CC[C@@H](N[C@H]2CCC[NH2+]CC2)c2ccccc21 ZINC000422943125 330161696 /nfs/dbraw/zinc/16/16/96/330161696.db2.gz KEHMYEACOWTSET-WMLDXEAASA-N 1 3 272.436 3.531 20 0 CHADHO CCC(CC)[C@H](N[C@H](C)C[C@@H](C)[NH3+])c1cccs1 ZINC000422944483 330162083 /nfs/dbraw/zinc/16/20/83/330162083.db2.gz ZUGAVZHURLPDOT-JMSVASOKSA-N 1 3 268.470 3.941 20 0 CHADHO c1ccc([C@H](CC2CCC2)NC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000423041321 330166882 /nfs/dbraw/zinc/16/68/82/330166882.db2.gz ISFMEOFNQUROHY-SWDXFRIISA-N 1 3 284.447 3.791 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]CC1(Cc2ccccc2)CCCC1 ZINC000423044256 330166901 /nfs/dbraw/zinc/16/69/01/330166901.db2.gz QTWVBJDHSHZBGZ-HOTGVXAUSA-N 1 3 274.452 3.505 20 0 CHADHO CC(C)[C@@H]1CCc2ccccc2[C@@H]1N[C@H](C)[C@@H]1CC[NH2+]C1 ZINC000423049266 330167000 /nfs/dbraw/zinc/16/70/00/330167000.db2.gz JSUHHASWYQRQFO-VYCZESIESA-N 1 3 286.463 3.534 20 0 CHADHO Cc1oc2ccccc2c1CCN[C@@H]1CCCCC[C@@H]1[NH3+] ZINC000423052941 330167309 /nfs/dbraw/zinc/16/73/09/330167309.db2.gz RMGRLLFKPBLXQR-DLBZAZTESA-N 1 3 286.419 3.533 20 0 CHADHO CC(C)c1ccc2c(c1)[C@@H](N[C@H](C)C[C@H](C)[NH3+])CC2 ZINC000423065858 330168249 /nfs/dbraw/zinc/16/82/49/330168249.db2.gz VJJBNOLNNDIVDF-AHIWAGSCSA-N 1 3 260.425 3.513 20 0 CHADHO C[C@@H]1CCNCC[C@@H]1[NH2+][C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC000423069862 330168323 /nfs/dbraw/zinc/16/83/23/330168323.db2.gz FDNFZEZMJKKEPH-OWYHZJEWSA-N 1 3 286.463 3.691 20 0 CHADHO C1CC12CCC([NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCCN1)CC2 ZINC000423077065 330168477 /nfs/dbraw/zinc/16/84/77/330168477.db2.gz SHAZDHXTVDUMLW-BRWVUGGUSA-N 1 3 276.468 3.610 20 0 CHADHO c1cc(C2CC2)ccc1CN[C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000423072776 330168514 /nfs/dbraw/zinc/16/85/14/330168514.db2.gz JUZJHQCWKIJSAB-CEXWTWQISA-N 1 3 284.447 3.574 20 0 CHADHO Cc1ccc([C@H](N[C@@H](C)CCCC[NH3+])c2ccccn2)cc1 ZINC000423082597 330168903 /nfs/dbraw/zinc/16/89/03/330168903.db2.gz DNMLDOQYLBSFAQ-LPHOPBHVSA-N 1 3 297.446 3.587 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NCC2CC(c3ccccc3)C2)c2ccccc21 ZINC000423107182 330170637 /nfs/dbraw/zinc/17/06/37/330170637.db2.gz DQFDCCOOXNPNHH-VAZMBZEVSA-N 1 3 292.426 3.915 20 0 CHADHO C[C@@H](N[C@@H](C)c1ccc(F)c2ccccc21)[C@@H]1CC[NH2+]C1 ZINC000423123681 330171317 /nfs/dbraw/zinc/17/13/17/330171317.db2.gz LOLJCFCTIQFQIE-HZSPNIEDSA-N 1 3 286.394 3.628 20 0 CHADHO [NH3+][C@H]1C[C@@H](NC[C@@H]2C[C@H]2c2ccccc2)c2ccccc21 ZINC000423127991 330171545 /nfs/dbraw/zinc/17/15/45/330171545.db2.gz CTGYCMXSMAKNAX-UDTPNQRGSA-N 1 3 278.399 3.525 20 0 CHADHO C[C@@]1(CN[C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)C[C@H]1c1ccccc1 ZINC000423133876 330172181 /nfs/dbraw/zinc/17/21/81/330172181.db2.gz LFQYVFVNRLJPIX-CXQPBAHBSA-N 1 3 298.474 3.691 20 0 CHADHO C[C@H](N[C@@H](C)[C@H]1CCC[NH2+]C1)c1cccc(C2CC2)c1 ZINC000423143147 330172545 /nfs/dbraw/zinc/17/25/45/330172545.db2.gz CLXYQJSJSOYTMV-DEYYWGMASA-N 1 3 272.436 3.603 20 0 CHADHO c1ccc([C@H]2CCCC[C@H]2CNC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000423153593 330173118 /nfs/dbraw/zinc/17/31/18/330173118.db2.gz HZNODBMRWLHLGL-XEOGZFBHSA-N 1 3 298.474 3.833 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@H](c1ccc(F)c(Cl)c1)C1CC1 ZINC000423153449 330173183 /nfs/dbraw/zinc/17/31/83/330173183.db2.gz GNSOWCPLJIQVTQ-YHAQOWFVSA-N 1 3 284.806 3.646 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C[C@H]1CCCC(C)(C)C1 ZINC000423165677 330173874 /nfs/dbraw/zinc/17/38/74/330173874.db2.gz QBLFUPDPNRBDTC-HIFRSBDPSA-N 1 3 289.467 3.716 20 0 CHADHO CCC[C@H]([NH2+][C@H](C)c1ccc(CN)nc1C)C1CCCC1 ZINC000423169034 330174224 /nfs/dbraw/zinc/17/42/24/330174224.db2.gz IPTOQCNYSFKCQU-KDOFPFPSSA-N 1 3 289.467 3.858 20 0 CHADHO C[C@@H](NCCC[NH3+])c1ccc(SC2CCCC2)cc1 ZINC000423174395 330174706 /nfs/dbraw/zinc/17/47/06/330174706.db2.gz AOWPQILXMJJDQA-CYBMUJFWSA-N 1 3 278.465 3.721 20 0 CHADHO Clc1ccc([C@@H]2CC[C@@H]([NH2+][C@H]3CCCNCC3)C2)cc1 ZINC000423174187 330174744 /nfs/dbraw/zinc/17/47/44/330174744.db2.gz BOHYGERWNRWDEE-HYVNUMGLSA-N 1 3 292.854 3.708 20 0 CHADHO C[C@@H]([NH2+]C1CCNCC1)c1cccc(-c2ccccc2)c1 ZINC000423175696 330174761 /nfs/dbraw/zinc/17/47/61/330174761.db2.gz ATKNSZNGPRBLKB-OAHLLOKOSA-N 1 3 280.415 3.756 20 0 CHADHO C[C@H](Cc1coc2ccccc12)NCC1([NH3+])CCCCC1 ZINC000423181681 330175387 /nfs/dbraw/zinc/17/53/87/330175387.db2.gz PETBAXSWBNDXFG-CQSZACIVSA-N 1 3 286.419 3.615 20 0 CHADHO NCCC[NH2+][C@@H]1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000423195487 330176288 /nfs/dbraw/zinc/17/62/88/330176288.db2.gz SQQJHGKPVNJSOD-JKSUJKDBSA-N 1 3 280.843 3.695 20 0 CHADHO C[C@H](NC[C@H]1CCC[NH2+]C1)c1cc2ccccc2s1 ZINC000423217454 330178756 /nfs/dbraw/zinc/17/87/56/330178756.db2.gz UFSAIZFZFCULQD-STQMWFEESA-N 1 3 274.433 3.552 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCNC1)c1cc2ccccc2s1 ZINC000423217454 330178758 /nfs/dbraw/zinc/17/87/58/330178758.db2.gz UFSAIZFZFCULQD-STQMWFEESA-N 1 3 274.433 3.552 20 0 CHADHO CC(C)Oc1ccc([C@H](C)NCC[C@H](C)[NH3+])cc1Cl ZINC000423227890 330180507 /nfs/dbraw/zinc/18/05/07/330180507.db2.gz XJYDKKACGZZJBQ-RYUDHWBXSA-N 1 3 284.831 3.515 20 0 CHADHO CC(C)[C@@H](N)C[NH2+][C@@H](C)c1cc2ccccc2s1 ZINC000423262973 330183817 /nfs/dbraw/zinc/18/38/17/330183817.db2.gz ACUMTLDWJZLPRI-AAEUAGOBSA-N 1 3 262.422 3.535 20 0 CHADHO CC(C)C[C@@H](CN)[NH2+][C@@H]1C[C@H](C)Sc2sccc21 ZINC000423271487 330184424 /nfs/dbraw/zinc/18/44/24/330184424.db2.gz XUBAEWPGFOGRMA-GMXVVIOVSA-N 1 3 284.494 3.637 20 0 CHADHO C[C@H]1C[C@H](N[C@H]2CCCC[C@@H]2C[NH3+])c2ccsc2S1 ZINC000423277511 330185124 /nfs/dbraw/zinc/18/51/24/330185124.db2.gz OICFXBWNACDWCG-XCCSTKFXSA-N 1 3 296.505 3.781 20 0 CHADHO C[NH2+]C[C@H](C)CN[C@@H]1CCCc2c3ccccc3sc21 ZINC000423276716 330185138 /nfs/dbraw/zinc/18/51/38/330185138.db2.gz OWLWLMQGZFMGGA-SWLSCSKDSA-N 1 3 288.460 3.724 20 0 CHADHO CC(C)(N)C[NH2+][C@@H](CCc1ccccc1)c1ccccc1 ZINC000423288409 330186027 /nfs/dbraw/zinc/18/60/27/330186027.db2.gz RZUVWNMKEIAQSC-SFHVURJKSA-N 1 3 282.431 3.687 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@H]2c3ccccc3C[C@@H]2C)cc1 ZINC000423289886 330186634 /nfs/dbraw/zinc/18/66/34/330186634.db2.gz BWGSVFWXVDWCGK-CKFHNAJUSA-N 1 3 280.415 3.729 20 0 CHADHO Cc1nc(C)c([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)s1 ZINC000423292840 330187596 /nfs/dbraw/zinc/18/75/96/330187596.db2.gz ORATZSGWEYHZOP-QWRGUYRKSA-N 1 3 289.448 3.630 20 0 CHADHO COc1cccc([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000423292771 330187815 /nfs/dbraw/zinc/18/78/15/330187815.db2.gz OJFFOAAZTVYKFG-KBPBESRZSA-N 1 3 284.403 3.566 20 0 CHADHO CCC([NH3+])(CC)CN[C@@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000423293525 330188051 /nfs/dbraw/zinc/18/80/51/330188051.db2.gz RPROMUGPLCMDNO-HZPDHXFCSA-N 1 3 289.467 3.523 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H]2CCc3ccc(F)cc32)cc1 ZINC000423293810 330188070 /nfs/dbraw/zinc/18/80/70/330188070.db2.gz SCHGVZCEXGJJFH-XIKOKIGWSA-N 1 3 284.378 3.623 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2CCCc3ccc(O)cc32)cc1 ZINC000423295169 330188333 /nfs/dbraw/zinc/18/83/33/330188333.db2.gz WHDIJLGFUAVOIL-ORAYPTAESA-N 1 3 296.414 3.579 20 0 CHADHO CCCC[C@@H](CN)[NH2+][C@H](C)c1cc2ccccc2o1 ZINC000423297982 330188783 /nfs/dbraw/zinc/18/87/83/330188783.db2.gz MQADDLXJPRUWDM-OCCSQVGLSA-N 1 3 260.381 3.601 20 0 CHADHO COc1ccccc1-c1ccc([C@@H](C)NC[C@H](C)C[NH3+])cc1 ZINC000423302558 330188967 /nfs/dbraw/zinc/18/89/67/330188967.db2.gz VRRMRUMTLBJTBT-HUUCEWRRSA-N 1 3 298.430 3.608 20 0 CHADHO C[C@@H](C[NH3+])CN[C@@H](C)c1ccc(-c2ccccc2)s1 ZINC000423302659 330189112 /nfs/dbraw/zinc/18/91/12/330189112.db2.gz HQWRJLNPLCOLBO-STQMWFEESA-N 1 3 274.433 3.661 20 0 CHADHO C[C@@H]1CC[C@H](NC[C@@]2(C)CCC[NH2+]C2)c2sccc21 ZINC000423350147 330192728 /nfs/dbraw/zinc/19/27/28/330192728.db2.gz XBJVYHUUTURBNA-INWMFGNUSA-N 1 3 278.465 3.666 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]C[C@@]2(C)CCCNC2)c2sccc21 ZINC000423350147 330192729 /nfs/dbraw/zinc/19/27/29/330192729.db2.gz XBJVYHUUTURBNA-INWMFGNUSA-N 1 3 278.465 3.666 20 0 CHADHO C[C@@H](NC[C@]1(C)CCC[NH2+]C1)c1cc2ccccc2s1 ZINC000423351347 330192873 /nfs/dbraw/zinc/19/28/73/330192873.db2.gz YWPTVKPJFNEULI-CXAGYDPISA-N 1 3 288.460 3.942 20 0 CHADHO C[C@@H]([NH2+]C[C@]1(C)CCCNC1)c1cc2ccccc2s1 ZINC000423351347 330192875 /nfs/dbraw/zinc/19/28/75/330192875.db2.gz YWPTVKPJFNEULI-CXAGYDPISA-N 1 3 288.460 3.942 20 0 CHADHO CC[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccc(C)cc1 ZINC000423357475 330193349 /nfs/dbraw/zinc/19/33/49/330193349.db2.gz MBNHXIVVOGRBLO-LJQANCHMSA-N 1 3 280.415 3.839 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@@H]([NH3+])C1)c1ccc(F)c2ccccc21 ZINC000423361484 330193526 /nfs/dbraw/zinc/19/35/26/330193526.db2.gz GYPORSUZQQLHTE-BFHYXJOUSA-N 1 3 286.394 3.899 20 0 CHADHO CC[C@H](C[C@@H](C)CC)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423364381 330194201 /nfs/dbraw/zinc/19/42/01/330194201.db2.gz VUJMABWJNJGGDT-SUMWQHHRSA-N 1 3 260.425 3.594 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@@H](c3ccc(Cl)cc3)C2)C1 ZINC000423364900 330194356 /nfs/dbraw/zinc/19/43/56/330194356.db2.gz KBXDTZXRZKRABX-SIXLDLHFSA-N 1 3 292.854 3.836 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](N[C@@H]2CCc3c2ccc(Cl)c3Cl)C1 ZINC000423366806 330194554 /nfs/dbraw/zinc/19/45/54/330194554.db2.gz CHGZUCYNJUYGSI-GPCCPHFNSA-N 1 3 299.245 3.840 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](N[C@@H]2CCc3c2ccc(Cl)c3Cl)C1 ZINC000423366807 330194660 /nfs/dbraw/zinc/19/46/60/330194660.db2.gz CHGZUCYNJUYGSI-ISTVAULSSA-N 1 3 299.245 3.840 20 0 CHADHO C[C@H]([NH2+][C@H]1CCN[C@H](C)C1)c1cc2ccccc2s1 ZINC000423368660 330194875 /nfs/dbraw/zinc/19/48/75/330194875.db2.gz BGUULYUCCKUOET-DYEKYZERSA-N 1 3 274.433 3.692 20 0 CHADHO CCCC[C@H]([NH2+][C@H]1CCN[C@H](C)C1)c1ccccc1 ZINC000423370139 330195064 /nfs/dbraw/zinc/19/50/64/330195064.db2.gz GTBHFQWLEOUPNT-PVAVHDDUSA-N 1 3 260.425 3.648 20 0 CHADHO CCN[C@H](C)C[NH2+][C@H](c1cccs1)C1CCCC1 ZINC000423373630 330195698 /nfs/dbraw/zinc/19/56/98/330195698.db2.gz HMHJRBSVQRJNMX-DOMZBBRYSA-N 1 3 266.454 3.567 20 0 CHADHO C[C@H](N[C@@H]1CC[NH2+]C[C@H]1C)c1cc2ccccc2s1 ZINC000423397754 330195963 /nfs/dbraw/zinc/19/59/63/330195963.db2.gz OLFSNWBZUFHJIR-MBNYWOFBSA-N 1 3 274.433 3.550 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCNC[C@H]1C)c1cc2ccccc2s1 ZINC000423397754 330195964 /nfs/dbraw/zinc/19/59/64/330195964.db2.gz OLFSNWBZUFHJIR-MBNYWOFBSA-N 1 3 274.433 3.550 20 0 CHADHO CC(C)CCC[C@H](C)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423403972 330196649 /nfs/dbraw/zinc/19/66/49/330196649.db2.gz XMDSYWBJTVHRPR-AWEZNQCLSA-N 1 3 260.425 3.594 20 0 CHADHO CC(C)Sc1ccc([C@H](C)[NH2+][C@H]2CCNC[C@H]2C)cc1 ZINC000423406139 330196673 /nfs/dbraw/zinc/19/66/73/330196673.db2.gz UJMACRNPQSLPMS-KEYYUXOJSA-N 1 3 292.492 3.836 20 0 CHADHO Cc1ccc2c(c1)[C@H](NCc1ccc3c(c1)C[NH2+]C3)[C@H](C)C2 ZINC000423375867 330198568 /nfs/dbraw/zinc/19/85/68/330198568.db2.gz IXNUHVNRMUBWGC-JLTOFOAXSA-N 1 3 292.426 3.621 20 0 CHADHO CC(C)c1ccc([C@H](C)[NH2+][C@H]2CCN[C@H](C)C2)cc1 ZINC000423378086 330198853 /nfs/dbraw/zinc/19/88/53/330198853.db2.gz MDWMTDFVOAXDIY-KEYYUXOJSA-N 1 3 260.425 3.601 20 0 CHADHO CCCCOc1ccc([C@H](C)[NH2+][C@@H]2CCNC[C@H]2C)cc1 ZINC000423392704 330200733 /nfs/dbraw/zinc/20/07/33/330200733.db2.gz LTMVCKVZZBXQKR-RVKKMQEKSA-N 1 3 290.451 3.514 20 0 CHADHO C[C@@H]1C[C@@H](N[C@H](c2ccccc2)C2CCCC2)CC[NH2+]1 ZINC000423395947 330200838 /nfs/dbraw/zinc/20/08/38/330200838.db2.gz TXAWYDTTXCSTKV-FHLIZLRMSA-N 1 3 272.436 3.648 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2)C2CCCC2)CCN1 ZINC000423395947 330200839 /nfs/dbraw/zinc/20/08/39/330200839.db2.gz TXAWYDTTXCSTKV-FHLIZLRMSA-N 1 3 272.436 3.648 20 0 CHADHO CC(C)[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)c1cc2ccccc2o1 ZINC000423395161 330200967 /nfs/dbraw/zinc/20/09/67/330200967.db2.gz RTHQZLVHUIAJHX-VKJFTORMSA-N 1 3 286.419 3.989 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)c1ccc(-c2ccccc2F)s1)[C@H](C)N ZINC000423448133 330202687 /nfs/dbraw/zinc/20/26/87/330202687.db2.gz PTIWDGUHZYBTLM-TUAOUCFPSA-N 1 3 292.423 3.941 20 0 CHADHO Cc1ccc2cc([C@H](C)N[C@@H]3C[C@H]3C3CC[NH2+]CC3)oc2c1 ZINC000423450730 330202917 /nfs/dbraw/zinc/20/29/17/330202917.db2.gz XLFGVRPJGMNHGM-RRQGHBQHSA-N 1 3 298.430 3.780 20 0 CHADHO C[C@@H](N)[C@H](C)[NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000423453504 330203178 /nfs/dbraw/zinc/20/31/78/330203178.db2.gz XSVBKBFLGZOWAP-ILXRZTDVSA-N 1 3 268.404 3.740 20 0 CHADHO C[C@@H](N)[C@@H](C)[NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000423453505 330203236 /nfs/dbraw/zinc/20/32/36/330203236.db2.gz XSVBKBFLGZOWAP-KFWWJZLASA-N 1 3 268.404 3.740 20 0 CHADHO CC[C@@H](N)C[NH2+][C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423455626 330203548 /nfs/dbraw/zinc/20/35/48/330203548.db2.gz CUDCFYSZYOROPA-CABCVRRESA-N 1 3 266.816 3.508 20 0 CHADHO CC[C@H](N)C[NH2+][C@H](C)c1sc(-c2ccccc2)nc1C ZINC000423461084 330203993 /nfs/dbraw/zinc/20/39/93/330203993.db2.gz JHQSEJHIKBIDFD-RISCZKNCSA-N 1 3 289.448 3.506 20 0 CHADHO [NH3+]C[C@@H]1CC[C@H](N[C@H]2CCc3cc(Cl)cc(Cl)c32)C1 ZINC000423485688 330206904 /nfs/dbraw/zinc/20/69/04/330206904.db2.gz BDGIKLQBNXLGGX-LQJRIPTKSA-N 1 3 299.245 3.698 20 0 CHADHO [NH3+]CCC[C@H](N[C@@H]1CCc2c1cccc2F)c1ccccc1 ZINC000423495785 330207763 /nfs/dbraw/zinc/20/77/63/330207763.db2.gz CQJKQVDTWBMKBH-RBUKOAKNSA-N 1 3 298.405 3.883 20 0 CHADHO C[C@@H](N[C@H](CCC[NH3+])c1ccccc1)c1cccc(O)c1 ZINC000423496461 330207902 /nfs/dbraw/zinc/20/79/02/330207902.db2.gz DXBPIBNUNNFKIN-RDTXWAMCSA-N 1 3 284.403 3.523 20 0 CHADHO C[C@H](N[C@H]1CC[C@H](C[NH3+])C1)c1cc(Cl)ccc1Cl ZINC000423496348 330207904 /nfs/dbraw/zinc/20/79/04/330207904.db2.gz WLVXABNSBICYCY-NHCYSSNCSA-N 1 3 287.234 3.771 20 0 CHADHO C[C@@H](N[C@@H](CCC[NH3+])c1ccccc1)c1cccc(O)c1 ZINC000423496459 330207964 /nfs/dbraw/zinc/20/79/64/330207964.db2.gz DXBPIBNUNNFKIN-KDOFPFPSSA-N 1 3 284.403 3.523 20 0 CHADHO C[C@@H](N[C@H](CCC[NH3+])c1ccccc1)c1ccsc1 ZINC000423498302 330208100 /nfs/dbraw/zinc/20/81/00/330208100.db2.gz HXSFSUSZPIRMGW-CZUORRHYSA-N 1 3 274.433 3.879 20 0 CHADHO [NH3+]CCC[C@H](N[C@@H]1CCc2cc(F)ccc21)c1ccccc1 ZINC000423513674 330209281 /nfs/dbraw/zinc/20/92/81/330209281.db2.gz VOYMUUADKMWFFA-RBUKOAKNSA-N 1 3 298.405 3.883 20 0 CHADHO Cc1c(C)c(C)c(CN[C@@H]2CC[N@H+](C)[C@H](C)C2)c(C)c1C ZINC000536841615 330236128 /nfs/dbraw/zinc/23/61/28/330236128.db2.gz VZPLHOWOZBJPNB-KZULUSFZSA-N 1 3 288.479 3.801 20 0 CHADHO Cc1c(C)c(C)c(CN[C@@H]2CC[N@@H+](C)[C@H](C)C2)c(C)c1C ZINC000536841615 330236129 /nfs/dbraw/zinc/23/61/29/330236129.db2.gz VZPLHOWOZBJPNB-KZULUSFZSA-N 1 3 288.479 3.801 20 0 CHADHO Cc1cc(CNCc2cccc(C[N@@H+](C)C(C)C)c2)ccn1 ZINC000527645728 330269016 /nfs/dbraw/zinc/26/90/16/330269016.db2.gz GRACFUVMBXLPLG-UHFFFAOYSA-N 1 3 297.446 3.520 20 0 CHADHO Cc1cc(CNCc2cccc(C[N@H+](C)C(C)C)c2)ccn1 ZINC000527645728 330269018 /nfs/dbraw/zinc/26/90/18/330269018.db2.gz GRACFUVMBXLPLG-UHFFFAOYSA-N 1 3 297.446 3.520 20 0 CHADHO C[C@H]([NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1)[C@@H]1C[C@H]1C1CC1 ZINC000527691044 330279234 /nfs/dbraw/zinc/27/92/34/330279234.db2.gz KRPASNXYEMJJRW-KYYHFZFISA-N 1 3 290.495 3.664 20 0 CHADHO CC[C@H](CCc1ccccc1)[NH2+][C@@H]1CCN2CCC[C@H]2C1 ZINC000527763940 330281614 /nfs/dbraw/zinc/28/16/14/330281614.db2.gz NEKCUBAMPQZCCM-QRVBRYPASA-N 1 3 286.463 3.614 20 0 CHADHO CC[C@H](CCc1ccccc1)N[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000527763940 330281615 /nfs/dbraw/zinc/28/16/15/330281615.db2.gz NEKCUBAMPQZCCM-QRVBRYPASA-N 1 3 286.463 3.614 20 0 CHADHO CC[C@H](CCc1ccccc1)N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000527763940 330281616 /nfs/dbraw/zinc/28/16/16/330281616.db2.gz NEKCUBAMPQZCCM-QRVBRYPASA-N 1 3 286.463 3.614 20 0 CHADHO CC(C)c1cccc([C@H](C)NC[C@@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000527850770 330288287 /nfs/dbraw/zinc/28/82/87/330288287.db2.gz NZTYWPYVYPCWRB-HOTGVXAUSA-N 1 3 286.463 3.945 20 0 CHADHO CC(C)c1cccc([C@H](C)NC[C@@H]2CC[N@H+](C3CC3)C2)c1 ZINC000527850770 330288288 /nfs/dbraw/zinc/28/82/88/330288288.db2.gz NZTYWPYVYPCWRB-HOTGVXAUSA-N 1 3 286.463 3.945 20 0 CHADHO CC(C)c1cccc([C@H](C)NC[C@H]2CCC[N@H+](C)C2)c1 ZINC000527861499 330289256 /nfs/dbraw/zinc/28/92/56/330289256.db2.gz LNYTUUFKGGXONE-JKSUJKDBSA-N 1 3 274.452 3.802 20 0 CHADHO CC(C)c1cccc([C@H](C)NC[C@H]2CCC[N@@H+](C)C2)c1 ZINC000527861499 330289257 /nfs/dbraw/zinc/28/92/57/330289257.db2.gz LNYTUUFKGGXONE-JKSUJKDBSA-N 1 3 274.452 3.802 20 0 CHADHO Cc1cc(C)c([C@@H](C)NC[C@@H]2CCC[N@H+](C)C2)cc1C ZINC000044534197 330329721 /nfs/dbraw/zinc/32/97/21/330329721.db2.gz BZCDDUFVZXAZQB-SJORKVTESA-N 1 3 274.452 3.604 20 0 CHADHO Cc1cc(C)c([C@@H](C)NC[C@@H]2CCC[N@@H+](C)C2)cc1C ZINC000044534197 330329722 /nfs/dbraw/zinc/32/97/22/330329722.db2.gz BZCDDUFVZXAZQB-SJORKVTESA-N 1 3 274.452 3.604 20 0 CHADHO CC(C)c1ccc([C@H](C)NC[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000044535653 330329886 /nfs/dbraw/zinc/32/98/86/330329886.db2.gz JAXUZRCCVSXJBF-HOTGVXAUSA-N 1 3 274.452 3.802 20 0 CHADHO CC(C)c1ccc([C@H](C)NC[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000044535653 330329887 /nfs/dbraw/zinc/32/98/87/330329887.db2.gz JAXUZRCCVSXJBF-HOTGVXAUSA-N 1 3 274.452 3.802 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1N[C@@H]1CCCc2cc(F)ccc21 ZINC000090964341 330397338 /nfs/dbraw/zinc/39/73/38/330397338.db2.gz NSNHKKMVHSZSBZ-OBQMCUGOSA-N 1 3 290.426 3.521 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1N[C@@H]1CCCc2cc(F)ccc21 ZINC000090964341 330397339 /nfs/dbraw/zinc/39/73/39/330397339.db2.gz NSNHKKMVHSZSBZ-OBQMCUGOSA-N 1 3 290.426 3.521 20 0 CHADHO C[C@@H](c1cccc(Cl)c1)N1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000516291118 330491079 /nfs/dbraw/zinc/49/10/79/330491079.db2.gz IXJBNITUHPFODY-XJKSGUPXSA-N 1 3 292.854 3.723 20 0 CHADHO C[C@H]1CC(C)(C)C[C@@H]1[NH2+]Cc1cccc(CN(C)C)c1 ZINC000434778800 330645088 /nfs/dbraw/zinc/64/50/88/330645088.db2.gz XXIDGQPTEVACBI-YOEHRIQHSA-N 1 3 274.452 3.663 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1N[C@H]1CCCc2c(F)cccc21 ZINC000453239853 331105756 /nfs/dbraw/zinc/10/57/56/331105756.db2.gz TURVDSCWUMWGNG-COCCGSRQSA-N 1 3 290.426 3.521 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1N[C@H]1CCCc2c(F)cccc21 ZINC000453239853 331105757 /nfs/dbraw/zinc/10/57/57/331105757.db2.gz TURVDSCWUMWGNG-COCCGSRQSA-N 1 3 290.426 3.521 20 0 CHADHO CC[C@]1(C(C)C)C[C@H]1NC1CC[NH+](C(C)(C)C)CC1 ZINC000453435707 331131537 /nfs/dbraw/zinc/13/15/37/331131537.db2.gz KZZYBCPYKHIRDF-NVXWUHKLSA-N 1 3 266.473 3.664 20 0 CHADHO CN(C)[C@H]1CCC[C@H]([NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC000459435974 331281241 /nfs/dbraw/zinc/28/12/41/331281241.db2.gz XYYTWDFCEIBQAL-ROUUACIJSA-N 1 3 272.436 3.526 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC000459435972 331281281 /nfs/dbraw/zinc/28/12/81/331281281.db2.gz XYYTWDFCEIBQAL-QZTJIDSGSA-N 1 3 272.436 3.526 20 0 CHADHO CC1(C)[C@H]([NH2+]CCCN2CCCC2)C[C@@H]1c1ccccc1 ZINC000463557986 331349516 /nfs/dbraw/zinc/34/95/16/331349516.db2.gz NZQJMYPYBGWCMQ-QZTJIDSGSA-N 1 3 286.463 3.644 20 0 CHADHO CC1(C)[C@H](NCCC[NH+]2CCCC2)C[C@@H]1c1ccccc1 ZINC000463557986 331349517 /nfs/dbraw/zinc/34/95/17/331349517.db2.gz NZQJMYPYBGWCMQ-QZTJIDSGSA-N 1 3 286.463 3.644 20 0 CHADHO C[C@@H](CC1CCCC1)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000468512794 331436285 /nfs/dbraw/zinc/43/62/85/331436285.db2.gz YFVMYEKCIUSOFV-ZDUSSCGKSA-N 1 3 266.473 3.854 20 0 CHADHO Cc1ccccc1C[C@H](C)[NH2+]CC(C)(C)CN1CCCC1 ZINC000477944017 331695067 /nfs/dbraw/zinc/69/50/67/331695067.db2.gz WHCWQZIGBMLMBZ-KRWDZBQOSA-N 1 3 288.479 3.638 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1)CN1CCCCC1 ZINC000488413779 332005585 /nfs/dbraw/zinc/00/55/85/332005585.db2.gz ZVVYUAJUTLXOQR-OWCLPIDISA-N 1 3 298.540 3.618 20 0 CHADHO C[C@H](CN[C@@H]1CS[C@@H](C(C)(C)C)C1)C[NH+]1CCCCC1 ZINC000488413779 332005586 /nfs/dbraw/zinc/00/55/86/332005586.db2.gz ZVVYUAJUTLXOQR-OWCLPIDISA-N 1 3 298.540 3.618 20 0 CHADHO Cc1ccc2c(c1)[C@@H](N[C@@H]1C[C@@H](C)[N@@H+](C)C[C@H]1C)CCC2 ZINC000490228097 332085028 /nfs/dbraw/zinc/08/50/28/332085028.db2.gz YTXUAEIGBBBYMV-VVWQDTPRSA-N 1 3 286.463 3.691 20 0 CHADHO Cc1ccc2c(c1)[C@@H](N[C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C)CCC2 ZINC000490228097 332085029 /nfs/dbraw/zinc/08/50/29/332085029.db2.gz YTXUAEIGBBBYMV-VVWQDTPRSA-N 1 3 286.463 3.691 20 0 CHADHO CC[N@@H+]1CC[C@@H](N[C@H]2CCCc3ccc(C)cc32)[C@H](C)C1 ZINC000490399527 332088652 /nfs/dbraw/zinc/08/86/52/332088652.db2.gz KNWOXNDLGGOMIV-LZQZEXGQSA-N 1 3 286.463 3.692 20 0 CHADHO CC[N@H+]1CC[C@@H](N[C@H]2CCCc3ccc(C)cc32)[C@H](C)C1 ZINC000490399527 332088653 /nfs/dbraw/zinc/08/86/53/332088653.db2.gz KNWOXNDLGGOMIV-LZQZEXGQSA-N 1 3 286.463 3.692 20 0 CHADHO CC1(C)CC[C@H]([NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000575365378 335097942 /nfs/dbraw/zinc/09/79/42/335097942.db2.gz VCVYJRCYJFVWKZ-HNNXBMFYSA-N 1 3 264.457 3.562 20 0 CHADHO NCCC[N@@H+](Cc1ccccc1)C[C@H]1CCCC(F)(F)C1 ZINC000336658766 335109930 /nfs/dbraw/zinc/10/99/30/335109930.db2.gz AEQQWERXSQNWJB-INIZCTEOSA-N 1 3 296.405 3.663 20 0 CHADHO NCCC[N@H+](Cc1ccccc1)C[C@H]1CCCC(F)(F)C1 ZINC000336658766 335109931 /nfs/dbraw/zinc/10/99/31/335109931.db2.gz AEQQWERXSQNWJB-INIZCTEOSA-N 1 3 296.405 3.663 20 0 CHADHO [NH3+]CCCN(Cc1ccccc1)C[C@H]1CCCC(F)(F)C1 ZINC000336658766 335109932 /nfs/dbraw/zinc/10/99/32/335109932.db2.gz AEQQWERXSQNWJB-INIZCTEOSA-N 1 3 296.405 3.663 20 0 CHADHO C[N@@H+]1CC[C@H](NCc2ccc3ccccc3c2)[C@H]2CCC[C@H]21 ZINC000513668371 333030892 /nfs/dbraw/zinc/03/08/92/333030892.db2.gz XNSADEMSFIQZFF-HSALFYBXSA-N 1 3 294.442 3.802 20 0 CHADHO C[N@H+]1CC[C@H](NCc2ccc3ccccc3c2)[C@H]2CCC[C@H]21 ZINC000513668371 333030893 /nfs/dbraw/zinc/03/08/93/333030893.db2.gz XNSADEMSFIQZFF-HSALFYBXSA-N 1 3 294.442 3.802 20 0 CHADHO CCN(CC)CCC[N@@H+]1CCC[C@@H]1c1ccc(C)cc1 ZINC000513966170 333055984 /nfs/dbraw/zinc/05/59/84/333055984.db2.gz MMXCGULZWIUDGF-GOSISDBHSA-N 1 3 274.452 3.864 20 0 CHADHO CCN(CC)CCC[N@H+]1CCC[C@@H]1c1ccc(C)cc1 ZINC000513966170 333055986 /nfs/dbraw/zinc/05/59/86/333055986.db2.gz MMXCGULZWIUDGF-GOSISDBHSA-N 1 3 274.452 3.864 20 0 CHADHO CCCc1ccc([C@@H](C)NCc2ccc(C[NH3+])cc2)cc1 ZINC000517236807 333095536 /nfs/dbraw/zinc/09/55/36/333095536.db2.gz OPZDJCMEQNGPPM-OAHLLOKOSA-N 1 3 282.431 3.949 20 0 CHADHO Cc1cc(C)cc(CN[C@@H](CC[NH+](C)C)C(C)(C)C)c1 ZINC000522557784 333290054 /nfs/dbraw/zinc/29/00/54/333290054.db2.gz GMTFLHRGRBCWMT-KRWDZBQOSA-N 1 3 276.468 3.759 20 0 CHADHO c1cc2c(s1)CCC[C@@H]2N[C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000250172404 333303046 /nfs/dbraw/zinc/30/30/46/333303046.db2.gz MJXZEOSNXMFYOX-HNKHHVNMSA-N 1 3 290.476 3.636 20 0 CHADHO CC(C)[N@H+](C)CCCNC1CC(c2ccc(Cl)cc2)C1 ZINC000230383606 333316720 /nfs/dbraw/zinc/31/67/20/333316720.db2.gz CKXZVNZHZCIHAE-UHFFFAOYSA-N 1 3 294.870 3.906 20 0 CHADHO CC(C)[N@@H+](C)CCCNC1CC(c2ccc(Cl)cc2)C1 ZINC000230383606 333316721 /nfs/dbraw/zinc/31/67/21/333316721.db2.gz CKXZVNZHZCIHAE-UHFFFAOYSA-N 1 3 294.870 3.906 20 0 CHADHO CC(C)N(C)CCC[NH2+]C1CC(c2ccc(Cl)cc2)C1 ZINC000230383606 333316722 /nfs/dbraw/zinc/31/67/22/333316722.db2.gz CKXZVNZHZCIHAE-UHFFFAOYSA-N 1 3 294.870 3.906 20 0 CHADHO CC(C)[C@@H](C[NH2+]CCCN1CCCC1)c1ccccc1 ZINC000232704750 333340713 /nfs/dbraw/zinc/34/07/13/333340713.db2.gz JCEYUWYTDSOMMH-GOSISDBHSA-N 1 3 274.452 3.502 20 0 CHADHO CC[NH+]1CCC(CCNCc2ccc([C@@H]3C[C@H]3C)o2)CC1 ZINC000174551791 335158618 /nfs/dbraw/zinc/15/86/18/335158618.db2.gz CJLUQDQKMVRIDI-RHSMWYFYSA-N 1 3 290.451 3.615 20 0 CHADHO CCCC[N@H+](C)CC1CCN(Cc2cccs2)CC1 ZINC000134174238 334082881 /nfs/dbraw/zinc/08/28/81/334082881.db2.gz OWEHAQYBVRWDFJ-UHFFFAOYSA-N 1 3 280.481 3.692 20 0 CHADHO CCCC[N@@H+](C)CC1CCN(Cc2cccs2)CC1 ZINC000134174238 334082882 /nfs/dbraw/zinc/08/28/82/334082882.db2.gz OWEHAQYBVRWDFJ-UHFFFAOYSA-N 1 3 280.481 3.692 20 0 CHADHO CC(C)c1cccc(C[NH2+]C2CCN(CC3CC3)CC2)c1 ZINC000547830520 334124413 /nfs/dbraw/zinc/12/44/13/334124413.db2.gz HARMRSHAEFQURS-UHFFFAOYSA-N 1 3 286.463 3.774 20 0 CHADHO c1ccc2c(c1)CCC[C@H]2[N@@H+]1CC[C@@H](CN2CCCCC2)C1 ZINC000245433128 334192720 /nfs/dbraw/zinc/19/27/20/334192720.db2.gz BSBSADLMZWLCMY-FXAWDEMLSA-N 1 3 298.474 3.872 20 0 CHADHO c1ccc2c(c1)CCC[C@H]2[N@H+]1CC[C@@H](CN2CCCCC2)C1 ZINC000245433128 334192721 /nfs/dbraw/zinc/19/27/21/334192721.db2.gz BSBSADLMZWLCMY-FXAWDEMLSA-N 1 3 298.474 3.872 20 0 CHADHO c1ccc2c(c1)CCC[C@H]2N1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000245433128 334192722 /nfs/dbraw/zinc/19/27/22/334192722.db2.gz BSBSADLMZWLCMY-FXAWDEMLSA-N 1 3 298.474 3.872 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@H](C)c2cc(C)cc(C)c2)C1 ZINC000246928655 334272201 /nfs/dbraw/zinc/27/22/01/334272201.db2.gz HATKHDMJRKQFNL-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@H](C)c2cc(C)cc(C)c2)C1 ZINC000246928655 334272203 /nfs/dbraw/zinc/27/22/03/334272203.db2.gz HATKHDMJRKQFNL-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](C)c2cc(C)cc(C)c2)C1 ZINC000246928655 334272205 /nfs/dbraw/zinc/27/22/05/334272205.db2.gz HATKHDMJRKQFNL-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H]2CCc3cc(F)ccc32)C1 ZINC000246929744 334272243 /nfs/dbraw/zinc/27/22/43/334272243.db2.gz GYWNOWXZVBSEIZ-KSSFIOAISA-N 1 3 290.426 3.523 20 0 CHADHO C[C@@H](NCCCCC[NH+]1CCCC1)c1ccccc1F ZINC000550267450 334218267 /nfs/dbraw/zinc/21/82/67/334218267.db2.gz ZLHQTKZULVYBNW-OAHLLOKOSA-N 1 3 278.415 3.742 20 0 CHADHO C[C@@H](c1ccc2ccccc2c1)N1CC[C@@H](C[NH+](C)C)C1 ZINC000246457501 334258423 /nfs/dbraw/zinc/25/84/23/334258423.db2.gz YMMMAXTWDBFZJV-HOTGVXAUSA-N 1 3 282.431 3.784 20 0 CHADHO C[C@H](N[C@H]1CCc2ccccc21)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248397579 334300055 /nfs/dbraw/zinc/30/00/55/334300055.db2.gz IBMJUXDJSANWFL-KNBMTAEXSA-N 1 3 298.474 3.917 20 0 CHADHO C[C@H](N[C@H]1CCc2ccccc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248397579 334300056 /nfs/dbraw/zinc/30/00/56/334300056.db2.gz IBMJUXDJSANWFL-KNBMTAEXSA-N 1 3 298.474 3.917 20 0 CHADHO C[C@H]([NH2+][C@H]1CCc2ccccc21)[C@H]1CCCN(C2CCC2)C1 ZINC000248397579 334300057 /nfs/dbraw/zinc/30/00/57/334300057.db2.gz IBMJUXDJSANWFL-KNBMTAEXSA-N 1 3 298.474 3.917 20 0 CHADHO CCCc1ccc(CN(C)[C@H]2CC[N@H+](CC)C[C@@H]2C)cc1 ZINC000552290850 334314032 /nfs/dbraw/zinc/31/40/32/334314032.db2.gz VFEFOFBALJRALA-LPHOPBHVSA-N 1 3 288.479 3.801 20 0 CHADHO CCCc1ccc(CN(C)[C@H]2CC[N@@H+](CC)C[C@@H]2C)cc1 ZINC000552290850 334314034 /nfs/dbraw/zinc/31/40/34/334314034.db2.gz VFEFOFBALJRALA-LPHOPBHVSA-N 1 3 288.479 3.801 20 0 CHADHO c1ccc(C[C@@H]2CC[C@H]([NH2+][C@@H]3CCN4CCC[C@H]4C3)C2)cc1 ZINC000249144200 334329088 /nfs/dbraw/zinc/32/90/88/334329088.db2.gz WWCLITQMCIRGLJ-HAGHYFMRSA-N 1 3 298.474 3.614 20 0 CHADHO C[NH2+]C[C@@H]1CCN([C@H](C)c2ccc(C(C)(C)C)cc2)C1 ZINC000251830808 334370538 /nfs/dbraw/zinc/37/05/38/334370538.db2.gz ZQYGNDAMHTVBMV-CABCVRRESA-N 1 3 274.452 3.586 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H]2CCC(C)(C)c3ccccc32)C1 ZINC000252439539 334379877 /nfs/dbraw/zinc/37/98/77/334379877.db2.gz PYXDVDZFWHUHCQ-YJBOKZPZSA-N 1 3 286.463 3.731 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H]2CCC(C)(C)c3ccccc32)C1 ZINC000252439539 334379879 /nfs/dbraw/zinc/37/98/79/334379879.db2.gz PYXDVDZFWHUHCQ-YJBOKZPZSA-N 1 3 286.463 3.731 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H]2CCC(C)(C)c3ccccc32)C1 ZINC000252439539 334379881 /nfs/dbraw/zinc/37/98/81/334379881.db2.gz PYXDVDZFWHUHCQ-YJBOKZPZSA-N 1 3 286.463 3.731 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](C)c2ccc(CC(C)C)cc2)C1 ZINC000252439586 334379922 /nfs/dbraw/zinc/37/99/22/334379922.db2.gz QIKIPVNJQLYJAN-AEFFLSMTSA-N 1 3 288.479 3.878 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](C)c2ccc(CC(C)C)cc2)C1 ZINC000252439586 334379923 /nfs/dbraw/zinc/37/99/23/334379923.db2.gz QIKIPVNJQLYJAN-AEFFLSMTSA-N 1 3 288.479 3.878 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](C)c2ccc(CC(C)C)cc2)C1 ZINC000252439586 334379924 /nfs/dbraw/zinc/37/99/24/334379924.db2.gz QIKIPVNJQLYJAN-AEFFLSMTSA-N 1 3 288.479 3.878 20 0 CHADHO C[C@@H](Cc1ccc(F)cc1)[NH2+]CCCN1CCCC[C@H]1C ZINC000252711109 334386052 /nfs/dbraw/zinc/38/60/52/334386052.db2.gz IOPBIXIKLGPBAE-JKSUJKDBSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@@H](Cc1ccc(F)cc1)NCCC[N@@H+]1CCCC[C@H]1C ZINC000252711109 334386054 /nfs/dbraw/zinc/38/60/54/334386054.db2.gz IOPBIXIKLGPBAE-JKSUJKDBSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@@H](Cc1ccc(F)cc1)NCCC[N@H+]1CCCC[C@H]1C ZINC000252711109 334386056 /nfs/dbraw/zinc/38/60/56/334386056.db2.gz IOPBIXIKLGPBAE-JKSUJKDBSA-N 1 3 292.442 3.611 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H]1CCC[C@H]1c1ccccc1 ZINC000554839648 334455286 /nfs/dbraw/zinc/45/52/86/334455286.db2.gz KJOIMSPHRVRCBX-ZWKOTPCHSA-N 1 3 274.452 3.644 20 0 CHADHO C[C@H]([NH2+]C1CCCCC1)c1ccc(OCCN(C)C)cc1 ZINC000152975467 334534231 /nfs/dbraw/zinc/53/42/31/334534231.db2.gz HTEKGCFDLHJZFO-HNNXBMFYSA-N 1 3 290.451 3.610 20 0 CHADHO CCC[C@H](NCC1CC[NH+](CCC)CC1)c1ccccn1 ZINC000159006954 334817942 /nfs/dbraw/zinc/81/79/42/334817942.db2.gz SFUMLVRCALZNIY-KRWDZBQOSA-N 1 3 289.467 3.634 20 0 CHADHO Cc1cc([C@H](NCc2ccc(C[NH3+])cc2)C2CC2)ccc1F ZINC000576943498 335267250 /nfs/dbraw/zinc/26/72/50/335267250.db2.gz KTPZXSSBAANYNR-LJQANCHMSA-N 1 3 298.405 3.834 20 0 CHADHO C[C@H](N[C@H]1CCCC[C@@H]1C[NH3+])c1ccc(Cl)c(F)c1 ZINC000577481858 335356963 /nfs/dbraw/zinc/35/69/63/335356963.db2.gz HMXYCRQJFSRBRK-NVBFEUDRSA-N 1 3 284.806 3.647 20 0 CHADHO c1csc([C@@H]2CCCN2Cc2ccc3c(c2)C[NH2+]CC3)c1 ZINC000581829426 336148920 /nfs/dbraw/zinc/14/89/20/336148920.db2.gz RVISAMJCNGDGJG-KRWDZBQOSA-N 1 3 298.455 3.731 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N[C@H](C)c1cccnc1Cl ZINC000131278532 520636427 /nfs/dbraw/zinc/63/64/27/520636427.db2.gz WVVMVMNHVVZDNB-UONOGXRCSA-N 1 3 297.874 3.896 20 0 CHADHO CCC[C@@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccccc1 ZINC000037649495 520780784 /nfs/dbraw/zinc/78/07/84/520780784.db2.gz FWZMQBHBZBPWAT-CRAIPNDOSA-N 1 3 272.436 3.602 20 0 CHADHO CCC[C@@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1ccccc1 ZINC000037649495 520780790 /nfs/dbraw/zinc/78/07/90/520780790.db2.gz FWZMQBHBZBPWAT-CRAIPNDOSA-N 1 3 272.436 3.602 20 0 CHADHO CC[N@H+](CCCN1CCCC1)Cc1cc2ccccc2o1 ZINC000340690988 521013878 /nfs/dbraw/zinc/01/38/78/521013878.db2.gz ZADBKTIEGSTGQP-UHFFFAOYSA-N 1 3 286.419 3.741 20 0 CHADHO CC[N@@H+](CCCN1CCCC1)Cc1cc2ccccc2o1 ZINC000340690988 521013885 /nfs/dbraw/zinc/01/38/85/521013885.db2.gz ZADBKTIEGSTGQP-UHFFFAOYSA-N 1 3 286.419 3.741 20 0 CHADHO COc1ccc([C@H](C)[NH2+]C2CCN(C(C)(C)C)CC2)cc1 ZINC000037786198 525316549 /nfs/dbraw/zinc/31/65/49/525316549.db2.gz YVAYKNXSENNHSR-AWEZNQCLSA-N 1 3 290.451 3.609 20 0 CHADHO C[C@H](NCCCCC[NH+]1CCCC1)c1ccc(Cl)cn1 ZINC000293636864 525332530 /nfs/dbraw/zinc/33/25/30/525332530.db2.gz GWKQUDPRPRRPQP-AWEZNQCLSA-N 1 3 295.858 3.652 20 0 CHADHO C[C@@H](NC1CC[NH+](C2CC2)CC1)c1ccc(Cl)cc1 ZINC000037140855 525401634 /nfs/dbraw/zinc/40/16/34/525401634.db2.gz UOEHLFKOSQSEHO-GFCCVEGCSA-N 1 3 278.827 3.617 20 0 CHADHO C[C@@H](c1ccc(C(C)(C)C)cc1)N1CCC[C@H](C[NH3+])C1 ZINC000044527692 526038775 /nfs/dbraw/zinc/03/87/75/526038775.db2.gz OVUOBCBANDDYFV-LSDHHAIUSA-N 1 3 274.452 3.716 20 0 CHADHO C[C@@H](c1ccc(F)c(Cl)c1)N1CCC[C@@H](CC[NH3+])C1 ZINC000226327112 526046415 /nfs/dbraw/zinc/04/64/15/526046415.db2.gz JKLOVEUAEPAVKZ-RYUDHWBXSA-N 1 3 284.806 3.601 20 0 CHADHO c1cc(N2CCC(C[NH2+][C@@H]3CCC34CCCC4)CC2)ccn1 ZINC000189158400 526432118 /nfs/dbraw/zinc/43/21/18/526432118.db2.gz XMCDNTWGNYSYTJ-GOSISDBHSA-N 1 3 299.462 3.610 20 0 CHADHO Cc1nc(C)c([C@H](C)[NH2+]CCCN2CCC(C)CC2)s1 ZINC000111360077 526751979 /nfs/dbraw/zinc/75/19/79/526751979.db2.gz FJPBVUNHWAOMIO-ZDUSSCGKSA-N 1 3 295.496 3.533 20 0 CHADHO CCC[NH+]1CCC(N[C@H]2CCCc3ccc(C)cc32)CC1 ZINC000352604979 528205450 /nfs/dbraw/zinc/20/54/50/528205450.db2.gz FKPMQODDZGWXHH-IBGZPJMESA-N 1 3 286.463 3.836 20 0 CHADHO CC(C)Cc1ccc([C@H](C)N[C@H]2CCC[NH2+]CC2)cc1 ZINC000133641115 1125482400 /nfs/dbraw/zinc/48/24/00/1125482400.db2.gz HYULYVMHDCUAAJ-YJBOKZPZSA-N 1 3 274.452 3.678 20 0 CHADHO CC[C@H](NC[C@@H]1CC[N@@H+](CC)C1)c1cccc(Cl)c1 ZINC000037644051 1118033217 /nfs/dbraw/zinc/03/32/17/1118033217.db2.gz VMJWEHDTNXYKHC-BBRMVZONSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@H]([NH2+]C[C@@H]1CCN(CC)C1)c1cccc(Cl)c1 ZINC000037644051 1118033221 /nfs/dbraw/zinc/03/32/21/1118033221.db2.gz VMJWEHDTNXYKHC-BBRMVZONSA-N 1 3 280.843 3.723 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1ccc(Cl)s1 ZINC000037649002 1118278283 /nfs/dbraw/zinc/27/82/83/1118278283.db2.gz QAWVEPSWFQTTAG-MNOVXSKESA-N 1 3 284.856 3.536 20 0 CHADHO CC[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000181745872 1120143279 /nfs/dbraw/zinc/14/32/79/1120143279.db2.gz UVGBAIVMBMYQEI-BBWFWOEESA-N 1 3 266.473 3.665 20 0 CHADHO CC1(C)CC([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000433298398 1121642837 /nfs/dbraw/zinc/64/28/37/1121642837.db2.gz OMKBDMNYLVWVCS-UHFFFAOYSA-N 1 3 264.457 3.562 20 0 CHADHO CC(C)CCN1CCC([NH2+]CCCC2CCC2)CC1 ZINC001182941609 1122196124 /nfs/dbraw/zinc/19/61/24/1122196124.db2.gz NFWPWWUYCXWQHF-UHFFFAOYSA-N 1 3 266.473 3.667 20 0 CHADHO NC1(C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)CCCC1 ZINC000665247653 1123256025 /nfs/dbraw/zinc/25/60/25/1123256025.db2.gz HEMRTCGRIIPLFA-HNNXBMFYSA-N 1 3 278.827 3.652 20 0 CHADHO CC1(C)C[C@H]([NH2+]CCCCC2CCCCC2)CCN1 ZINC001246480440 1131522225 /nfs/dbraw/zinc/52/22/25/1131522225.db2.gz WXNGEBBYZOQIJS-MRXNPFEDSA-N 1 3 266.473 3.857 20 0 CHADHO C[C@@H](Cc1c(F)cccc1Cl)[NH2+]C(C)(C)C(C)(C)N ZINC001172853055 1132340297 /nfs/dbraw/zinc/34/02/97/1132340297.db2.gz YBMNTKHQTWHIDW-JTQLQIEISA-N 1 3 286.822 3.516 20 0 CHADHO C[C@@H](Cc1c(F)cccc1Cl)NC(C)(C)C(C)(C)[NH3+] ZINC001172853055 1132340305 /nfs/dbraw/zinc/34/03/05/1132340305.db2.gz YBMNTKHQTWHIDW-JTQLQIEISA-N 1 3 286.822 3.516 20 0 CHADHO CC[C@@H]1CC[C@H]([N@H+](CCCN)C2CCCCC2)C1 ZINC001173265671 1132431602 /nfs/dbraw/zinc/43/16/02/1132431602.db2.gz UUMARGQPWSJHOW-ZBFHGGJFSA-N 1 3 252.446 3.549 20 0 CHADHO CC[C@@H]1CC[C@H]([N@@H+](CCCN)C2CCCCC2)C1 ZINC001173265671 1132431604 /nfs/dbraw/zinc/43/16/04/1132431604.db2.gz UUMARGQPWSJHOW-ZBFHGGJFSA-N 1 3 252.446 3.549 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@@H+]1CCC[C@H](CN)[C@H]1C ZINC001205902993 1133628070 /nfs/dbraw/zinc/62/80/70/1133628070.db2.gz MHQRCIYDFDGVNN-GVDBMIGSSA-N 1 3 298.515 3.667 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@H+]1CCC[C@H](CN)[C@H]1C ZINC001205902993 1133628077 /nfs/dbraw/zinc/62/80/77/1133628077.db2.gz MHQRCIYDFDGVNN-GVDBMIGSSA-N 1 3 298.515 3.667 20 0 CHADHO Cc1ncccc1CNCc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000236666662 1125559067 /nfs/dbraw/zinc/55/90/67/1125559067.db2.gz FLCUGHQKWAMBKG-UHFFFAOYSA-N 1 3 297.446 3.520 20 0 CHADHO Cc1ncccc1CNCc1cccc(C[N@H+](C)C(C)C)c1 ZINC000236666662 1125559070 /nfs/dbraw/zinc/55/90/70/1125559070.db2.gz FLCUGHQKWAMBKG-UHFFFAOYSA-N 1 3 297.446 3.520 20 0 CHADHO CC(C)[N@@H+]1CCC[C@H](CN[C@H]2CCCc3ccccc32)C1 ZINC000246933281 1125654976 /nfs/dbraw/zinc/65/49/76/1125654976.db2.gz HDFZYCQBUDNCSC-APWZRJJASA-N 1 3 286.463 3.774 20 0 CHADHO CC(C)[N@H+]1CCC[C@H](CN[C@H]2CCCc3ccccc32)C1 ZINC000246933281 1125654979 /nfs/dbraw/zinc/65/49/79/1125654979.db2.gz HDFZYCQBUDNCSC-APWZRJJASA-N 1 3 286.463 3.774 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H]2CCCc3ccccc32)C1 ZINC000246933281 1125654983 /nfs/dbraw/zinc/65/49/83/1125654983.db2.gz HDFZYCQBUDNCSC-APWZRJJASA-N 1 3 286.463 3.774 20 0 CHADHO CCCC[C@@H](N[C@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000643521935 1129444158 /nfs/dbraw/zinc/44/41/58/1129444158.db2.gz FQQYZKACYAPZMU-DLBZAZTESA-N 1 3 260.425 3.650 20 0 CHADHO C[C@H](NCCCCC[NH+]1CCCCC1)c1ccncc1F ZINC000338360713 1126738182 /nfs/dbraw/zinc/73/81/82/1126738182.db2.gz RVNGSTHMUHSGIW-HNNXBMFYSA-N 1 3 293.430 3.528 20 0 CHADHO COc1ccc([C@@H](C)N[C@@H](CC[NH+](C)C)C(C)(C)C)cc1 ZINC000483200951 1126772265 /nfs/dbraw/zinc/77/22/65/1126772265.db2.gz OBUSFUKKKBVYDA-PBHICJAKSA-N 1 3 292.467 3.712 20 0 CHADHO COc1cccc([C@H](C)N[C@@H](CC[NH+](C)C)C(C)(C)C)c1 ZINC000483183768 1126772579 /nfs/dbraw/zinc/77/25/79/1126772579.db2.gz JXQZXJBQVYHOSJ-YOEHRIQHSA-N 1 3 292.467 3.712 20 0 CHADHO C(CC1CCCC1)CN1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000483232816 1126774927 /nfs/dbraw/zinc/77/49/27/1126774927.db2.gz SMNMEVWPYUVJTM-GOSISDBHSA-N 1 3 278.484 3.765 20 0 CHADHO C(CC1CCCC1)C[N@@H+]1CC[C@H](CN2CCCCC2)C1 ZINC000483232816 1126774931 /nfs/dbraw/zinc/77/49/31/1126774931.db2.gz SMNMEVWPYUVJTM-GOSISDBHSA-N 1 3 278.484 3.765 20 0 CHADHO C(CC1CCCC1)C[N@H+]1CC[C@H](CN2CCCCC2)C1 ZINC000483232816 1126774934 /nfs/dbraw/zinc/77/49/34/1126774934.db2.gz SMNMEVWPYUVJTM-GOSISDBHSA-N 1 3 278.484 3.765 20 0 CHADHO CC1=C(C)CN(C/C=C/C[N@@H+]2CCC(C)=C(C)C2)CC1 ZINC000483336379 1126781251 /nfs/dbraw/zinc/78/12/51/1126781251.db2.gz DVJWQPYOECCTSZ-AATRIKPKSA-N 1 3 274.452 3.627 20 0 CHADHO CC1=C(C)CN(C/C=C/C[N@H+]2CCC(C)=C(C)C2)CC1 ZINC000483336379 1126781254 /nfs/dbraw/zinc/78/12/54/1126781254.db2.gz DVJWQPYOECCTSZ-AATRIKPKSA-N 1 3 274.452 3.627 20 0 CHADHO CC1CC[NH+](Cc2cccc(CNCc3cc[nH]c3)c2)CC1 ZINC000175706999 1126785344 /nfs/dbraw/zinc/78/53/44/1126785344.db2.gz SBVUGKXPEJXNJQ-UHFFFAOYSA-N 1 3 297.446 3.536 20 0 CHADHO Cc1ccccc1C(C)(C)NC1CC[NH+](CC2CC2)CC1 ZINC001168368281 1126803099 /nfs/dbraw/zinc/80/30/99/1126803099.db2.gz FUILKSWRXYUFGG-UHFFFAOYSA-N 1 3 286.463 3.694 20 0 CHADHO Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H](N(C)C)C2)c(C)c1 ZINC000484466050 1126817015 /nfs/dbraw/zinc/81/70/15/1126817015.db2.gz JEECOSZLJKNUSG-ULQDDVLXSA-N 1 3 274.452 3.827 20 0 CHADHO C[C@H](C[NH2+]C1CCN(C(C)(C)C)CC1)Cc1ccccc1 ZINC000182054672 1126865382 /nfs/dbraw/zinc/86/53/82/1126865382.db2.gz BTPZBFIMNGANKC-INIZCTEOSA-N 1 3 288.479 3.718 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@@H+]1CCC12CCNCC2 ZINC001235103569 1130710267 /nfs/dbraw/zinc/71/02/67/1130710267.db2.gz UZKJDPJTQMFPCG-MRXNPFEDSA-N 1 3 264.457 3.587 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@H+]1CCC12CCNCC2 ZINC001235103569 1130710270 /nfs/dbraw/zinc/71/02/70/1130710270.db2.gz UZKJDPJTQMFPCG-MRXNPFEDSA-N 1 3 264.457 3.587 20 0 CHADHO Cc1ccccc1[C@H](C)N1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000485430885 1126913111 /nfs/dbraw/zinc/91/31/11/1126913111.db2.gz AXILODQDHMJTAA-ROUUACIJSA-N 1 3 286.463 3.864 20 0 CHADHO Cc1ccccc1[C@H](C)[N@@H+]1CC[C@@H](CN2CCCCC2)C1 ZINC000485430885 1126913115 /nfs/dbraw/zinc/91/31/15/1126913115.db2.gz AXILODQDHMJTAA-ROUUACIJSA-N 1 3 286.463 3.864 20 0 CHADHO Cc1ccccc1[C@H](C)[N@H+]1CC[C@@H](CN2CCCCC2)C1 ZINC000485430885 1126913118 /nfs/dbraw/zinc/91/31/18/1126913118.db2.gz AXILODQDHMJTAA-ROUUACIJSA-N 1 3 286.463 3.864 20 0 CHADHO C([NH2+]C1CC2(C1)CCCCC2)[C@@H]1CCCN(CC2CC2)C1 ZINC000668817878 1127052639 /nfs/dbraw/zinc/05/26/39/1127052639.db2.gz BLCPNZIWEUINFR-KRWDZBQOSA-N 1 3 290.495 3.811 20 0 CHADHO Cc1cc([C@H](N[C@H]2CC[N@H+](C)[C@H](C)C2)C2CC2)ccc1F ZINC000271540238 1127090219 /nfs/dbraw/zinc/09/02/19/1127090219.db2.gz QSXOZFJPAXQQGG-RPVQJOFSSA-N 1 3 290.426 3.658 20 0 CHADHO Cc1cc([C@H](N[C@H]2CC[N@@H+](C)[C@H](C)C2)C2CC2)ccc1F ZINC000271540238 1127090223 /nfs/dbraw/zinc/09/02/23/1127090223.db2.gz QSXOZFJPAXQQGG-RPVQJOFSSA-N 1 3 290.426 3.658 20 0 CHADHO CCCCc1ccc(C[N@@H+]2CC[C@]3(CCN(C)C3)C2)s1 ZINC001138755453 1129214882 /nfs/dbraw/zinc/21/48/82/1129214882.db2.gz PJONEUJPKURVFM-KRWDZBQOSA-N 1 3 292.492 3.618 20 0 CHADHO CCCCc1ccc(C[N@H+]2CC[C@]3(CCN(C)C3)C2)s1 ZINC001138755453 1129214885 /nfs/dbraw/zinc/21/48/85/1129214885.db2.gz PJONEUJPKURVFM-KRWDZBQOSA-N 1 3 292.492 3.618 20 0 CHADHO Cc1sccc1CN1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000351813359 1127209967 /nfs/dbraw/zinc/20/99/67/1127209967.db2.gz QZZFOUCGPNQHND-NVXWUHKLSA-N 1 3 290.476 3.505 20 0 CHADHO Cc1sccc1CN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000351813359 1127209970 /nfs/dbraw/zinc/20/99/70/1127209970.db2.gz QZZFOUCGPNQHND-NVXWUHKLSA-N 1 3 290.476 3.505 20 0 CHADHO CC(C)[N@H+](C)CC1CCN([C@H](C)c2ccccc2F)CC1 ZINC000590786144 1127273264 /nfs/dbraw/zinc/27/32/64/1127273264.db2.gz CIYMIKDGOKPVDH-OAHLLOKOSA-N 1 3 292.442 3.939 20 0 CHADHO CC(C)[N@@H+](C)CC1CCN([C@H](C)c2ccccc2F)CC1 ZINC000590786144 1127273265 /nfs/dbraw/zinc/27/32/65/1127273265.db2.gz CIYMIKDGOKPVDH-OAHLLOKOSA-N 1 3 292.442 3.939 20 0 CHADHO CCC[N@@H+]1CCC[C@@H]1CN[C@H](CC)c1ccc(OC)cc1 ZINC000353973020 1127282564 /nfs/dbraw/zinc/28/25/64/1127282564.db2.gz PCXYSGREXDIMJX-SJLPKXTDSA-N 1 3 290.451 3.610 20 0 CHADHO CCC[N@H+]1CCC[C@@H]1CN[C@H](CC)c1ccc(OC)cc1 ZINC000353973020 1127282568 /nfs/dbraw/zinc/28/25/68/1127282568.db2.gz PCXYSGREXDIMJX-SJLPKXTDSA-N 1 3 290.451 3.610 20 0 CHADHO CCc1cnccc1[C@H](C)[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000359292215 1127456664 /nfs/dbraw/zinc/45/66/64/1127456664.db2.gz FOPXPGCAHVKHPB-AWEZNQCLSA-N 1 3 289.467 3.558 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@@H]2CCCCc3ccccc32)C1 ZINC000360233681 1127493397 /nfs/dbraw/zinc/49/33/97/1127493397.db2.gz JHDJXUCXYBQPQT-QFBILLFUSA-N 1 3 286.463 3.776 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@@H]2CCCCc3ccccc32)C1 ZINC000360233681 1127493399 /nfs/dbraw/zinc/49/33/99/1127493399.db2.gz JHDJXUCXYBQPQT-QFBILLFUSA-N 1 3 286.463 3.776 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H]2CCCCc3ccccc32)C1 ZINC000360233681 1127493401 /nfs/dbraw/zinc/49/34/01/1127493401.db2.gz JHDJXUCXYBQPQT-QFBILLFUSA-N 1 3 286.463 3.776 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@@H]2CC[N@H+](C)[C@@H](C)C2)c1C ZINC000361080112 1127536513 /nfs/dbraw/zinc/53/65/13/1127536513.db2.gz NVPNLNYOVZYPQL-SUMWQHHRSA-N 1 3 299.462 3.665 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1C ZINC000361080112 1127536514 /nfs/dbraw/zinc/53/65/14/1127536514.db2.gz NVPNLNYOVZYPQL-SUMWQHHRSA-N 1 3 299.462 3.665 20 0 CHADHO C[C@H](N[C@@H]1CC[N@H+](C)[C@H](C)C1)c1cccc(C2CC2)c1 ZINC000294564006 1127582985 /nfs/dbraw/zinc/58/29/85/1127582985.db2.gz BNRKQKMMCICLMK-QWQRMKEZSA-N 1 3 272.436 3.697 20 0 CHADHO C[C@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc(C2CC2)c1 ZINC000294564006 1127582988 /nfs/dbraw/zinc/58/29/88/1127582988.db2.gz BNRKQKMMCICLMK-QWQRMKEZSA-N 1 3 272.436 3.697 20 0 CHADHO CCC[C@H](N[C@H]1CCC[C@H]([NH+](C)C)C1)c1ccccc1 ZINC000361966637 1127603060 /nfs/dbraw/zinc/60/30/60/1127603060.db2.gz NPZOGVTYJZEGJH-BZSNNMDCSA-N 1 3 274.452 3.990 20 0 CHADHO CCC[C@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)c1ccccc1 ZINC000361966637 1127603063 /nfs/dbraw/zinc/60/30/63/1127603063.db2.gz NPZOGVTYJZEGJH-BZSNNMDCSA-N 1 3 274.452 3.990 20 0 CHADHO C(C1CCCC1)N1CCC([NH2+][C@H]2CCC23CCC3)CC1 ZINC000669699241 1127674740 /nfs/dbraw/zinc/67/47/40/1127674740.db2.gz QGNPYELTHGNRHW-KRWDZBQOSA-N 1 3 276.468 3.563 20 0 CHADHO CC[C@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)c1ccsc1 ZINC000297645667 1127703433 /nfs/dbraw/zinc/70/34/33/1127703433.db2.gz JXTVZHRFDSSKNA-ZBFHGGJFSA-N 1 3 280.481 3.909 20 0 CHADHO Cc1ccccc1C1CC([NH2+]C[C@@H](C)CN2CCCC2)C1 ZINC000062078495 1127732401 /nfs/dbraw/zinc/73/24/01/1127732401.db2.gz RJBMFAQUEIEZDW-FAEJEUNOSA-N 1 3 286.463 3.563 20 0 CHADHO C[C@H](CSC(C)(C)C)NC1CC([NH+]2CCCCC2)C1 ZINC000366284799 1127745291 /nfs/dbraw/zinc/74/52/91/1127745291.db2.gz OXTHAFDIVVWIGX-WLYUNCDWSA-N 1 3 284.513 3.513 20 0 CHADHO Cc1cccc(C)c1CN1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000608499820 1127872316 /nfs/dbraw/zinc/87/23/16/1127872316.db2.gz SSQQYLFHOUJOEO-GOSISDBHSA-N 1 3 286.463 3.611 20 0 CHADHO Cc1ccccc1C1(N[C@H]2CC[N@@H+](C)C(C)(C)C2)CCC1 ZINC000623559234 1127961997 /nfs/dbraw/zinc/96/19/97/1127961997.db2.gz WTHIZPASVBHEBZ-INIZCTEOSA-N 1 3 286.463 3.837 20 0 CHADHO Cc1ccccc1C1(N[C@H]2CC[N@H+](C)C(C)(C)C2)CCC1 ZINC000623559234 1127962001 /nfs/dbraw/zinc/96/20/01/1127962001.db2.gz WTHIZPASVBHEBZ-INIZCTEOSA-N 1 3 286.463 3.837 20 0 CHADHO CC(C)[NH+]1CCC(N[C@@H](C)c2cc3c(s2)CCC3)CC1 ZINC000540175603 1127965886 /nfs/dbraw/zinc/96/58/86/1127965886.db2.gz IZVSCPAFNPKARL-ZDUSSCGKSA-N 1 3 292.492 3.760 20 0 CHADHO C[C@@H](CC[NH2+][C@H](c1ccccc1)C1CC1)N1CCCCC1 ZINC000544370467 1127970744 /nfs/dbraw/zinc/97/07/44/1127970744.db2.gz BIMLDWXKJQRRDR-QFBILLFUSA-N 1 3 286.463 3.992 20 0 CHADHO CC[C@@H](CN(C)CCC[NH+]1CCCC1)c1ccccc1 ZINC000467516036 1127972443 /nfs/dbraw/zinc/97/24/43/1127972443.db2.gz DRVOHECIYHPADB-KRWDZBQOSA-N 1 3 274.452 3.598 20 0 CHADHO CC[C@@H](C[N@H+](C)CCCN1CCCC1)c1ccccc1 ZINC000467516036 1127972445 /nfs/dbraw/zinc/97/24/45/1127972445.db2.gz DRVOHECIYHPADB-KRWDZBQOSA-N 1 3 274.452 3.598 20 0 CHADHO CC[C@@H](C[N@@H+](C)CCCN1CCCC1)c1ccccc1 ZINC000467516036 1127972446 /nfs/dbraw/zinc/97/24/46/1127972446.db2.gz DRVOHECIYHPADB-KRWDZBQOSA-N 1 3 274.452 3.598 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCC[C@H](N(C)C)C1)c1cccc(Cl)c1 ZINC000470363501 1128010057 /nfs/dbraw/zinc/01/00/57/1128010057.db2.gz RKRVTNOWHRKFKQ-XYPHTWIQSA-N 1 3 294.870 3.906 20 0 CHADHO Cc1ccccc1[C@@H](C(C)C)[N@H+](C)C[C@H]1CCCNC1 ZINC000469972476 1128060461 /nfs/dbraw/zinc/06/04/61/1128060461.db2.gz LKHPRDWKOCQIHE-FUHWJXTLSA-N 1 3 274.452 3.624 20 0 CHADHO Cc1ccccc1[C@@H](C(C)C)[N@@H+](C)C[C@H]1CCCNC1 ZINC000469972476 1128060466 /nfs/dbraw/zinc/06/04/66/1128060466.db2.gz LKHPRDWKOCQIHE-FUHWJXTLSA-N 1 3 274.452 3.624 20 0 CHADHO CCC[C@H](CC)[N@@H+](Cc1ccccc1)C[C@H](C)CN ZINC001257250892 1128091877 /nfs/dbraw/zinc/09/18/77/1128091877.db2.gz WTROBMQECBJQHJ-WBVHZDCISA-N 1 3 262.441 3.662 20 0 CHADHO CCC[C@H](CC)[N@H+](Cc1ccccc1)C[C@H](C)CN ZINC001257250892 1128091880 /nfs/dbraw/zinc/09/18/80/1128091880.db2.gz WTROBMQECBJQHJ-WBVHZDCISA-N 1 3 262.441 3.662 20 0 CHADHO CC(C)=C1CC[C@@H](C)C[C@@H]1N[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000924694765 1128109878 /nfs/dbraw/zinc/10/98/78/1128109878.db2.gz GYWFSAALJSSJLU-CVYDXHPNSA-N 1 3 276.468 3.728 20 0 CHADHO CC(C)=C1CC[C@@H](C)C[C@@H]1N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000924694765 1128109880 /nfs/dbraw/zinc/10/98/80/1128109880.db2.gz GYWFSAALJSSJLU-CVYDXHPNSA-N 1 3 276.468 3.728 20 0 CHADHO Cc1ccc2c(c1)[C@H](N[C@@H]1CCC[C@H]([NH+](C)C)C1)[C@@H](C)C2 ZINC000493277493 1128137873 /nfs/dbraw/zinc/13/78/73/1128137873.db2.gz RGPXTPYPDFZADH-LKCYJCQHSA-N 1 3 286.463 3.691 20 0 CHADHO Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)[C@@H](C)C2 ZINC000493277493 1128137875 /nfs/dbraw/zinc/13/78/75/1128137875.db2.gz RGPXTPYPDFZADH-LKCYJCQHSA-N 1 3 286.463 3.691 20 0 CHADHO Cc1nc([C@@H](C)NCCCCCC2CC[NH2+]CC2)cs1 ZINC000925809368 1128142992 /nfs/dbraw/zinc/14/29/92/1128142992.db2.gz UHGYUTVWLLMAMJ-CYBMUJFWSA-N 1 3 295.496 3.662 20 0 CHADHO CC(C)CCN1CCC([NH2+]C[C@@H](C)CC(F)(F)F)CC1 ZINC000926586425 1128182422 /nfs/dbraw/zinc/18/24/22/1128182422.db2.gz WZIMKKSAVFYNGG-ZDUSSCGKSA-N 1 3 294.405 3.675 20 0 CHADHO CCCC[C@H](CCC)[NH2+][C@H]1CCC[C@@H](N(C)C)C1 ZINC000715232739 1128290349 /nfs/dbraw/zinc/29/03/49/1128290349.db2.gz ACJDYXHOCILAMT-HRCADAONSA-N 1 3 254.462 3.808 20 0 CHADHO C[C@@H]1C[C@H](N[C@H]2CCCc3c4ccccc4[nH]c32)CC[N@@H+]1C ZINC000316741944 1128335666 /nfs/dbraw/zinc/33/56/66/1128335666.db2.gz IARUVLWFJKZXKS-LBTNJELSSA-N 1 3 297.446 3.618 20 0 CHADHO C[C@@H]1C[C@H](N[C@H]2CCCc3c4ccccc4[nH]c32)CC[N@H+]1C ZINC000316741944 1128335669 /nfs/dbraw/zinc/33/56/69/1128335669.db2.gz IARUVLWFJKZXKS-LBTNJELSSA-N 1 3 297.446 3.618 20 0 CHADHO CC(F)(F)CCC[NH+]1CCC(NCc2ccccc2)CC1 ZINC000930614769 1128327609 /nfs/dbraw/zinc/32/76/09/1128327609.db2.gz IABNJXXBYJFOKK-UHFFFAOYSA-N 1 3 296.405 3.676 20 0 CHADHO CCC[C@@H](C[NH2+]C[C@H]1CCN(C(C)C)C1)c1ccccc1 ZINC000561612781 1128340856 /nfs/dbraw/zinc/34/08/56/1128340856.db2.gz QNCPCJPSLXSWOE-MJGOQNOKSA-N 1 3 288.479 3.890 20 0 CHADHO Cc1ccccc1-c1ccccc1CN(C)C[C@H]1CC[NH2+]C1 ZINC001235842164 1128366973 /nfs/dbraw/zinc/36/69/73/1128366973.db2.gz MFBVTKKUCJPGOP-KRWDZBQOSA-N 1 3 294.442 3.703 20 0 CHADHO CC[NH+]1CCC(N[C@@H](c2ccc(F)cc2)C(C)(C)C)CC1 ZINC000037119051 1128416682 /nfs/dbraw/zinc/41/66/82/1128416682.db2.gz XZSJHLJMSRMCNN-KRWDZBQOSA-N 1 3 292.442 3.987 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@H](C)[C@H]2CCCC[C@H]2C)C1 ZINC000562522490 1128408079 /nfs/dbraw/zinc/40/80/79/1128408079.db2.gz GMIRLWPQSWQHHC-VQHPVUNQSA-N 1 3 266.473 3.521 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H]2CCCC[C@@H]2c2ccccc2)C1 ZINC000037644555 1128433530 /nfs/dbraw/zinc/43/35/30/1128433530.db2.gz DPTKTCXLTPRJLI-BHIYHBOVSA-N 1 3 286.463 3.644 20 0 CHADHO CCCC[C@@H]([NH2+]C[C@H]1CCN(CC)C1)c1ccccc1 ZINC000037644532 1128433629 /nfs/dbraw/zinc/43/36/29/1128433629.db2.gz SPHLVLSVLSPXGS-SJLPKXTDSA-N 1 3 274.452 3.849 20 0 CHADHO CCCC[C@@H](NC[C@H]1CC[N@H+](CC)C1)c1ccccc1 ZINC000037644532 1128433631 /nfs/dbraw/zinc/43/36/31/1128433631.db2.gz SPHLVLSVLSPXGS-SJLPKXTDSA-N 1 3 274.452 3.849 20 0 CHADHO CCCC[C@@H](NC[C@H]1CC[N@@H+](CC)C1)c1ccccc1 ZINC000037644532 1128433632 /nfs/dbraw/zinc/43/36/32/1128433632.db2.gz SPHLVLSVLSPXGS-SJLPKXTDSA-N 1 3 274.452 3.849 20 0 CHADHO NC[C@H]1CCC[N@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC000564968974 1128517851 /nfs/dbraw/zinc/51/78/51/1128517851.db2.gz NNYWDLFYMPTURL-TVRKMHQQSA-N 1 3 286.463 3.631 20 0 CHADHO NC[C@H]1CCC[N@@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC000564968974 1128517854 /nfs/dbraw/zinc/51/78/54/1128517854.db2.gz NNYWDLFYMPTURL-TVRKMHQQSA-N 1 3 286.463 3.631 20 0 CHADHO CC[NH2+]CCCN[C@@H](c1cccs1)C1CCCC1 ZINC000565651904 1128530930 /nfs/dbraw/zinc/53/09/30/1128530930.db2.gz UAABJXVKIMLYHM-OAHLLOKOSA-N 1 3 266.454 3.569 20 0 CHADHO C[C@H](CC[NH2+][C@@H]1CC[C@@H]1C(C)(C)C)N1CCCCC1 ZINC000566382215 1128543571 /nfs/dbraw/zinc/54/35/71/1128543571.db2.gz IRZKOXBLXLTGIH-OWCLPIDISA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H]2CCCC23CCCC3)C1 ZINC000556076220 1128544633 /nfs/dbraw/zinc/54/46/33/1128544633.db2.gz LIYRRDRCNBCCML-SJORKVTESA-N 1 3 278.484 3.809 20 0 CHADHO CCC1([NH2+]C2CCN(C3CCCCC3)CC2)CCC1 ZINC000569155622 1128599768 /nfs/dbraw/zinc/59/97/68/1128599768.db2.gz KEOVHDMEUKYIMU-UHFFFAOYSA-N 1 3 264.457 3.706 20 0 CHADHO CC[N@H+](Cc1ccc(F)cc1)C1CCN(CC(C)C)CC1 ZINC001258016066 1128673137 /nfs/dbraw/zinc/67/31/37/1128673137.db2.gz ADDUCPVFZSUCFQ-UHFFFAOYSA-N 1 3 292.442 3.768 20 0 CHADHO CC[N@@H+](Cc1ccc(F)cc1)C1CCN(CC(C)C)CC1 ZINC001258016066 1128673140 /nfs/dbraw/zinc/67/31/40/1128673140.db2.gz ADDUCPVFZSUCFQ-UHFFFAOYSA-N 1 3 292.442 3.768 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCNC2(CCC2)C1)C(C)(C)c1ccccc1 ZINC000643545860 1117790040 /nfs/dbraw/zinc/79/00/40/1117790040.db2.gz DKMVWXVTZRVRBX-DOTOQJQBSA-N 1 3 286.463 3.617 20 0 CHADHO C[C@@H]1CC[C@@H](C[NH3+])CN1Cc1cccc(C(C)(C)C)c1 ZINC001206767588 1117819304 /nfs/dbraw/zinc/81/93/04/1117819304.db2.gz CCTPNOYAXJPDSU-ZBFHGGJFSA-N 1 3 274.452 3.543 20 0 CHADHO C[N@@H+]1CC[C@@H](N[C@H](c2ccccc2)C2CC2)CC1(C)C ZINC000623344913 1117836588 /nfs/dbraw/zinc/83/65/88/1117836588.db2.gz IFWAWAZDODBSLU-IAGOWNOFSA-N 1 3 272.436 3.600 20 0 CHADHO C[N@H+]1CC[C@@H](N[C@H](c2ccccc2)C2CC2)CC1(C)C ZINC000623344913 1117836597 /nfs/dbraw/zinc/83/65/97/1117836597.db2.gz IFWAWAZDODBSLU-IAGOWNOFSA-N 1 3 272.436 3.600 20 0 CHADHO CCCCc1ccc(CN2C[C@H](C[NH3+])CC[C@@H]2C)cc1 ZINC001206769383 1117842625 /nfs/dbraw/zinc/84/26/25/1117842625.db2.gz OXNNFGIHVSDIRQ-YJBOKZPZSA-N 1 3 274.452 3.588 20 0 CHADHO Cc1cc(C)cc([C@@H](C)N[C@@H]2CC[N@H+](C)C(C)(C)C2)c1 ZINC000623409220 1117851181 /nfs/dbraw/zinc/85/11/81/1117851181.db2.gz URLZWCJNMVKTOJ-NVXWUHKLSA-N 1 3 274.452 3.827 20 0 CHADHO Cc1cc(C)cc([C@@H](C)N[C@@H]2CC[N@@H+](C)C(C)(C)C2)c1 ZINC000623409220 1117851186 /nfs/dbraw/zinc/85/11/86/1117851186.db2.gz URLZWCJNMVKTOJ-NVXWUHKLSA-N 1 3 274.452 3.827 20 0 CHADHO Cc1ccccc1C1(N[C@@H]2CC[N@@H+](C)C(C)(C)C2)CCC1 ZINC000623559235 1117871465 /nfs/dbraw/zinc/87/14/65/1117871465.db2.gz WTHIZPASVBHEBZ-MRXNPFEDSA-N 1 3 286.463 3.837 20 0 CHADHO Cc1ccccc1C1(N[C@@H]2CC[N@H+](C)C(C)(C)C2)CCC1 ZINC000623559235 1117871472 /nfs/dbraw/zinc/87/14/72/1117871472.db2.gz WTHIZPASVBHEBZ-MRXNPFEDSA-N 1 3 286.463 3.837 20 0 CHADHO CCCC[C@H](C)[C@@H](C)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000624123499 1117987435 /nfs/dbraw/zinc/98/74/35/1117987435.db2.gz NFQJPMOUDYVKSA-ARFHVFGLSA-N 1 3 254.462 3.523 20 0 CHADHO CC[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cc(C)ccc1C ZINC000623995612 1117966820 /nfs/dbraw/zinc/96/68/20/1117966820.db2.gz CHDBQHLOVBOBGA-RGPMPMONSA-N 1 3 286.463 3.969 20 0 CHADHO CC[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc(C)ccc1C ZINC000623995612 1117966823 /nfs/dbraw/zinc/96/68/23/1117966823.db2.gz CHDBQHLOVBOBGA-RGPMPMONSA-N 1 3 286.463 3.969 20 0 CHADHO CC(C)[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccccc1 ZINC000624121932 1117984516 /nfs/dbraw/zinc/98/45/16/1117984516.db2.gz GGPKTOFOVJGJQC-AEFFLSMTSA-N 1 3 274.452 3.705 20 0 CHADHO C[C@H](CCC(C)(C)C)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000624123959 1117985324 /nfs/dbraw/zinc/98/53/24/1117985324.db2.gz UTJJDTVWQWYLBJ-CABCVRRESA-N 1 3 254.462 3.523 20 0 CHADHO CC[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1cccc(F)c1 ZINC000624123740 1117987369 /nfs/dbraw/zinc/98/73/69/1117987369.db2.gz RVKLLIKBYSUEIZ-RHSMWYFYSA-N 1 3 278.415 3.598 20 0 CHADHO CC[C@H](NC[C@@H]1CC[N@H+](CC)C1)c1cccc(Cl)c1 ZINC000037644051 1118033213 /nfs/dbraw/zinc/03/32/13/1118033213.db2.gz VMJWEHDTNXYKHC-BBRMVZONSA-N 1 3 280.843 3.723 20 0 CHADHO CCC[C@@H]([NH2+]C[C@@H](C)CN1CCCCC1)c1cccnc1 ZINC000185081640 1118059889 /nfs/dbraw/zinc/05/98/89/1118059889.db2.gz CXIHRIISZAPJEX-SJLPKXTDSA-N 1 3 289.467 3.634 20 0 CHADHO C[C@@H](CSC(C)(C)C)[NH2+]CCCN1CCCC[C@H]1C ZINC000764635103 1118103927 /nfs/dbraw/zinc/10/39/27/1118103927.db2.gz ISWJGYKHSRJVET-LSDHHAIUSA-N 1 3 286.529 3.761 20 0 CHADHO CCCCCC[C@H](C)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000705966994 1118117521 /nfs/dbraw/zinc/11/75/21/1118117521.db2.gz KITSXIYUBBCBMN-HOTGVXAUSA-N 1 3 254.462 3.667 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)CC(C)(C)c1ccccc1)CN(C)C ZINC000312520551 1118150952 /nfs/dbraw/zinc/15/09/52/1118150952.db2.gz OKXAEAWSVBNTRK-CVEARBPZSA-N 1 3 276.468 3.530 20 0 CHADHO C[C@@H]1C[C@H](C)CN(CCC[NH2+]C2CCC(C)(C)CC2)C1 ZINC001648814932 1118223900 /nfs/dbraw/zinc/22/39/00/1118223900.db2.gz VJSXCSHNLDLDGD-IYBDPMFKSA-N 1 3 280.500 3.913 20 0 CHADHO C[NH2+]C1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1C(C)C ZINC001279435549 1118330565 /nfs/dbraw/zinc/33/05/65/1118330565.db2.gz JUQCCZHZGNYNNC-ALOPSCKCSA-N 1 3 272.436 3.525 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@@H]([NH3+])C1)c1ccc(-c2ccncc2)cc1 ZINC000580062711 1118370965 /nfs/dbraw/zinc/37/09/65/1118370965.db2.gz WNBIXMOMDNSLQL-GDIGMMSISA-N 1 3 295.430 3.669 20 0 CHADHO CC[NH+](CC)CC1CCN(Cc2cc3ccccc3[nH]2)CC1 ZINC000684021426 1118489731 /nfs/dbraw/zinc/48/97/31/1118489731.db2.gz WZLXQHFZNBOQIE-UHFFFAOYSA-N 1 3 299.462 3.722 20 0 CHADHO CC(C)[NH+](CCCNC[C@@H](C)c1ccccc1)C(C)C ZINC000580932621 1118524717 /nfs/dbraw/zinc/52/47/17/1118524717.db2.gz QPKSHTTWSVIMOR-QGZVFWFLSA-N 1 3 276.468 3.889 20 0 CHADHO C[C@H](c1cccs1)N(C)Cc1cccc2c1CC[NH2+]C2 ZINC000123935503 1118577514 /nfs/dbraw/zinc/57/75/14/1118577514.db2.gz VXMJLVMRNVMSDH-CYBMUJFWSA-N 1 3 286.444 3.587 20 0 CHADHO Clc1ccc(CN2CCC[C@@H](C3CC[NH2+]CC3)C2)s1 ZINC000656786260 1118657009 /nfs/dbraw/zinc/65/70/09/1118657009.db2.gz QZIBQJZNIPLFNU-CYBMUJFWSA-N 1 3 298.883 3.613 20 0 CHADHO CCCc1ccc(C[NH2+]C2CC(N3CCCCC3)C2)cc1 ZINC000684425719 1118701195 /nfs/dbraw/zinc/70/11/95/1118701195.db2.gz LPRINFAXZWQMHW-UHFFFAOYSA-N 1 3 286.463 3.746 20 0 CHADHO C[C@@H](c1ccc(Cl)c(Cl)c1)N1CC[C@@H](CC[NH3+])C1 ZINC000723691314 1118707893 /nfs/dbraw/zinc/70/78/93/1118707893.db2.gz MAGBJFWOEOBRSY-WDEREUQCSA-N 1 3 287.234 3.725 20 0 CHADHO C[NH2+]C[C@@H]1CCCN(CCCc2cccc3ccccc32)C1 ZINC000430669649 1118722969 /nfs/dbraw/zinc/72/29/69/1118722969.db2.gz UFYRZQVMCWBDAM-KRWDZBQOSA-N 1 3 296.458 3.704 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2C[C@@H](C)CC[C@H]2CC)C1 ZINC000430732715 1118765058 /nfs/dbraw/zinc/76/50/58/1118765058.db2.gz PYEXRVFNFFGMPE-YLFCFFPRSA-N 1 3 266.473 3.523 20 0 CHADHO CC[C@@H]1CC[C@H](C)C[C@H]1[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000430722598 1118765456 /nfs/dbraw/zinc/76/54/56/1118765456.db2.gz QRTDRHYQPMWSCY-BSDSXHPESA-N 1 3 280.500 3.911 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@@H](C)CCc1c(F)cccc1F ZINC000510688496 1118787052 /nfs/dbraw/zinc/78/70/52/1118787052.db2.gz QZHKOJRBAJCVSH-AWEZNQCLSA-N 1 3 298.421 3.606 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@H](C)CCc1c(F)cccc1F ZINC000510688497 1118787225 /nfs/dbraw/zinc/78/72/25/1118787225.db2.gz QZHKOJRBAJCVSH-CQSZACIVSA-N 1 3 298.421 3.606 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H](C)CCc1c(F)cccc1F ZINC000510724008 1118797317 /nfs/dbraw/zinc/79/73/17/1118797317.db2.gz UZZSRFGYUIFPSF-AWEZNQCLSA-N 1 3 298.421 3.607 20 0 CHADHO C[C@H]([NH2+][C@@H]1CC[C@@H]1C1CCC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000510947026 1118872367 /nfs/dbraw/zinc/87/23/67/1118872367.db2.gz XKHIRBKSUXYQQZ-RGIVZKHGSA-N 1 3 290.495 3.808 20 0 CHADHO Cc1ccc(F)c(CN2CCC(C[N@@H+](C)C(C)C)CC2)c1 ZINC000535815246 1118888741 /nfs/dbraw/zinc/88/87/41/1118888741.db2.gz RJJANQDJLNSBNV-UHFFFAOYSA-N 1 3 292.442 3.686 20 0 CHADHO Cc1ccc(F)c(CN2CCC(C[N@H+](C)C(C)C)CC2)c1 ZINC000535815246 1118888744 /nfs/dbraw/zinc/88/87/44/1118888744.db2.gz RJJANQDJLNSBNV-UHFFFAOYSA-N 1 3 292.442 3.686 20 0 CHADHO C(C[NH+]1CCC(N2CCCCC2)CC1)C1CCCC1 ZINC000525633079 1119272370 /nfs/dbraw/zinc/27/23/70/1119272370.db2.gz GUFYRDIDGUKVGX-UHFFFAOYSA-N 1 3 264.457 3.517 20 0 CHADHO C[C@@H](C[N@@H+]1CCC[C@H](N(C)C)CC1)C1CCCCC1 ZINC000569628312 1119346603 /nfs/dbraw/zinc/34/66/03/1119346603.db2.gz ALWNAOSLOBRJAD-RDJZCZTQSA-N 1 3 266.473 3.619 20 0 CHADHO C[C@@H](C[N@H+]1CCC[C@H](N(C)C)CC1)C1CCCCC1 ZINC000569628312 1119346605 /nfs/dbraw/zinc/34/66/05/1119346605.db2.gz ALWNAOSLOBRJAD-RDJZCZTQSA-N 1 3 266.473 3.619 20 0 CHADHO CC[C@@H](N[C@@H]1CC[NH2+]CC(C)(C)C1)c1ccc(OC)cc1 ZINC000635012182 1119368807 /nfs/dbraw/zinc/36/88/07/1119368807.db2.gz RPNMNCHFUUZRLP-NVXWUHKLSA-N 1 3 290.451 3.514 20 0 CHADHO CC1CCN(CCC[NH2+][C@@H]2CCc3c2cccc3F)CC1 ZINC000147617641 1119388264 /nfs/dbraw/zinc/38/82/64/1119388264.db2.gz OZJXKWGMGCFOSI-GOSISDBHSA-N 1 3 290.426 3.525 20 0 CHADHO CN1CCC[C@H]1CC[NH2+]C1(c2ccc(Cl)cc2)CCC1 ZINC000583646397 1119389636 /nfs/dbraw/zinc/38/96/36/1119389636.db2.gz YTHRDNZSMLEWSR-INIZCTEOSA-N 1 3 292.854 3.793 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@@H](C)c2cc(C)cc(C)c2)C1 ZINC000151095693 1119393238 /nfs/dbraw/zinc/39/32/38/1119393238.db2.gz HATKHDMJRKQFNL-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@@H](C)c2cc(C)cc(C)c2)C1 ZINC000151095693 1119393241 /nfs/dbraw/zinc/39/32/41/1119393241.db2.gz HATKHDMJRKQFNL-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO [NH3+]Cc1ccc(CN[C@H](c2ccccc2)C2CC2)c(F)c1 ZINC000650755033 1119413542 /nfs/dbraw/zinc/41/35/42/1119413542.db2.gz XEWNSOPAPUDQBE-GOSISDBHSA-N 1 3 284.378 3.525 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@H](C)c1csc(C)c1 ZINC000650755625 1119414034 /nfs/dbraw/zinc/41/40/34/1119414034.db2.gz JNAWXCSILSREME-CYBMUJFWSA-N 1 3 274.433 3.627 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@@H](C)c1cc(C)sc1C ZINC000650758717 1119415814 /nfs/dbraw/zinc/41/58/14/1119415814.db2.gz WJVOBUMUMQZTNM-ZDUSSCGKSA-N 1 3 288.460 3.935 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@H]1CCSc2ccccc21 ZINC000650758840 1119417493 /nfs/dbraw/zinc/41/74/93/1119417493.db2.gz YXJFEYMOCKDMML-KRWDZBQOSA-N 1 3 298.455 3.733 20 0 CHADHO C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H]2C2CCCCC2)C[C@H](C)N1 ZINC000708386427 1119423213 /nfs/dbraw/zinc/42/32/13/1119423213.db2.gz MIINRQHBYMWJFW-YALNPMBYSA-N 1 3 264.457 3.560 20 0 CHADHO C[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2C2CCCCC2)C[C@H](C)N1 ZINC000708386427 1119423216 /nfs/dbraw/zinc/42/32/16/1119423216.db2.gz MIINRQHBYMWJFW-YALNPMBYSA-N 1 3 264.457 3.560 20 0 CHADHO C[C@@H]1CC[N@@H+](C2CCC(C(C)(C)C)CC2)C[C@H]1CN ZINC000253189698 1119460116 /nfs/dbraw/zinc/46/01/16/1119460116.db2.gz KLJXZITYCNEUGT-WXLSXGNJSA-N 1 3 266.473 3.508 20 0 CHADHO C[C@@H]1CC[N@H+](C2CCC(C(C)(C)C)CC2)C[C@H]1CN ZINC000253189698 1119460118 /nfs/dbraw/zinc/46/01/18/1119460118.db2.gz KLJXZITYCNEUGT-WXLSXGNJSA-N 1 3 266.473 3.508 20 0 CHADHO CC(C)[NH2+]CCCN[C@@H](C)c1cccc2ccccc21 ZINC000584047210 1119465930 /nfs/dbraw/zinc/46/59/30/1119465930.db2.gz SWIXMVMLXONRHT-HNNXBMFYSA-N 1 3 270.420 3.879 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]C[C@H](C)Cc2ccccc2)C1 ZINC000248546365 1128852027 /nfs/dbraw/zinc/85/20/27/1128852027.db2.gz DVDMLAHUYYUNHQ-IEBWSBKVSA-N 1 3 288.479 3.575 20 0 CHADHO CCCC1(C[NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000090402414 1119544335 /nfs/dbraw/zinc/54/43/35/1119544335.db2.gz VIPDHJOPLLGDGO-UHFFFAOYSA-N 1 3 278.484 3.953 20 0 CHADHO C[C@H]1CC[C@@H](CN)C[N@@H+]1C1CCC2(CCCC2)CC1 ZINC000129785616 1119557570 /nfs/dbraw/zinc/55/75/70/1119557570.db2.gz PNEMRCWUWVFGAP-GJZGRUSLSA-N 1 3 264.457 3.549 20 0 CHADHO C[C@H]1CC[C@@H](CN)C[N@H+]1C1CCC2(CCCC2)CC1 ZINC000129785616 1119557573 /nfs/dbraw/zinc/55/75/73/1119557573.db2.gz PNEMRCWUWVFGAP-GJZGRUSLSA-N 1 3 264.457 3.549 20 0 CHADHO c1ccc([C@@H]2C[C@H]2CN2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000093563895 1119572006 /nfs/dbraw/zinc/57/20/06/1119572006.db2.gz VZXIKUFMBLGGRH-UFYCRDLUSA-N 1 3 298.474 3.740 20 0 CHADHO Cc1ccc([C@H](C)C[N@@H+]2CCC[C@H]3CN(C)CC[C@@H]32)cc1 ZINC000628281210 1119789346 /nfs/dbraw/zinc/78/93/46/1119789346.db2.gz HQSFURHVWTXQFJ-NEWSRXKRSA-N 1 3 286.463 3.515 20 0 CHADHO Cc1ccc([C@H](C)C[N@H+]2CCC[C@H]3CN(C)CC[C@@H]32)cc1 ZINC000628281210 1119789349 /nfs/dbraw/zinc/78/93/49/1119789349.db2.gz HQSFURHVWTXQFJ-NEWSRXKRSA-N 1 3 286.463 3.515 20 0 CHADHO Cc1ccc([C@H](C)C[N@@H+]2CCC[C@H]3CN(C)CC[C@H]32)cc1 ZINC000628281211 1119789390 /nfs/dbraw/zinc/78/93/90/1119789390.db2.gz HQSFURHVWTXQFJ-NZSAHSFTSA-N 1 3 286.463 3.515 20 0 CHADHO Cc1ccc([C@H](C)C[N@H+]2CCC[C@H]3CN(C)CC[C@H]32)cc1 ZINC000628281211 1119789393 /nfs/dbraw/zinc/78/93/93/1119789393.db2.gz HQSFURHVWTXQFJ-NZSAHSFTSA-N 1 3 286.463 3.515 20 0 CHADHO CC[NH+](CC)Cc1ccc(CNCc2ccncc2C)cc1 ZINC000294809678 1119798311 /nfs/dbraw/zinc/79/83/11/1119798311.db2.gz QIVRAGOBOHJVDJ-UHFFFAOYSA-N 1 3 297.446 3.522 20 0 CHADHO C[C@H]1C[C@H]([NH2+]C[C@H]2CCCCN(C)C2)CC(C)(C)C1 ZINC000708787061 1119844580 /nfs/dbraw/zinc/84/45/80/1119844580.db2.gz FMYWRDVMSYNCKW-XHSDSOJGSA-N 1 3 266.473 3.523 20 0 CHADHO CC[C@@H]1C[N@@H+]([C@@H]2CC[C@@](C)(c3ccccc3)C2)CC[C@@H]1N ZINC000647497296 1119846524 /nfs/dbraw/zinc/84/65/24/1119846524.db2.gz BXVRCVRNGWELTL-OQIJWPOYSA-N 1 3 286.463 3.556 20 0 CHADHO CC[C@@H]1C[N@H+]([C@@H]2CC[C@@](C)(c3ccccc3)C2)CC[C@@H]1N ZINC000647497296 1119846527 /nfs/dbraw/zinc/84/65/27/1119846527.db2.gz BXVRCVRNGWELTL-OQIJWPOYSA-N 1 3 286.463 3.556 20 0 CHADHO COc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H](N(C)C)C2)c(C)c1 ZINC000414121600 1119906360 /nfs/dbraw/zinc/90/63/60/1119906360.db2.gz ZWYLPYZGQVRMQV-JYJNAYRXSA-N 1 3 290.451 3.527 20 0 CHADHO C[C@@H]1C[N@H+](CC[C@H]2CCCCN2C)[C@@H]1c1ccccc1 ZINC000472590620 1119989654 /nfs/dbraw/zinc/98/96/54/1119989654.db2.gz GTRYHWVICPDSGD-NXHRZFHOSA-N 1 3 272.436 3.554 20 0 CHADHO C[C@@H]1C[N@@H+](CC[C@H]2CCCCN2C)[C@@H]1c1ccccc1 ZINC000472590620 1119989656 /nfs/dbraw/zinc/98/96/56/1119989656.db2.gz GTRYHWVICPDSGD-NXHRZFHOSA-N 1 3 272.436 3.554 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@H](C)[C@H]1CC2CCC1CC2 ZINC000381724924 1128886097 /nfs/dbraw/zinc/88/60/97/1128886097.db2.gz RZJDBNVAONZFNH-RDHHWEPZSA-N 1 3 266.473 3.521 20 0 CHADHO CCc1ccc([C@@H](C)[NH2+]C[C@H]2CCCCN(C)C2)cc1 ZINC000624120219 1120056834 /nfs/dbraw/zinc/05/68/34/1120056834.db2.gz UOKPMHVXUIUPNQ-NVXWUHKLSA-N 1 3 274.452 3.632 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@H]2CCC[C@H]2c2ccccc2)C1 ZINC000624122681 1120104193 /nfs/dbraw/zinc/10/41/93/1120104193.db2.gz YOEOFPCFBQMMFC-NEWSRXKRSA-N 1 3 286.463 3.644 20 0 CHADHO C[C@H]([NH3+])[C@H]1CCCN(Cc2ccc(C(C)(C)C)cc2)C1 ZINC000111695824 1120155023 /nfs/dbraw/zinc/15/50/23/1120155023.db2.gz NSHSDCRZGYIKTE-HOCLYGCPSA-N 1 3 274.452 3.543 20 0 CHADHO C/C(=C\c1ccc(Cl)cc1)CNC[C@H](C)C[NH+](C)C ZINC000491597881 1120210812 /nfs/dbraw/zinc/21/08/12/1120210812.db2.gz ZZMFTZDJWZBPEY-SSUFTNFISA-N 1 3 280.843 3.531 20 0 CHADHO C/C(=C\c1ccc(Cl)cc1)C[NH2+]C[C@H](C)CN(C)C ZINC000491597881 1120210813 /nfs/dbraw/zinc/21/08/13/1120210813.db2.gz ZZMFTZDJWZBPEY-SSUFTNFISA-N 1 3 280.843 3.531 20 0 CHADHO c1csc([C@@H](N[C@@H]2CCC[NH2+]CC2)C2CCCC2)c1 ZINC000129085351 1120252990 /nfs/dbraw/zinc/25/29/90/1120252990.db2.gz AAUHJEGRQOQEBZ-ZBFHGGJFSA-N 1 3 278.465 3.711 20 0 CHADHO CC(C)C[C@H](C)CN1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000499545765 1120311060 /nfs/dbraw/zinc/31/10/60/1120311060.db2.gz CYIYZYMMHNFTBY-JZXOWHBKSA-N 1 3 278.484 3.617 20 0 CHADHO CC(C)C[C@H](C)CN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000499545765 1120311064 /nfs/dbraw/zinc/31/10/64/1120311064.db2.gz CYIYZYMMHNFTBY-JZXOWHBKSA-N 1 3 278.484 3.617 20 0 CHADHO C[C@H](c1cccc2ccccc21)[N@@H+]1CC[C@](C)(CN)C1 ZINC000312432931 1120362692 /nfs/dbraw/zinc/36/26/92/1120362692.db2.gz AUOBJOZLZONBRQ-RDTXWAMCSA-N 1 3 268.404 3.572 20 0 CHADHO C[C@H](c1cccc2ccccc21)[N@H+]1CC[C@](C)(CN)C1 ZINC000312432931 1120362699 /nfs/dbraw/zinc/36/26/99/1120362699.db2.gz AUOBJOZLZONBRQ-RDTXWAMCSA-N 1 3 268.404 3.572 20 0 CHADHO C[C@@H](c1cccc2ccccc21)[N@@H+]1CC[C@@](C)(CN)C1 ZINC000312432928 1120362853 /nfs/dbraw/zinc/36/28/53/1120362853.db2.gz AUOBJOZLZONBRQ-KSSFIOAISA-N 1 3 268.404 3.572 20 0 CHADHO C[C@@H](c1cccc2ccccc21)[N@H+]1CC[C@@](C)(CN)C1 ZINC000312432928 1120362854 /nfs/dbraw/zinc/36/28/54/1120362854.db2.gz AUOBJOZLZONBRQ-KSSFIOAISA-N 1 3 268.404 3.572 20 0 CHADHO C/C(=C/c1ccccc1)CNC1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000255600903 1120384523 /nfs/dbraw/zinc/38/45/23/1120384523.db2.gz VLADPYQPTWSQAP-SQHNDAJUSA-N 1 3 284.447 3.695 20 0 CHADHO C/C(=C/c1ccccc1)CNC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000255600903 1120384526 /nfs/dbraw/zinc/38/45/26/1120384526.db2.gz VLADPYQPTWSQAP-SQHNDAJUSA-N 1 3 284.447 3.695 20 0 CHADHO C[C@H]1CC[NH2+]CC[C@H]1N[C@H]1CCCc2ccc(Cl)cc21 ZINC000629549002 1128914461 /nfs/dbraw/zinc/91/44/61/1128914461.db2.gz PJMHHRMLMGUKKA-VUCTXSBTSA-N 1 3 292.854 3.695 20 0 CHADHO CC(C)(CN[C@H]1CCC[C@H]1[NH3+])c1ccc2ccccc2c1 ZINC000629550486 1128914904 /nfs/dbraw/zinc/91/49/04/1128914904.db2.gz NENFSMARQJLPFK-MSOLQXFVSA-N 1 3 282.431 3.587 20 0 CHADHO C[C@H]([NH2+][C@@H]1CC[C@@H](C)NC1)c1cc2ccccc2s1 ZINC000629542688 1128915025 /nfs/dbraw/zinc/91/50/25/1128915025.db2.gz JIERFVVBLBKVHZ-MBNYWOFBSA-N 1 3 274.433 3.692 20 0 CHADHO C[C@@H]1CC[NH2+]CC[C@@H]1N[C@@H]1CCCc2ccc(Cl)cc21 ZINC000629556423 1128915603 /nfs/dbraw/zinc/91/56/03/1128915603.db2.gz PJMHHRMLMGUKKA-OAUYIBNBSA-N 1 3 292.854 3.695 20 0 CHADHO C[C@@H]1CC[NH2+]CC[C@H]1N[C@@H]1CCCc2ccc(Cl)cc21 ZINC000629556421 1128915949 /nfs/dbraw/zinc/91/59/49/1128915949.db2.gz PJMHHRMLMGUKKA-CSMYWGQOSA-N 1 3 292.854 3.695 20 0 CHADHO C[C@@H]([NH2+]C1CCN(C2CCCCC2)CC1)C1CCC1 ZINC000157523823 1120437908 /nfs/dbraw/zinc/43/79/08/1120437908.db2.gz SBYOGOGSBDCUTE-CQSZACIVSA-N 1 3 264.457 3.562 20 0 CHADHO CN(C[C@H]1CCC[N@H+](C)C1)[C@H]1CCc2ccc(Cl)cc21 ZINC000543203724 1120462243 /nfs/dbraw/zinc/46/22/43/1120462243.db2.gz VPTKCGWFAKFUNC-GUYCJALGSA-N 1 3 292.854 3.601 20 0 CHADHO CN(C[C@H]1CCC[N@@H+](C)C1)[C@H]1CCc2ccc(Cl)cc21 ZINC000543203724 1120462246 /nfs/dbraw/zinc/46/22/46/1120462246.db2.gz VPTKCGWFAKFUNC-GUYCJALGSA-N 1 3 292.854 3.601 20 0 CHADHO C[C@@H]([NH2+]CC(C)(C)CN(C)C)c1cccc(Cl)c1 ZINC000019905884 1120490715 /nfs/dbraw/zinc/49/07/15/1120490715.db2.gz LXNGIDWVMLMOMA-GFCCVEGCSA-N 1 3 268.832 3.578 20 0 CHADHO CSCC1CCC(N[C@@H](c2ccccc2)[C@@H](C)[NH3+])CC1 ZINC000925677810 1120565488 /nfs/dbraw/zinc/56/54/88/1120565488.db2.gz ABDBIJJNDPHOKG-RKHAHWSXSA-N 1 3 292.492 3.586 20 0 CHADHO CC1=CC[C@H](CC[N@@H+]2CC[C@]3(C2)CCCCN3)C1(C)C ZINC001222421116 1120596340 /nfs/dbraw/zinc/59/63/40/1120596340.db2.gz IOLSTFLSWHAFFY-AEFFLSMTSA-N 1 3 276.468 3.587 20 0 CHADHO CC1=CC[C@H](CC[N@H+]2CC[C@]3(C2)CCCCN3)C1(C)C ZINC001222421116 1120596344 /nfs/dbraw/zinc/59/63/44/1120596344.db2.gz IOLSTFLSWHAFFY-AEFFLSMTSA-N 1 3 276.468 3.587 20 0 CHADHO CCC(C)(C)c1ccc(C[N@@H+]2CC[C@@H](CN(C)C)C2)cc1 ZINC000509023467 1120596988 /nfs/dbraw/zinc/59/69/88/1120596988.db2.gz WDIKCXQZRJUZBM-KRWDZBQOSA-N 1 3 288.479 3.758 20 0 CHADHO CCC(C)(C)c1ccc(C[N@H+]2CC[C@@H](CN(C)C)C2)cc1 ZINC000509023467 1120596993 /nfs/dbraw/zinc/59/69/93/1120596993.db2.gz WDIKCXQZRJUZBM-KRWDZBQOSA-N 1 3 288.479 3.758 20 0 CHADHO C[C@H]1C[C@H](NCc2ccc(F)c3ccccc23)CC[N@@H+]1C ZINC000631079569 1120632844 /nfs/dbraw/zinc/63/28/44/1120632844.db2.gz IJFZTIUDRHUQQT-DZGCQCFKSA-N 1 3 286.394 3.551 20 0 CHADHO C[C@H]1C[C@H](NCc2ccc(F)c3ccccc23)CC[N@H+]1C ZINC000631079569 1120632846 /nfs/dbraw/zinc/63/28/46/1120632846.db2.gz IJFZTIUDRHUQQT-DZGCQCFKSA-N 1 3 286.394 3.551 20 0 CHADHO CCCCCN1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000253620313 1128935214 /nfs/dbraw/zinc/93/52/14/1128935214.db2.gz UEZDVZOPGUTSGG-SJORKVTESA-N 1 3 266.473 3.763 20 0 CHADHO CCCCCN1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000253620313 1128935215 /nfs/dbraw/zinc/93/52/15/1128935215.db2.gz UEZDVZOPGUTSGG-SJORKVTESA-N 1 3 266.473 3.763 20 0 CHADHO CC[C@H](C[C@@H](C)CC)[N@@H+]1CCC[C@@]2(CCCNC2)C1 ZINC000228082865 1120768283 /nfs/dbraw/zinc/76/82/83/1120768283.db2.gz PQEGAFMUQUDCHO-GVDBMIGSSA-N 1 3 266.473 3.667 20 0 CHADHO CC[C@H](C[C@@H](C)CC)[N@H+]1CCC[C@@]2(CCCNC2)C1 ZINC000228082865 1120768287 /nfs/dbraw/zinc/76/82/87/1120768287.db2.gz PQEGAFMUQUDCHO-GVDBMIGSSA-N 1 3 266.473 3.667 20 0 CHADHO c1ccc2c(c1)cccc2CN1CC[C@H](C[NH+]2CCCC2)C1 ZINC000150768463 1120843439 /nfs/dbraw/zinc/84/34/39/1120843439.db2.gz YSLOTFXQAOYRKH-QGZVFWFLSA-N 1 3 294.442 3.758 20 0 CHADHO c1ccc2c(c1)cccc2CN1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000150768488 1120843527 /nfs/dbraw/zinc/84/35/27/1120843527.db2.gz YSLOTFXQAOYRKH-KRWDZBQOSA-N 1 3 294.442 3.758 20 0 CHADHO FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663466330 1120981004 /nfs/dbraw/zinc/98/10/04/1120981004.db2.gz RAQGFPNTGVEPIY-OKZBNKHCSA-N 1 3 296.474 3.616 20 0 CHADHO CCCc1ccc([C@@H](C)[NH2+]C[C@H]2CNCCC2(F)F)cc1 ZINC000925781730 1120995092 /nfs/dbraw/zinc/99/50/92/1120995092.db2.gz ZXOUCLSEKKVGAO-CZUORRHYSA-N 1 3 296.405 3.535 20 0 CHADHO Fc1ccc2c(c1)[C@@H]([NH2+]CCCN1CCCCC1)CCC2 ZINC000344107924 1121083781 /nfs/dbraw/zinc/08/37/81/1121083781.db2.gz XGBNZBLAFLXFIU-SFHVURJKSA-N 1 3 290.426 3.669 20 0 CHADHO C[NH+](C)Cc1ccc(CN[C@H]2CCCc3occc32)cc1 ZINC000171128776 1121095125 /nfs/dbraw/zinc/09/51/25/1121095125.db2.gz HNGGOBIXPNJTKT-KRWDZBQOSA-N 1 3 284.403 3.508 20 0 CHADHO Cc1oc2ccccc2c1CCN[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000344134129 1121099544 /nfs/dbraw/zinc/09/95/44/1121099544.db2.gz OUCLHONSGGSAJC-JKSUJKDBSA-N 1 3 298.430 3.500 20 0 CHADHO Cc1oc2ccccc2c1CCN[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000344134129 1121099554 /nfs/dbraw/zinc/09/95/54/1121099554.db2.gz OUCLHONSGGSAJC-JKSUJKDBSA-N 1 3 298.430 3.500 20 0 CHADHO C[C@@H]1CCC[C@@H]([NH+]2CCC(NCCC(C)(C)F)CC2)C1 ZINC000658193022 1121213321 /nfs/dbraw/zinc/21/33/21/1121213321.db2.gz RUGNLKFROZKVML-GDBMZVCRSA-N 1 3 284.463 3.757 20 0 CHADHO C[C@@H]1CCC[C@@H](N2CCC([NH2+]CCC(C)(C)F)CC2)C1 ZINC000658193022 1121213334 /nfs/dbraw/zinc/21/33/34/1121213334.db2.gz RUGNLKFROZKVML-GDBMZVCRSA-N 1 3 284.463 3.757 20 0 CHADHO C[C@@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc2ccccc2c1 ZINC000124383128 1121293389 /nfs/dbraw/zinc/29/33/89/1121293389.db2.gz WNWDTWXULRLTTH-CVEARBPZSA-N 1 3 294.442 3.975 20 0 CHADHO C[C@@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc2ccccc2c1 ZINC000124383128 1121293395 /nfs/dbraw/zinc/29/33/95/1121293395.db2.gz WNWDTWXULRLTTH-CVEARBPZSA-N 1 3 294.442 3.975 20 0 CHADHO C[C@@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccc2ccccc2c1 ZINC000124383570 1121293423 /nfs/dbraw/zinc/29/34/23/1121293423.db2.gz WNWDTWXULRLTTH-HZPDHXFCSA-N 1 3 294.442 3.975 20 0 CHADHO C[C@@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc2ccccc2c1 ZINC000124383570 1121293428 /nfs/dbraw/zinc/29/34/28/1121293428.db2.gz WNWDTWXULRLTTH-HZPDHXFCSA-N 1 3 294.442 3.975 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H](C)[C@@H](C)c1ccccc1 ZINC000675724893 1121347721 /nfs/dbraw/zinc/34/77/21/1121347721.db2.gz PDPABNOMOQPHOV-CVEARBPZSA-N 1 3 262.441 3.500 20 0 CHADHO C[C@H](CCc1cccc(F)c1)[N@@H+]1CCC[C@@H](N(C)C)CC1 ZINC000432790536 1121353713 /nfs/dbraw/zinc/35/37/13/1121353713.db2.gz CJZMEMQHUNCDHZ-CRAIPNDOSA-N 1 3 292.442 3.563 20 0 CHADHO C[C@H](CCc1cccc(F)c1)[N@H+]1CCC[C@@H](N(C)C)CC1 ZINC000432790536 1121353720 /nfs/dbraw/zinc/35/37/20/1121353720.db2.gz CJZMEMQHUNCDHZ-CRAIPNDOSA-N 1 3 292.442 3.563 20 0 CHADHO CC[C@H](C[N@@H+]1CCC[C@H](N(C)C)CC1)c1ccccc1 ZINC000432816116 1121379496 /nfs/dbraw/zinc/37/94/96/1121379496.db2.gz NDSJZXAKLCRLQQ-AEFFLSMTSA-N 1 3 274.452 3.596 20 0 CHADHO CC[C@H](C[N@H+]1CCC[C@H](N(C)C)CC1)c1ccccc1 ZINC000432816116 1121379504 /nfs/dbraw/zinc/37/95/04/1121379504.db2.gz NDSJZXAKLCRLQQ-AEFFLSMTSA-N 1 3 274.452 3.596 20 0 CHADHO CCCC[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000512669170 1121520590 /nfs/dbraw/zinc/52/05/90/1121520590.db2.gz YZLWFGIGWQXOHV-GUDVDZBRSA-N 1 3 286.463 3.677 20 0 CHADHO Cc1cc(Nc2ccnc(C(C)(C)C)c2)cc(C)[nH+]1 ZINC001176054561 1121541373 /nfs/dbraw/zinc/54/13/73/1121541373.db2.gz GHKSQRNNALNMRF-UHFFFAOYSA-N 1 3 255.365 3.556 20 0 CHADHO CC[NH+](CC)CCCC1CCN(C/C=C/Cl)CC1 ZINC000182738420 1128996197 /nfs/dbraw/zinc/99/61/97/1128996197.db2.gz CJWCPDGUAQPCKP-UXBLZVDNSA-N 1 3 272.864 3.573 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+]C(C1CCCC1)C1CCCC1 ZINC001176364409 1121615498 /nfs/dbraw/zinc/61/54/98/1121615498.db2.gz CRRFAQWBVBSNGG-QGZVFWFLSA-N 1 3 278.484 3.809 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@H]2[N@H+](C)C[C@H]2CCCNC2)cc1 ZINC000261747656 1121690769 /nfs/dbraw/zinc/69/07/69/1121690769.db2.gz BZWODTKXUVYZDN-YTQUADARSA-N 1 3 286.463 3.563 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@H]2[N@@H+](C)C[C@H]2CCCNC2)cc1 ZINC000261747656 1121690772 /nfs/dbraw/zinc/69/07/72/1121690772.db2.gz BZWODTKXUVYZDN-YTQUADARSA-N 1 3 286.463 3.563 20 0 CHADHO C[C@H](CC[NH2+]Cc1cccc(C2CCCC2)c1)N(C)C ZINC001179265736 1121866063 /nfs/dbraw/zinc/86/60/63/1121866063.db2.gz CEPPYBGJIGUOKW-OAHLLOKOSA-N 1 3 274.452 3.774 20 0 CHADHO Cc1occc1CN1CCC(C[NH+]2CCCCCC2)CC1 ZINC001180125157 1121954284 /nfs/dbraw/zinc/95/42/84/1121954284.db2.gz SXNRBJQLJXDAAX-UHFFFAOYSA-N 1 3 290.451 3.676 20 0 CHADHO [NH3+]CCCN[C@H](c1cccc(Cl)c1)C1CCCC1 ZINC000420412112 1122005873 /nfs/dbraw/zinc/00/58/73/1122005873.db2.gz SDAQBYJURPJIMA-HNNXBMFYSA-N 1 3 266.816 3.510 20 0 CHADHO c1ccc(CN2C[C@@H]3CCCC[C@@H]([NH2+]CC4CC4)[C@H]3C2)cc1 ZINC000514103650 1122375718 /nfs/dbraw/zinc/37/57/18/1122375718.db2.gz DFQCWVVPKSHUNJ-SLFFLAALSA-N 1 3 298.474 3.677 20 0 CHADHO CC1CCC([NH2+]C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001167958456 1122444944 /nfs/dbraw/zinc/44/49/44/1122444944.db2.gz FDVRBXPPNPYXMM-DWVVOELRSA-N 1 3 276.468 3.560 20 0 CHADHO CCN(CC)Cc1cc([C@@H](C)[NH2+]CC(C)C)ccc1OC ZINC000775362999 1122528512 /nfs/dbraw/zinc/52/85/12/1122528512.db2.gz OBZBUQXOYNDCMV-OAHLLOKOSA-N 1 3 292.467 3.844 20 0 CHADHO CC[NH+](CC)CCCN1CCCC2(CCCCC2)C1 ZINC001190872547 1122559186 /nfs/dbraw/zinc/55/91/86/1122559186.db2.gz KPVKQCJBKHPORL-UHFFFAOYSA-N 1 3 266.473 3.765 20 0 CHADHO CCN(CC)CCC[N@@H+]1CCCC2(CCCCC2)C1 ZINC001190872547 1122559190 /nfs/dbraw/zinc/55/91/90/1122559190.db2.gz KPVKQCJBKHPORL-UHFFFAOYSA-N 1 3 266.473 3.765 20 0 CHADHO CCN(CC)CCC[N@H+]1CCCC2(CCCCC2)C1 ZINC001190872547 1122559194 /nfs/dbraw/zinc/55/91/94/1122559194.db2.gz KPVKQCJBKHPORL-UHFFFAOYSA-N 1 3 266.473 3.765 20 0 CHADHO CC[C@@H](C[NH2+]C[C@H]1CCN(C(C)C)C1)c1ccccc1 ZINC000516099462 1122568434 /nfs/dbraw/zinc/56/84/34/1122568434.db2.gz BHIPUAVXBWXVPA-SJORKVTESA-N 1 3 274.452 3.500 20 0 CHADHO C[C@H]1CCC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C1 ZINC001167962032 1122632799 /nfs/dbraw/zinc/63/27/99/1122632799.db2.gz SNWVWBVTEMCMAT-JWNBLRDTSA-N 1 3 276.468 3.560 20 0 CHADHO C[C@H](C[NH2+][C@@H](c1ccccc1)C1CCCC1)CN(C)C ZINC000425932360 1122664139 /nfs/dbraw/zinc/66/41/39/1122664139.db2.gz PVMUJPBXFBGCEG-QAPCUYQASA-N 1 3 274.452 3.705 20 0 CHADHO C[C@@H](Cc1ccccc1F)[NH2+]CC[C@H](C)N1CCCCC1 ZINC000437994820 1122670742 /nfs/dbraw/zinc/67/07/42/1122670742.db2.gz QFNQDKZMTHKNRD-HOTGVXAUSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@@H](Cc1ccccc1F)NCC[C@H](C)[NH+]1CCCCC1 ZINC000437994820 1122670745 /nfs/dbraw/zinc/67/07/45/1122670745.db2.gz QFNQDKZMTHKNRD-HOTGVXAUSA-N 1 3 292.442 3.611 20 0 CHADHO C[N@@H+]1CC[C@@]2(C1)CCCN(Cc1cccc3ccccc31)C2 ZINC001194504859 1122781209 /nfs/dbraw/zinc/78/12/09/1122781209.db2.gz GGSSMZGIGDUJGN-HXUWFJFHSA-N 1 3 294.442 3.758 20 0 CHADHO C[N@H+]1CC[C@@]2(C1)CCCN(Cc1cccc3ccccc31)C2 ZINC001194504859 1122781213 /nfs/dbraw/zinc/78/12/13/1122781213.db2.gz GGSSMZGIGDUJGN-HXUWFJFHSA-N 1 3 294.442 3.758 20 0 CHADHO CC(C)CC[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167966617 1122839725 /nfs/dbraw/zinc/83/97/25/1122839725.db2.gz XMJMEEGGCFAYPH-MIGBEJBISA-N 1 3 278.484 3.806 20 0 CHADHO CCC(CC)C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000154173394 1129084225 /nfs/dbraw/zinc/08/42/25/1129084225.db2.gz CLYDIOUCOQRQTC-UHFFFAOYSA-N 1 3 266.473 3.809 20 0 CHADHO CCC[N@H+]([C@H](C)CC)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167981622 1122898136 /nfs/dbraw/zinc/89/81/36/1122898136.db2.gz BWMBYXKPOVGILG-NAZJXLNTSA-N 1 3 278.484 3.902 20 0 CHADHO CCC[N@@H+]([C@H](C)CC)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167981622 1122898138 /nfs/dbraw/zinc/89/81/38/1122898138.db2.gz BWMBYXKPOVGILG-NAZJXLNTSA-N 1 3 278.484 3.902 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)c1cccc(F)c1 ZINC000187964756 1122982300 /nfs/dbraw/zinc/98/23/00/1122982300.db2.gz SXSDWFSGSASGBR-MAUKXSAKSA-N 1 3 292.442 3.987 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)c1ccoc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000309915813 1129094722 /nfs/dbraw/zinc/09/47/22/1129094722.db2.gz OCBDZMTUQPHYNQ-RYRKJORJSA-N 1 3 298.430 3.841 20 0 CHADHO C[C@@H]1[C@@H](C[NH3+])CCCN1Cc1ccc(C(C)(C)C)cc1 ZINC001205903955 1123069297 /nfs/dbraw/zinc/06/92/97/1123069297.db2.gz SGGNQUYSLJOWJB-GDBMZVCRSA-N 1 3 274.452 3.543 20 0 CHADHO CCC(C)(C)CCN1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000441400944 1123084862 /nfs/dbraw/zinc/08/48/62/1123084862.db2.gz MAVDFNACHTVGJP-WBVHZDCISA-N 1 3 278.484 3.761 20 0 CHADHO CCC(C)(C)CCN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000441400944 1123084867 /nfs/dbraw/zinc/08/48/67/1123084867.db2.gz MAVDFNACHTVGJP-WBVHZDCISA-N 1 3 278.484 3.761 20 0 CHADHO CC1([NH+]2CCCC2)CCN(CC2CCCCC2)CC1 ZINC001201401983 1123092668 /nfs/dbraw/zinc/09/26/68/1123092668.db2.gz WEZCRFKEDOJMSW-UHFFFAOYSA-N 1 3 264.457 3.517 20 0 CHADHO C1=CC[C@@H](C[N@H+]2CCCC[C@H]2CCN2CCCC2)CC1 ZINC001201418795 1123097182 /nfs/dbraw/zinc/09/71/82/1123097182.db2.gz SERFPZQKIGPJJT-MSOLQXFVSA-N 1 3 276.468 3.683 20 0 CHADHO C1=CC[C@@H](C[N@@H+]2CCCC[C@H]2CCN2CCCC2)CC1 ZINC001201418795 1123097186 /nfs/dbraw/zinc/09/71/86/1123097186.db2.gz SERFPZQKIGPJJT-MSOLQXFVSA-N 1 3 276.468 3.683 20 0 CHADHO CC(C)(C)C[NH+]1CCC2(CCN(Cc3ccoc3)C2)CC1 ZINC001201435379 1123104068 /nfs/dbraw/zinc/10/40/68/1123104068.db2.gz JWJYDDDILXKEIC-UHFFFAOYSA-N 1 3 290.451 3.614 20 0 CHADHO CC(C)[N@H+](CC1CC1)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167995487 1123107021 /nfs/dbraw/zinc/10/70/21/1123107021.db2.gz HIGWAFNRCDXYSR-JWTNVVGKSA-N 1 3 276.468 3.512 20 0 CHADHO CC(C)[N@@H+](CC1CC1)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167995487 1123107022 /nfs/dbraw/zinc/10/70/22/1123107022.db2.gz HIGWAFNRCDXYSR-JWTNVVGKSA-N 1 3 276.468 3.512 20 0 CHADHO C[C@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccc2ccccc2c1 ZINC000124383335 1123110339 /nfs/dbraw/zinc/11/03/39/1123110339.db2.gz WNWDTWXULRLTTH-JKSUJKDBSA-N 1 3 294.442 3.975 20 0 CHADHO C[C@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc2ccccc2c1 ZINC000124383335 1123110342 /nfs/dbraw/zinc/11/03/42/1123110342.db2.gz WNWDTWXULRLTTH-JKSUJKDBSA-N 1 3 294.442 3.975 20 0 CHADHO C(C1CC1)N1[C@@H]2CC[C@H]1CC([NH+]1CCCCCCC1)C2 ZINC001167995856 1123111479 /nfs/dbraw/zinc/11/14/79/1123111479.db2.gz SMKKJRVZIAUKAN-JWTNVVGKSA-N 1 3 276.468 3.658 20 0 CHADHO CC(C)C[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC001201617116 1123131522 /nfs/dbraw/zinc/13/15/22/1123131522.db2.gz DOUVRKORLQYXQN-IPMKNSEASA-N 1 3 286.463 3.533 20 0 CHADHO CCC(CC)C[NH2+]C1CCN(CC2CCCC2)CC1 ZINC001201857615 1123153161 /nfs/dbraw/zinc/15/31/61/1123153161.db2.gz PTKOABODHKMDBN-UHFFFAOYSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@H](C[NH2+]C1CCC(C(F)F)CC1)CN1CCCCC1 ZINC000442716692 1123196995 /nfs/dbraw/zinc/19/69/95/1123196995.db2.gz ONSBWRZZHQVFEN-WLYUNCDWSA-N 1 3 288.426 3.522 20 0 CHADHO [NH3+][C@H]1C[C@H](NCC2CCC(F)(F)CC2)c2ccccc21 ZINC000335022286 1123291525 /nfs/dbraw/zinc/29/15/25/1123291525.db2.gz KTHCGQIQRDJURX-GJZGRUSLSA-N 1 3 280.362 3.546 20 0 CHADHO [NH3+][C@@H]1C[C@H](NC2CCC3(CC3(F)F)CC2)c2ccccc21 ZINC000665273775 1123303425 /nfs/dbraw/zinc/30/34/25/1123303425.db2.gz DFBNVXOCHYNSHH-SKLNQHAPSA-N 1 3 292.373 3.689 20 0 CHADHO C[C@@H](CC[NH2+]C1CCC(C(F)F)CC1)N1CCCCC1 ZINC000442847742 1123342429 /nfs/dbraw/zinc/34/24/29/1123342429.db2.gz CXJHGBBNUZKUQC-NFOMZHRRSA-N 1 3 288.426 3.664 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H](C)C2CCC(F)(F)CC2)C1 ZINC000474085266 1123423865 /nfs/dbraw/zinc/42/38/65/1123423865.db2.gz WTRABZBSVGHHEQ-UONOGXRCSA-N 1 3 288.426 3.522 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](C)C2CCC(F)(F)CC2)C1 ZINC000474085267 1123424092 /nfs/dbraw/zinc/42/40/92/1123424092.db2.gz WTRABZBSVGHHEQ-ZIAGYGMSSA-N 1 3 288.426 3.522 20 0 CHADHO CCN(C)C[C@H]1CC[N@H+](C[C@@H](c2ccccc2)C(C)C)C1 ZINC000474263542 1123497057 /nfs/dbraw/zinc/49/70/57/1123497057.db2.gz CYZJBECDSLDYRY-IEBWSBKVSA-N 1 3 288.479 3.700 20 0 CHADHO CCN(C)C[C@H]1CC[N@@H+](C[C@@H](c2ccccc2)C(C)C)C1 ZINC000474263542 1123497059 /nfs/dbraw/zinc/49/70/59/1123497059.db2.gz CYZJBECDSLDYRY-IEBWSBKVSA-N 1 3 288.479 3.700 20 0 CHADHO CCC1([NH+]2CCC2)CCN(C[C@H]2C[C@@H]2c2ccccc2)CC1 ZINC000895827024 1123517298 /nfs/dbraw/zinc/51/72/98/1123517298.db2.gz BBLXCLMBQQPAAD-RTBURBONSA-N 1 3 298.474 3.740 20 0 CHADHO CCC1(N2CCC2)CC[NH+](C[C@H]2C[C@@H]2c2ccccc2)CC1 ZINC000895827024 1123517301 /nfs/dbraw/zinc/51/73/01/1123517301.db2.gz BBLXCLMBQQPAAD-RTBURBONSA-N 1 3 298.474 3.740 20 0 CHADHO CCC1(N2CCC2)CC[NH+](Cc2cccc3[nH]ccc32)CC1 ZINC000895828045 1123517335 /nfs/dbraw/zinc/51/73/35/1123517335.db2.gz SLKOZXDHYBYEQH-UHFFFAOYSA-N 1 3 297.446 3.618 20 0 CHADHO CCN1CC[C@H](C[NH2+]C[C@H](CC(C)C)c2ccccc2)C1 ZINC000474497805 1123541245 /nfs/dbraw/zinc/54/12/45/1123541245.db2.gz ZBSRURNBGHKBOI-MJGOQNOKSA-N 1 3 288.479 3.748 20 0 CHADHO C[C@@H]1CCC[C@H](CC[N@@H+]2CCC[C@H](N(C)C)CC2)C1 ZINC000429531815 1123558425 /nfs/dbraw/zinc/55/84/25/1123558425.db2.gz WRDALCDVBXFXBG-ZACQAIPSSA-N 1 3 266.473 3.619 20 0 CHADHO C[C@@H]1CCC[C@H](CC[N@H+]2CCC[C@H](N(C)C)CC2)C1 ZINC000429531815 1123558428 /nfs/dbraw/zinc/55/84/28/1123558428.db2.gz WRDALCDVBXFXBG-ZACQAIPSSA-N 1 3 266.473 3.619 20 0 CHADHO CC/C=C\CCCCCCN1CCC[C@H](C[NH2+]C)C1 ZINC001205008408 1123636428 /nfs/dbraw/zinc/63/64/28/1123636428.db2.gz AAKMUHATMXUVFR-VGOKWCNXSA-N 1 3 266.473 3.835 20 0 CHADHO CC(C)c1ccccc1C[NH2+]C[C@H]1CCCCN(C)C1 ZINC000858245845 1123639011 /nfs/dbraw/zinc/63/90/11/1123639011.db2.gz PPOKOHVDSJURPC-MRXNPFEDSA-N 1 3 274.452 3.632 20 0 CHADHO CC(C)Cc1ccccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)N2C ZINC000858443993 1123654688 /nfs/dbraw/zinc/65/46/88/1123654688.db2.gz YRJXMIVMJSTNJP-YQQQUEKLSA-N 1 3 286.463 3.600 20 0 CHADHO C[C@H]1CC[C@H](C)C1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000777127827 1123708945 /nfs/dbraw/zinc/70/89/45/1123708945.db2.gz VKILSSQLKGPZMF-GJZGRUSLSA-N 1 3 278.484 3.808 20 0 CHADHO CC[C@@H](C[N@@H+]1CCCC12CCN(C)CC2)c1ccccc1 ZINC000475116893 1123795629 /nfs/dbraw/zinc/79/56/29/1123795629.db2.gz FWMSAHPENCWKGL-KRWDZBQOSA-N 1 3 286.463 3.740 20 0 CHADHO CC[C@@H](C[N@H+]1CCCC12CCN(C)CC2)c1ccccc1 ZINC000475116893 1123795634 /nfs/dbraw/zinc/79/56/34/1123795634.db2.gz FWMSAHPENCWKGL-KRWDZBQOSA-N 1 3 286.463 3.740 20 0 CHADHO CC1(CC[NH2+][C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)CC1 ZINC000475216112 1123825577 /nfs/dbraw/zinc/82/55/77/1123825577.db2.gz MZAVGQOSRDDNKX-IPMKNSEASA-N 1 3 298.474 3.677 20 0 CHADHO Cc1ccc([C@H](CNc2cc[nH+]c(C)c2)N2CCCC2)o1 ZINC000302544129 1123972096 /nfs/dbraw/zinc/97/20/96/1123972096.db2.gz GMOIIPDJXYATPL-INIZCTEOSA-N 1 3 285.391 3.540 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)CS1 ZINC000655718433 1123997725 /nfs/dbraw/zinc/99/77/25/1123997725.db2.gz JKIUEZPRWGBBKT-ZBFHGGJFSA-N 1 3 296.524 3.657 20 0 CHADHO Cc1cccc([C@H]2CCN(CCC[NH+]3CCCCC3)C2)c1 ZINC000444619934 1124047252 /nfs/dbraw/zinc/04/72/52/1124047252.db2.gz MBGVDPATBLSLAV-IBGZPJMESA-N 1 3 286.463 3.660 20 0 CHADHO CN1CCCC[C@@H]1CC[N@H+](C)CC1(c2ccccc2)CC1 ZINC000444686190 1124050721 /nfs/dbraw/zinc/05/07/21/1124050721.db2.gz BUPSZLNDUVGHLB-GOSISDBHSA-N 1 3 286.463 3.524 20 0 CHADHO CN1CCCC[C@@H]1CC[N@@H+](C)CC1(c2ccccc2)CC1 ZINC000444686190 1124050724 /nfs/dbraw/zinc/05/07/24/1124050724.db2.gz BUPSZLNDUVGHLB-GOSISDBHSA-N 1 3 286.463 3.524 20 0 CHADHO CN(C)[C@H]1CCC[C@@H]([NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC000526988882 1124538103 /nfs/dbraw/zinc/53/81/03/1124538103.db2.gz QRDMDAYBGLDZHB-CABCVRRESA-N 1 3 282.378 3.587 20 0 CHADHO CC(C)[C@H]1C[C@@H](N[C@H]2CC[N@H+](C)[C@@H](C)C2)c2ccccc21 ZINC000448026527 1124555932 /nfs/dbraw/zinc/55/59/32/1124555932.db2.gz INWLQYCGDSGEMI-ILRDRHFLSA-N 1 3 286.463 3.943 20 0 CHADHO CC(C)[C@H]1C[C@@H](N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c2ccccc21 ZINC000448026527 1124555943 /nfs/dbraw/zinc/55/59/43/1124555943.db2.gz INWLQYCGDSGEMI-ILRDRHFLSA-N 1 3 286.463 3.943 20 0 CHADHO CC1(C)CCC[N@@H+]1CCNC1CC(c2ccccc2F)C1 ZINC000449781272 1124870774 /nfs/dbraw/zinc/87/07/74/1124870774.db2.gz HQVZNYVXEIJLCB-UHFFFAOYSA-N 1 3 290.426 3.536 20 0 CHADHO CC1(C)CCC[N@H+]1CCNC1CC(c2ccccc2F)C1 ZINC000449781272 1124870779 /nfs/dbraw/zinc/87/07/79/1124870779.db2.gz HQVZNYVXEIJLCB-UHFFFAOYSA-N 1 3 290.426 3.536 20 0 CHADHO CSC(C)(C)CC[NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000877188813 1125018655 /nfs/dbraw/zinc/01/86/55/1125018655.db2.gz HIWLLFQYFDOOBP-HUUCEWRRSA-N 1 3 298.540 3.761 20 0 CHADHO CCCc1ccc2nccc(N3CC[C@@H](C[NH+](C)C)C3)c2c1 ZINC000450432526 1125022560 /nfs/dbraw/zinc/02/25/60/1125022560.db2.gz HGBAYEUGQMBWPP-INIZCTEOSA-N 1 3 297.446 3.575 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)CCc2ccccc2Cl)C[C@@H]1C ZINC000531140605 1125196555 /nfs/dbraw/zinc/19/65/55/1125196555.db2.gz DKIUCFMUTWDKLI-HOCLYGCPSA-N 1 3 294.870 3.687 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)CCc2ccccc2Cl)C[C@@H]1C ZINC000531140605 1125196557 /nfs/dbraw/zinc/19/65/57/1125196557.db2.gz DKIUCFMUTWDKLI-HOCLYGCPSA-N 1 3 294.870 3.687 20 0 CHADHO CCC[NH+]1CCC(N[C@@H]2CCCC[C@@H]2C(F)(F)F)CC1 ZINC000037099645 1125365498 /nfs/dbraw/zinc/36/54/98/1125365498.db2.gz MIBZZGJJCWONMD-UONOGXRCSA-N 1 3 292.389 3.572 20 0 CHADHO Cc1ccccc1C1CC([NH2+]C[C@@H]2CCN(C(C)C)C2)C1 ZINC000040622763 1125388903 /nfs/dbraw/zinc/38/89/03/1125388903.db2.gz ODYWUFWKZWTMEZ-AOCRQIFASA-N 1 3 286.463 3.561 20 0 CHADHO Cc1cc(C)c(C[NH2+]CCCN2CCCCC2)cc1C ZINC000035015387 1125422521 /nfs/dbraw/zinc/42/25/21/1125422521.db2.gz IAKOUXXBTSCRPD-UHFFFAOYSA-N 1 3 274.452 3.577 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@@H+]1CCCC[C@@H](CN)C1 ZINC001206606314 1129381193 /nfs/dbraw/zinc/38/11/93/1129381193.db2.gz KDKVKLFNGQJVAA-SJORKVTESA-N 1 3 266.473 3.820 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@H+]1CCCC[C@@H](CN)C1 ZINC001206606314 1129381197 /nfs/dbraw/zinc/38/11/97/1129381197.db2.gz KDKVKLFNGQJVAA-SJORKVTESA-N 1 3 266.473 3.820 20 0 CHADHO CC[C@H]([NH2+][C@H](C)c1ccc(CN)nc1C)C1CCCCC1 ZINC000643462355 1129442329 /nfs/dbraw/zinc/44/23/29/1129442329.db2.gz FBELGJNWJQDOSE-KDOFPFPSSA-N 1 3 289.467 3.858 20 0 CHADHO CCC[C@H]([NH2+][C@@H]1CCNC2(CCC2)C1)C1CCCC1 ZINC000643547242 1129445227 /nfs/dbraw/zinc/44/52/27/1129445227.db2.gz BVJZOTOAJZBYES-CVEARBPZSA-N 1 3 264.457 3.610 20 0 CHADHO C1CC2(C1)C[C@H]([NH2+][C@H]1CCCC13CCCCC3)CCN2 ZINC000643548695 1129446231 /nfs/dbraw/zinc/44/62/31/1129446231.db2.gz TYGBRWYIVLCMOY-CVEARBPZSA-N 1 3 276.468 3.754 20 0 CHADHO CC(C)c1ccc(CCN(C2CC2)C2CC[NH2+]CC2)cc1 ZINC000647482427 1129578573 /nfs/dbraw/zinc/57/85/73/1129578573.db2.gz DXUWIRVNLFVNGA-UHFFFAOYSA-N 1 3 286.463 3.569 20 0 CHADHO CC(C)c1ccc(CC[N@H+](C2CC2)C2CCNCC2)cc1 ZINC000647482427 1129578575 /nfs/dbraw/zinc/57/85/75/1129578575.db2.gz DXUWIRVNLFVNGA-UHFFFAOYSA-N 1 3 286.463 3.569 20 0 CHADHO CC(C)c1ccc(CC[N@@H+](C2CC2)C2CCNCC2)cc1 ZINC000647482427 1129578578 /nfs/dbraw/zinc/57/85/78/1129578578.db2.gz DXUWIRVNLFVNGA-UHFFFAOYSA-N 1 3 286.463 3.569 20 0 CHADHO Clc1ccc(CN2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)s1 ZINC000647543222 1129581068 /nfs/dbraw/zinc/58/10/68/1129581068.db2.gz JQVZKISHFQNFTH-OLZOCXBDSA-N 1 3 298.883 3.613 20 0 CHADHO CCCN(C[C@@H]1CC[NH2+]C1)[C@@H](C)c1cc2ccccc2o1 ZINC000647882244 1129587248 /nfs/dbraw/zinc/58/72/48/1129587248.db2.gz ZVFNFTKSJZXHIE-LSDHHAIUSA-N 1 3 286.419 3.815 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](N[C@H]1CCCCc3ccccc31)C2 ZINC001169122765 1129700707 /nfs/dbraw/zinc/70/07/07/1129700707.db2.gz CZSXDYNMWXVQAT-ZMMAXQRCSA-N 1 3 284.447 3.669 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](N[C@H]1CCCCc3ccccc31)C2 ZINC001169122765 1129700709 /nfs/dbraw/zinc/70/07/09/1129700709.db2.gz CZSXDYNMWXVQAT-ZMMAXQRCSA-N 1 3 284.447 3.669 20 0 CHADHO CCCC[C@H]1C[C@@H]([NH2+]C(CCC)CCC)CCN1 ZINC001246196463 1131391974 /nfs/dbraw/zinc/39/19/74/1131391974.db2.gz FYUMBHLYBXIYKI-HOTGVXAUSA-N 1 3 254.462 3.856 20 0 CHADHO CC[NH+]1CCC(N[C@H](c2cccc(F)c2)C(C)C)CC1 ZINC001169229884 1129710271 /nfs/dbraw/zinc/71/02/71/1129710271.db2.gz JJDZZEDTAPEQOS-KRWDZBQOSA-N 1 3 278.415 3.597 20 0 CHADHO CC[NH+]1CCC(N[C@@H](CC(C)C)c2ccc(F)cc2)CC1 ZINC001169229857 1129710862 /nfs/dbraw/zinc/71/08/62/1129710862.db2.gz HJALNXRWVBMBDI-SFHVURJKSA-N 1 3 292.442 3.987 20 0 CHADHO CC[C@]1(C)CCC[C@H]1[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000651705935 1129745410 /nfs/dbraw/zinc/74/54/10/1129745410.db2.gz NGARFHVRZSPZMU-GVDBMIGSSA-N 1 3 266.473 3.665 20 0 CHADHO CC[N@@H+]1CC[C@H](NCc2cccc3ccsc32)[C@H](C)C1 ZINC000651863663 1129750075 /nfs/dbraw/zinc/75/00/75/1129750075.db2.gz SKNVMJWBSZJXLW-CJNGLKHVSA-N 1 3 288.460 3.721 20 0 CHADHO CC[N@H+]1CC[C@H](NCc2cccc3ccsc32)[C@H](C)C1 ZINC000651863663 1129750079 /nfs/dbraw/zinc/75/00/79/1129750079.db2.gz SKNVMJWBSZJXLW-CJNGLKHVSA-N 1 3 288.460 3.721 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N1CCCC(F)(F)[C@H](F)C1 ZINC001258908252 1129845453 /nfs/dbraw/zinc/84/54/53/1129845453.db2.gz UANVWSBSUSGFOG-ZIAGYGMSSA-N 1 3 294.405 3.566 20 0 CHADHO C[C@H]1[C@H]([NH+]2CCCC2)CCN1CC1CCC2(CC2)CC1 ZINC001170039419 1130008520 /nfs/dbraw/zinc/00/85/20/1130008520.db2.gz ONOAMIUTQDJSRZ-DOTOQJQBSA-N 1 3 276.468 3.515 20 0 CHADHO CCc1ccc(CCNC2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC2)cc1 ZINC000903097048 1130111575 /nfs/dbraw/zinc/11/15/75/1130111575.db2.gz BOESQBFDQCNUJG-CTXDPNEZSA-N 1 3 298.474 3.539 20 0 CHADHO CCc1ccc(CCNC2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)cc1 ZINC000903097048 1130111577 /nfs/dbraw/zinc/11/15/77/1130111577.db2.gz BOESQBFDQCNUJG-CTXDPNEZSA-N 1 3 298.474 3.539 20 0 CHADHO CC(C)CCC[C@H](C)N1CCC([NH3+])(CC2CC2)CC1 ZINC001170072065 1130145568 /nfs/dbraw/zinc/14/55/68/1130145568.db2.gz XPKLTZCNARVVSL-HNNXBMFYSA-N 1 3 266.473 3.795 20 0 CHADHO C[C@H]1CC[C@H](N2CCC([NH3+])(c3cccc(Cl)c3)CC2)C1 ZINC001170119608 1130275613 /nfs/dbraw/zinc/27/56/13/1130275613.db2.gz ZCZVSHRMADFLMK-BBRMVZONSA-N 1 3 292.854 3.778 20 0 CHADHO c1ccc2cc(CCN[C@H]3CC[N@@H+]4CCC[C@H]4C3)ccc2c1 ZINC000677237656 1130297010 /nfs/dbraw/zinc/29/70/10/1130297010.db2.gz MNCUIKFSQDPNGH-PMACEKPBSA-N 1 3 294.442 3.599 20 0 CHADHO c1ccc2cc(CCN[C@H]3CC[N@H+]4CCC[C@H]4C3)ccc2c1 ZINC000677237656 1130297014 /nfs/dbraw/zinc/29/70/14/1130297014.db2.gz MNCUIKFSQDPNGH-PMACEKPBSA-N 1 3 294.442 3.599 20 0 CHADHO Cc1ccccc1[C@H](N[C@@H]1CC[N@@H+]2CCC[C@H]2C1)C1CC1 ZINC000677240280 1130297687 /nfs/dbraw/zinc/29/76/87/1130297687.db2.gz FCTATHUQNBONSY-ZIFCJYIRSA-N 1 3 284.447 3.663 20 0 CHADHO Cc1ccccc1[C@H](N[C@@H]1CC[N@H+]2CCC[C@H]2C1)C1CC1 ZINC000677240280 1130297688 /nfs/dbraw/zinc/29/76/88/1130297688.db2.gz FCTATHUQNBONSY-ZIFCJYIRSA-N 1 3 284.447 3.663 20 0 CHADHO Cc1ccc2c(c1)CC[C@H]2NCC(C)(C)C[NH+]1CCCC1 ZINC000790747827 1130328972 /nfs/dbraw/zinc/32/89/72/1130328972.db2.gz GWCQTCJSGCHWNZ-GOSISDBHSA-N 1 3 286.463 3.694 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@H](c2ccccc2)C2CCC2)C1 ZINC000791133275 1130354417 /nfs/dbraw/zinc/35/44/17/1130354417.db2.gz AEDNFTMHTWEHNL-GUDVDZBRSA-N 1 3 286.463 3.990 20 0 CHADHO C[NH+](C)[C@@H]1CCC[C@@H](N[C@H](c2ccccc2)C2CCC2)C1 ZINC000791133275 1130354423 /nfs/dbraw/zinc/35/44/23/1130354423.db2.gz AEDNFTMHTWEHNL-GUDVDZBRSA-N 1 3 286.463 3.990 20 0 CHADHO CCC[NH+]1CCC(N[C@@H]2c3ccccc3CC[C@@H]2C)CC1 ZINC000678774011 1130453200 /nfs/dbraw/zinc/45/32/00/1130453200.db2.gz DBNUTUCQIWFISD-KXBFYZLASA-N 1 3 286.463 3.774 20 0 CHADHO Cc1ccc(-c2ccc(C[N@@H+]3CC4CC3(CN)C4)cc2)cc1 ZINC001235008840 1130703713 /nfs/dbraw/zinc/70/37/13/1130703713.db2.gz VVOUZFZDTBQLLM-UHFFFAOYSA-N 1 3 292.426 3.585 20 0 CHADHO Cc1ccc(-c2ccc(C[N@H+]3CC4CC3(CN)C4)cc2)cc1 ZINC001235008840 1130703716 /nfs/dbraw/zinc/70/37/16/1130703716.db2.gz VVOUZFZDTBQLLM-UHFFFAOYSA-N 1 3 292.426 3.585 20 0 CHADHO Cc1ccc([C@H](C)CCN2CCC[C@]3(CCC[NH2+]3)CC2)o1 ZINC001235041885 1130704154 /nfs/dbraw/zinc/70/41/54/1130704154.db2.gz UPJVQLRBCLVELX-CRAIPNDOSA-N 1 3 290.451 3.690 20 0 CHADHO c1cc(CN2CCC[C@]3(CCC[NH2+]3)CC2)c2c(c1)CCCC2 ZINC001235039067 1130705322 /nfs/dbraw/zinc/70/53/22/1130705322.db2.gz MUGKRIBPSYOCKW-HXUWFJFHSA-N 1 3 298.474 3.674 20 0 CHADHO CCc1cc(-n2c(-c3ccccc3)cnc2[C@H](C)N)cc[nH+]1 ZINC001170686612 1130715172 /nfs/dbraw/zinc/71/51/72/1130715172.db2.gz VJZVLBCYGBMGJP-ZDUSSCGKSA-N 1 3 292.386 3.516 20 0 CHADHO Cc1ccc([C@@H](C)CC[N@@H+]2CCCCC23CCNCC3)o1 ZINC001235191190 1130720513 /nfs/dbraw/zinc/72/05/13/1130720513.db2.gz QJMMFGFBTXKAPB-HNNXBMFYSA-N 1 3 290.451 3.690 20 0 CHADHO Cc1ccc([C@@H](C)CC[N@H+]2CCCCC23CCNCC3)o1 ZINC001235191190 1130720515 /nfs/dbraw/zinc/72/05/15/1130720515.db2.gz QJMMFGFBTXKAPB-HNNXBMFYSA-N 1 3 290.451 3.690 20 0 CHADHO CC1(C[N@H+]2CCCCC23CCNCC3)CCCCC1 ZINC001235189845 1130721554 /nfs/dbraw/zinc/72/15/54/1130721554.db2.gz DTZCHOFTHHHKAU-UHFFFAOYSA-N 1 3 264.457 3.565 20 0 CHADHO CC1(C[N@@H+]2CCCCC23CCNCC3)CCCCC1 ZINC001235189845 1130721548 /nfs/dbraw/zinc/72/15/48/1130721548.db2.gz DTZCHOFTHHHKAU-UHFFFAOYSA-N 1 3 264.457 3.565 20 0 CHADHO Clc1ccccc1CN1CCC([C@@H]2CCCC[NH2+]2)CC1 ZINC001235232378 1130726479 /nfs/dbraw/zinc/72/64/79/1130726479.db2.gz HVIQCTMTSGBWPO-KRWDZBQOSA-N 1 3 292.854 3.694 20 0 CHADHO CN(CCC[NH3+])Cc1cccc2c3ccccc3sc21 ZINC001235435551 1130743431 /nfs/dbraw/zinc/74/34/31/1130743431.db2.gz OTOYQEGMILMFMM-UHFFFAOYSA-N 1 3 284.428 3.835 20 0 CHADHO CN(CCC[NH3+])Cc1ccccc1-c1ccc(Cl)cc1 ZINC001235435356 1130744201 /nfs/dbraw/zinc/74/42/01/1130744201.db2.gz LCZZIACYQNFJEG-UHFFFAOYSA-N 1 3 288.822 3.788 20 0 CHADHO C[N@H+](Cc1ccccc1-c1ccc(F)cc1)C1CCNCC1 ZINC001235466616 1130747197 /nfs/dbraw/zinc/74/71/97/1130747197.db2.gz PZSDBBXFMOXHTF-UHFFFAOYSA-N 1 3 298.405 3.677 20 0 CHADHO C[N@@H+](Cc1ccccc1-c1ccc(F)cc1)C1CCNCC1 ZINC001235466616 1130747203 /nfs/dbraw/zinc/74/72/03/1130747203.db2.gz PZSDBBXFMOXHTF-UHFFFAOYSA-N 1 3 298.405 3.677 20 0 CHADHO CN(Cc1ccccc1-c1ccc(F)cc1)C1CC[NH2+]CC1 ZINC001235466616 1130747210 /nfs/dbraw/zinc/74/72/10/1130747210.db2.gz PZSDBBXFMOXHTF-UHFFFAOYSA-N 1 3 298.405 3.677 20 0 CHADHO CN(Cc1ccccc1Cl)CC1CC2(C1)CC[NH2+]CC2 ZINC001235664876 1130763786 /nfs/dbraw/zinc/76/37/86/1130763786.db2.gz ZDMQFDOOFYACCU-UHFFFAOYSA-N 1 3 292.854 3.552 20 0 CHADHO Cc1cccc(-c2ccc(CN3CCC[C@@H](C[NH3+])C3)cc2)c1 ZINC001235677120 1130765327 /nfs/dbraw/zinc/76/53/27/1130765327.db2.gz YLYACKINFIASGZ-SFHVURJKSA-N 1 3 294.442 3.833 20 0 CHADHO [NH3+]C[C@@H]1CCCN(Cc2ccc(-c3ccc(F)cc3)cc2)C1 ZINC001235675534 1130766625 /nfs/dbraw/zinc/76/66/25/1130766625.db2.gz ZDHQMPZNYNXOGR-INIZCTEOSA-N 1 3 298.405 3.663 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](C[N@@H+]2CC[C@@H](CN)C2)CC1 ZINC001235751230 1130775930 /nfs/dbraw/zinc/77/59/30/1130775930.db2.gz XHZLKCGVLVOYFH-MSOLQXFVSA-N 1 3 276.468 3.740 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](C[N@H+]2CC[C@@H](CN)C2)CC1 ZINC001235751230 1130775935 /nfs/dbraw/zinc/77/59/35/1130775935.db2.gz XHZLKCGVLVOYFH-MSOLQXFVSA-N 1 3 276.468 3.740 20 0 CHADHO C[NH2+]C1CCN(C[C@H](C)Cc2ccc(C(C)C)cc2)CC1 ZINC001235789945 1130779572 /nfs/dbraw/zinc/77/95/72/1130779572.db2.gz XKNGFMDJVZPQIW-MRXNPFEDSA-N 1 3 288.479 3.672 20 0 CHADHO CCCCCCc1csc(CN2CC3(CC([NH3+])C3)C2)c1 ZINC001235819763 1130783211 /nfs/dbraw/zinc/78/32/11/1130783211.db2.gz IDGVAPVISJSUPU-UHFFFAOYSA-N 1 3 292.492 3.794 20 0 CHADHO C[C@H]1CC[C@H](N)C[N@@H+]1Cc1ccccc1-c1ccccc1 ZINC001235906871 1130803836 /nfs/dbraw/zinc/80/38/36/1130803836.db2.gz OZXZIDCWXSTSBK-YJBOKZPZSA-N 1 3 280.415 3.665 20 0 CHADHO C[C@H]1CC[C@H](N)C[N@H+]1Cc1ccccc1-c1ccccc1 ZINC001235906871 1130803842 /nfs/dbraw/zinc/80/38/42/1130803842.db2.gz OZXZIDCWXSTSBK-YJBOKZPZSA-N 1 3 280.415 3.665 20 0 CHADHO c1cc(C2CCCCC2)ccc1CN1C[C@H]2CC[NH2+]C[C@H]2C1 ZINC001235934781 1130811003 /nfs/dbraw/zinc/81/10/03/1130811003.db2.gz ALEYGGSCMXRREM-UXHICEINSA-N 1 3 298.474 3.776 20 0 CHADHO Cc1ccc2ccccc2c1CN(C)C[C@@H]1CCC[NH2+]C1 ZINC001235956778 1130816262 /nfs/dbraw/zinc/81/62/62/1130816262.db2.gz HZCRMVMUDQJLBK-MRXNPFEDSA-N 1 3 282.431 3.580 20 0 CHADHO [NH3+][C@@H]1[C@@H]2CC[C@H]1CN(Cc1cccc(-c3ccsc3)c1)C2 ZINC001235960223 1130819559 /nfs/dbraw/zinc/81/95/59/1130819559.db2.gz RZHQBELTOGTWCR-ALXJQNPVSA-N 1 3 298.455 3.584 20 0 CHADHO CN(C/C=C/c1ccccc1)Cc1cc2c(s1)CC[NH2+]C2 ZINC001235964104 1130819834 /nfs/dbraw/zinc/81/98/34/1130819834.db2.gz ZFWVOVZVPPWNAM-VMPITWQZSA-N 1 3 298.455 3.539 20 0 CHADHO CC1(C)[C@@H]2C[C@H]([NH2+]C3CCN(C4CCCCC4)CC3)C[C@@H]21 ZINC001170731034 1130835973 /nfs/dbraw/zinc/83/59/73/1130835973.db2.gz NTKVDKVVXZSHEP-VBUUOAMHSA-N 1 3 290.495 3.808 20 0 CHADHO C[NH2+]C[C@H]1CCN(Cc2cccc(-c3ccccc3)c2C)C1 ZINC001236067899 1130845467 /nfs/dbraw/zinc/84/54/67/1130845467.db2.gz RKLHDEDMIFYFQW-QGZVFWFLSA-N 1 3 294.442 3.703 20 0 CHADHO COc1ccc2cc(C[N@H+](C)[C@@H]3CCCC[C@H]3N)ccc2c1 ZINC001236210673 1130887836 /nfs/dbraw/zinc/88/78/36/1130887836.db2.gz DWRPIMUWTUXGBT-RTBURBONSA-N 1 3 298.430 3.550 20 0 CHADHO COc1ccc2cc(C[N@@H+](C)[C@@H]3CCCC[C@H]3N)ccc2c1 ZINC001236210673 1130887844 /nfs/dbraw/zinc/88/78/44/1130887844.db2.gz DWRPIMUWTUXGBT-RTBURBONSA-N 1 3 298.430 3.550 20 0 CHADHO C[N@H+](Cc1c[nH]c2cc(Cl)ccc12)[C@H]1CCCC[C@H]1N ZINC001236217392 1130893172 /nfs/dbraw/zinc/89/31/72/1130893172.db2.gz OUSOCJBSSISPIC-ZBFHGGJFSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@@H+](Cc1c[nH]c2cc(Cl)ccc12)[C@H]1CCCC[C@H]1N ZINC001236217392 1130893183 /nfs/dbraw/zinc/89/31/83/1130893183.db2.gz OUSOCJBSSISPIC-ZBFHGGJFSA-N 1 3 291.826 3.523 20 0 CHADHO Cc1sc2ccccc2c1CN(C)C1(C)CC[NH2+]CC1 ZINC001236226098 1130896652 /nfs/dbraw/zinc/89/66/52/1130896652.db2.gz IDUZZWCQBQPLGZ-UHFFFAOYSA-N 1 3 288.460 3.784 20 0 CHADHO Cc1sc2ccccc2c1C[N@@H+](C)C1(C)CCNCC1 ZINC001236226098 1130896655 /nfs/dbraw/zinc/89/66/55/1130896655.db2.gz IDUZZWCQBQPLGZ-UHFFFAOYSA-N 1 3 288.460 3.784 20 0 CHADHO Cc1sc2ccccc2c1C[N@H+](C)C1(C)CCNCC1 ZINC001236226098 1130896658 /nfs/dbraw/zinc/89/66/58/1130896658.db2.gz IDUZZWCQBQPLGZ-UHFFFAOYSA-N 1 3 288.460 3.784 20 0 CHADHO CCN(Cc1c(C)ccc2ccccc21)C[C@@H]1CC[NH2+]C1 ZINC001236407728 1130931635 /nfs/dbraw/zinc/93/16/35/1130931635.db2.gz GVUGBBBRWRWCKE-MRXNPFEDSA-N 1 3 282.431 3.580 20 0 CHADHO C[C@@H]1C[C@@H]1C[N@H+](Cc1ccc(Cl)cc1)C1CCNCC1 ZINC001236452565 1130945800 /nfs/dbraw/zinc/94/58/00/1130945800.db2.gz FVTIAFFBRZFKNZ-UKRRQHHQSA-N 1 3 292.854 3.550 20 0 CHADHO C[C@@H]1C[C@@H]1C[N@@H+](Cc1ccc(Cl)cc1)C1CCNCC1 ZINC001236452565 1130945805 /nfs/dbraw/zinc/94/58/05/1130945805.db2.gz FVTIAFFBRZFKNZ-UKRRQHHQSA-N 1 3 292.854 3.550 20 0 CHADHO C[C@@H]1C[C@@H]1CN(Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001236452565 1130945811 /nfs/dbraw/zinc/94/58/11/1130945811.db2.gz FVTIAFFBRZFKNZ-UKRRQHHQSA-N 1 3 292.854 3.550 20 0 CHADHO CCC(C)(C)c1ccc(CN2CC[C@](C)(C[NH3+])C2)cc1 ZINC001236603613 1130982247 /nfs/dbraw/zinc/98/22/47/1130982247.db2.gz AZGKFKIIUASKLE-GOSISDBHSA-N 1 3 274.452 3.545 20 0 CHADHO C[C@]1(C[NH3+])CCN(Cc2cccc(-c3ccsc3)c2)C1 ZINC001236605471 1130983932 /nfs/dbraw/zinc/98/39/32/1130983932.db2.gz VJZDFTYAQAAMMP-QGZVFWFLSA-N 1 3 286.444 3.586 20 0 CHADHO CCCc1ccc(CN(C2CCC2)C2CC[NH2+]CC2)s1 ZINC001236633342 1130986731 /nfs/dbraw/zinc/98/67/31/1130986731.db2.gz GDRDOOOHVPLERP-UHFFFAOYSA-N 1 3 292.492 3.807 20 0 CHADHO CCCN(Cc1ccc(C(C)(C)C)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236834899 1131018973 /nfs/dbraw/zinc/01/89/73/1131018973.db2.gz JNQAFLHBRIJEBH-QGZVFWFLSA-N 1 3 288.479 3.806 20 0 CHADHO CCCN(Cc1cccc2sccc21)C[C@@H]1CC[NH2+]C1 ZINC001236845090 1131022154 /nfs/dbraw/zinc/02/21/54/1131022154.db2.gz YRNOGRIAORJKSZ-CQSZACIVSA-N 1 3 288.460 3.723 20 0 CHADHO Cc1ccc(-c2ccc(CN3CCC[C@@](C)(C[NH3+])C3)cc2)o1 ZINC001237059276 1131042300 /nfs/dbraw/zinc/04/23/00/1131042300.db2.gz SGHCVVLVIJTVMM-IBGZPJMESA-N 1 3 298.430 3.816 20 0 CHADHO c1ccc(C2(CN3CC[C@H]4[NH2+]CCC[C@@H]4C3)CCCC2)cc1 ZINC001237381235 1131091972 /nfs/dbraw/zinc/09/19/72/1131091972.db2.gz IIISACWTQMMXLP-IEBWSBKVSA-N 1 3 298.474 3.572 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+]3CCC4(CC4)C3)cc21 ZINC001237877484 1131146415 /nfs/dbraw/zinc/14/64/15/1131146415.db2.gz NHYXJQIVMOWNAK-UHFFFAOYSA-N 1 3 282.431 3.674 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+]3CCC4(CC4)C3)cc21 ZINC001237877484 1131146417 /nfs/dbraw/zinc/14/64/17/1131146417.db2.gz NHYXJQIVMOWNAK-UHFFFAOYSA-N 1 3 282.431 3.674 20 0 CHADHO C[C@H](N[C@@H](c1ccccc1)C1CCCCC1)C1C[NH2+]C1 ZINC000817909102 1131187940 /nfs/dbraw/zinc/18/79/40/1131187940.db2.gz XULLHUZBBPOQIN-KSSFIOAISA-N 1 3 272.436 3.506 20 0 CHADHO Cc1cc(CN(C)CC2CC[NH+](C)CC2)c(F)cc1Cl ZINC001238303928 1131190025 /nfs/dbraw/zinc/19/00/25/1131190025.db2.gz CMVPRYKJUXBMFW-UHFFFAOYSA-N 1 3 298.833 3.561 20 0 CHADHO CC(C)[C@H](N)C[NH2+][C@H](C)c1ccc(SC(F)F)cc1 ZINC000817959181 1131192076 /nfs/dbraw/zinc/19/20/76/1131192076.db2.gz PXBVLSOJFYFFRP-ZWNOBZJWSA-N 1 3 288.407 3.635 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H]1CCc2c(Cl)cccc2C1 ZINC001171006934 1131416514 /nfs/dbraw/zinc/41/65/14/1131416514.db2.gz ASCVAVNTVZUGLO-OAHLLOKOSA-N 1 3 294.870 3.519 20 0 CHADHO CC[C@@H](C)C1CCC([NH2+][C@@H]2C[C@@H](C)N[C@@H](C)C2)CC1 ZINC001246340561 1131479126 /nfs/dbraw/zinc/47/91/26/1131479126.db2.gz VCMITRHWFDVUPE-NFDFWZLDSA-N 1 3 266.473 3.710 20 0 CHADHO CC(C)([NH2+][C@H]1CCNC2(CCC2)C1)C1CCCCC1 ZINC001246354571 1131486067 /nfs/dbraw/zinc/48/60/67/1131486067.db2.gz NNXXHZPUJIMOME-HNNXBMFYSA-N 1 3 264.457 3.610 20 0 CHADHO CCCN(CCC[NH+](C)C)Cc1c[nH]c2cc(C)ccc12 ZINC001136975480 1131491512 /nfs/dbraw/zinc/49/15/12/1131491512.db2.gz IOMPNRVJNHJPDL-UHFFFAOYSA-N 1 3 287.451 3.640 20 0 CHADHO CC[C@@]1(CN[C@H](C)C[C@H](C)CC(C)C)CCC[NH2+]1 ZINC001246458548 1131507745 /nfs/dbraw/zinc/50/77/45/1131507745.db2.gz YYEICPCFZHGKSE-OAGGEKHMSA-N 1 3 254.462 3.569 20 0 CHADHO [NH3+]CCCCCCCN[C@@H](c1ccccc1)c1ccccn1 ZINC000844221712 1131537058 /nfs/dbraw/zinc/53/70/58/1131537058.db2.gz UJQVAQMVIYHDFX-IBGZPJMESA-N 1 3 297.446 3.670 20 0 CHADHO CCCCCC1CCC(N2CC[C@](C)([NH3+])C2)CC1 ZINC001246531466 1131561775 /nfs/dbraw/zinc/56/17/75/1131561775.db2.gz RGAYZCIFYXTPKS-GPANFISMSA-N 1 3 252.446 3.549 20 0 CHADHO C[C@@H]1CCC[N@@H+]([C@H]2CCNC3(CCCCC3)C2)C[C@H]1C ZINC001246577436 1131664803 /nfs/dbraw/zinc/66/48/03/1131664803.db2.gz WLTYRIYXCQNGGH-ZACQAIPSSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H]1CCC[N@H+]([C@H]2CCNC3(CCCCC3)C2)C[C@H]1C ZINC001246577436 1131664804 /nfs/dbraw/zinc/66/48/04/1131664804.db2.gz WLTYRIYXCQNGGH-ZACQAIPSSA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[N@@H+]1CC[C@@]2(C1)CCCNC2 ZINC001246602825 1131714522 /nfs/dbraw/zinc/71/45/22/1131714522.db2.gz JTCKKYDZQXYUJT-ULQDDVLXSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[N@H+]1CC[C@@]2(C1)CCCNC2 ZINC001246602825 1131714526 /nfs/dbraw/zinc/71/45/26/1131714526.db2.gz JTCKKYDZQXYUJT-ULQDDVLXSA-N 1 3 266.473 3.523 20 0 CHADHO C1CN([C@H]2CCCC3(CCCCC3)C2)[C@]2(C1)CC[NH2+]C2 ZINC001246646519 1131774721 /nfs/dbraw/zinc/77/47/21/1131774721.db2.gz FRHKVRHVDWRAGA-FUHWJXTLSA-N 1 3 276.468 3.707 20 0 CHADHO CCCCN1CCC([NH2+]Cc2ccc(SC)cc2)CC1 ZINC000037149825 1132002062 /nfs/dbraw/zinc/00/20/62/1132002062.db2.gz QOTDFBKIQBNPIF-UHFFFAOYSA-N 1 3 292.492 3.763 20 0 CHADHO CN1C(C)(C)CC([N@@H+]2CCC[C@H](C(F)F)C2)CC1(C)C ZINC001171639762 1132082716 /nfs/dbraw/zinc/08/27/16/1132082716.db2.gz SKHNVLZILUHWHG-LBPRGKRZSA-N 1 3 288.426 3.615 20 0 CHADHO CN1C(C)(C)CC([N@H+]2CCC[C@H](C(F)F)C2)CC1(C)C ZINC001171639762 1132082723 /nfs/dbraw/zinc/08/27/23/1132082723.db2.gz SKHNVLZILUHWHG-LBPRGKRZSA-N 1 3 288.426 3.615 20 0 CHADHO C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H](NCc1ccc3ccccc3c1)C2 ZINC001172107850 1132130015 /nfs/dbraw/zinc/13/00/15/1132130015.db2.gz KQJUZRAAKUFPEW-ACDBMABISA-N 1 3 294.442 3.945 20 0 CHADHO C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H](NCc1ccc3ccccc3c1)C2 ZINC001172107850 1132130018 /nfs/dbraw/zinc/13/00/18/1132130018.db2.gz KQJUZRAAKUFPEW-ACDBMABISA-N 1 3 294.442 3.945 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H]3CCCC[C@@H]31)C2 ZINC001172123497 1132135443 /nfs/dbraw/zinc/13/54/43/1132135443.db2.gz GNFDJNPAYOPJTF-AVEIZBFRSA-N 1 3 276.468 3.656 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@@H]3CCCC[C@@H]31)C2 ZINC001172123497 1132135446 /nfs/dbraw/zinc/13/54/46/1132135446.db2.gz GNFDJNPAYOPJTF-AVEIZBFRSA-N 1 3 276.468 3.656 20 0 CHADHO C[C@@H]1CC[C@@H]([NH+]2C(C)(C)CC(N)CC2(C)C)C[C@@H]1C ZINC001172360308 1132188089 /nfs/dbraw/zinc/18/80/89/1132188089.db2.gz RQGSVOXVRRRRMM-VNHYZAJKSA-N 1 3 266.473 3.791 20 0 CHADHO C[C@@H]1CC[C@H]([NH+]2C(C)(C)CC(N)CC2(C)C)C[C@H]1C ZINC001172360306 1132188521 /nfs/dbraw/zinc/18/85/21/1132188521.db2.gz RQGSVOXVRRRRMM-NFAWXSAZSA-N 1 3 266.473 3.791 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]([NH2+]CCCN3CCCC3)C2)cc1 ZINC001172536456 1132273863 /nfs/dbraw/zinc/27/38/63/1132273863.db2.gz XWRAUUVRLNALQF-MOPGFXCFSA-N 1 3 286.463 3.788 20 0 CHADHO Cc1ccc2ccccc2c1C[NH+]1CCC2(CN(C)C2)CC1 ZINC001142383937 1132378803 /nfs/dbraw/zinc/37/88/03/1132378803.db2.gz UGUAAHIGUNQRCM-UHFFFAOYSA-N 1 3 294.442 3.676 20 0 CHADHO C[N@H+](CCc1ccc(Cl)cc1)Cc1cc2cnccc2[nH]1 ZINC001232014075 1132410857 /nfs/dbraw/zinc/41/08/57/1132410857.db2.gz JGRYBBZOBLGMJD-UHFFFAOYSA-N 1 3 299.805 3.891 20 0 CHADHO C[N@@H+](CCc1ccc(Cl)cc1)Cc1cc2cnccc2[nH]1 ZINC001232014075 1132410860 /nfs/dbraw/zinc/41/08/60/1132410860.db2.gz JGRYBBZOBLGMJD-UHFFFAOYSA-N 1 3 299.805 3.891 20 0 CHADHO CCCC[C@H](CC(C)C)[NH2+]CCCN1CCCC1 ZINC001173247565 1132418754 /nfs/dbraw/zinc/41/87/54/1132418754.db2.gz WSNJMTWWPQXLPT-MRXNPFEDSA-N 1 3 254.462 3.667 20 0 CHADHO C[C@H]1CCC[N@H+](Cc2cc(F)cc(CN(C)C)c2)C[C@H]1C ZINC001232144349 1132427485 /nfs/dbraw/zinc/42/74/85/1132427485.db2.gz IYUODTKZBWVXMF-LSDHHAIUSA-N 1 3 292.442 3.755 20 0 CHADHO C[C@H]1CCC[N@@H+](Cc2cc(F)cc(CN(C)C)c2)C[C@H]1C ZINC001232144349 1132427488 /nfs/dbraw/zinc/42/74/88/1132427488.db2.gz IYUODTKZBWVXMF-LSDHHAIUSA-N 1 3 292.442 3.755 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@@H+]2CCC23CCCCC3)c1 ZINC001232145212 1132427962 /nfs/dbraw/zinc/42/79/62/1132427962.db2.gz YKTPXJQOBDQZAN-UHFFFAOYSA-N 1 3 290.426 3.796 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@H+]2CCC23CCCCC3)c1 ZINC001232145212 1132427965 /nfs/dbraw/zinc/42/79/65/1132427965.db2.gz YKTPXJQOBDQZAN-UHFFFAOYSA-N 1 3 290.426 3.796 20 0 CHADHO CC[C@H]1CC[C@@H]([NH2+]C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001173269316 1132434147 /nfs/dbraw/zinc/43/41/47/1132434147.db2.gz VLXXAQATXVSOLS-UONOGXRCSA-N 1 3 266.473 3.806 20 0 CHADHO CC[C@@H]1CC[C@H](N2CCC([NH3+])(c3cccc(F)c3)CC2)C1 ZINC001173269032 1132434229 /nfs/dbraw/zinc/43/42/29/1132434229.db2.gz FSFZCJQNLGOCLI-PBHICJAKSA-N 1 3 290.426 3.654 20 0 CHADHO CCC[N@H+](CCCN(C)C)Cc1ccnc(C(C)(C)C)c1 ZINC001232220978 1132438758 /nfs/dbraw/zinc/43/87/58/1132438758.db2.gz UHQBUKPFHMVQSY-UHFFFAOYSA-N 1 3 291.483 3.543 20 0 CHADHO CCC[N@@H+](CCCN(C)C)Cc1ccnc(C(C)(C)C)c1 ZINC001232220978 1132438762 /nfs/dbraw/zinc/43/87/62/1132438762.db2.gz UHQBUKPFHMVQSY-UHFFFAOYSA-N 1 3 291.483 3.543 20 0 CHADHO CCSC[C@@H](C)[NH2+]C1CCN(C[C@H]2CC=CCC2)CC1 ZINC001173297299 1132445507 /nfs/dbraw/zinc/44/55/07/1132445507.db2.gz CZHQZZIGLBJTHX-CVEARBPZSA-N 1 3 296.524 3.538 20 0 CHADHO CCSC[C@@H](C)NC1CC[NH+](C[C@H]2CC=CCC2)CC1 ZINC001173297299 1132445512 /nfs/dbraw/zinc/44/55/12/1132445512.db2.gz CZHQZZIGLBJTHX-CVEARBPZSA-N 1 3 296.524 3.538 20 0 CHADHO CC(C)(C)c1cc(Nc2ccc3c(c2)C[NH2+]C3)ccn1 ZINC001159240317 1132818897 /nfs/dbraw/zinc/81/88/97/1132818897.db2.gz CYWGXEXSLAGOOU-UHFFFAOYSA-N 1 3 267.376 3.726 20 0 CHADHO Cc1nc2ccc(Nc3ccc([C@H]4CC[NH2+]C4)cc3)cc2[nH]1 ZINC001159776257 1132907924 /nfs/dbraw/zinc/90/79/24/1132907924.db2.gz CSBMSSKLPNGCAK-AWEZNQCLSA-N 1 3 292.386 3.692 20 0 CHADHO CC(C)=CCCC1=CC[C@H](CN2CC(C)(C[NH3+])C2)CC1 ZINC001206712194 1133262691 /nfs/dbraw/zinc/26/26/91/1133262691.db2.gz WFOCSQMUFKZXLK-KRWDZBQOSA-N 1 3 276.468 3.740 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](C[NH+]2CCC(N)CC2)CC1 ZINC001204645973 1133470973 /nfs/dbraw/zinc/47/09/73/1133470973.db2.gz DELIROYCSHDKCA-QGZVFWFLSA-N 1 3 276.468 3.882 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](CN2CCC([NH3+])CC2)CC1 ZINC001204645973 1133470975 /nfs/dbraw/zinc/47/09/75/1133470975.db2.gz DELIROYCSHDKCA-QGZVFWFLSA-N 1 3 276.468 3.882 20 0 CHADHO C[NH2+]C[C@H]1CCCN(Cc2c(C)ccc3ccccc32)C1 ZINC001205009589 1133517324 /nfs/dbraw/zinc/51/73/24/1133517324.db2.gz YCVLFYLUUVNHNT-MRXNPFEDSA-N 1 3 282.431 3.580 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@@H+]1CCC[C@@H](N)CC1 ZINC001205087764 1133526441 /nfs/dbraw/zinc/52/64/41/1133526441.db2.gz IVOPILJQTAAZFD-HZPDHXFCSA-N 1 3 252.446 3.572 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@H+]1CCC[C@@H](N)CC1 ZINC001205087764 1133526446 /nfs/dbraw/zinc/52/64/46/1133526446.db2.gz IVOPILJQTAAZFD-HZPDHXFCSA-N 1 3 252.446 3.572 20 0 CHADHO CC(C)c1ccc(C[C@H](C)C[N@@H+]2CCC[C@@H](N)CC2)cc1 ZINC001205093896 1133527635 /nfs/dbraw/zinc/52/76/35/1133527635.db2.gz HMVDFYCDBRKKCC-QFBILLFUSA-N 1 3 288.479 3.802 20 0 CHADHO CC(C)c1ccc(C[C@H](C)C[N@H+]2CCC[C@@H](N)CC2)cc1 ZINC001205093896 1133527638 /nfs/dbraw/zinc/52/76/38/1133527638.db2.gz HMVDFYCDBRKKCC-QFBILLFUSA-N 1 3 288.479 3.802 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CCC[C@@H](N)CC1 ZINC001205093469 1133528134 /nfs/dbraw/zinc/52/81/34/1133528134.db2.gz AWGVOTBFJYRDIW-MJSXRHKHSA-N 1 3 252.446 3.716 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CCC[C@@H](N)CC1 ZINC001205093469 1133528136 /nfs/dbraw/zinc/52/81/36/1133528136.db2.gz AWGVOTBFJYRDIW-MJSXRHKHSA-N 1 3 252.446 3.716 20 0 CHADHO CCC(C)(C)c1ccc(CN2CC[C@@H](C)[C@@H](C[NH3+])C2)cc1 ZINC001205305521 1133558293 /nfs/dbraw/zinc/55/82/93/1133558293.db2.gz SBEDSRHZOUYPBR-WBVHZDCISA-N 1 3 288.479 3.791 20 0 CHADHO Cc1ccc(F)c(CN2CC[C@@H](C[NH3+])[C@@H](C)CC2)c1Cl ZINC001205617228 1133595021 /nfs/dbraw/zinc/59/50/21/1133595021.db2.gz INOPYZKAIWAQLW-AAEUAGOBSA-N 1 3 298.833 3.594 20 0 CHADHO C[C@H]1[C@H](CN)CCC[N@@H+]1CC1(c2ccccc2)CCCC1 ZINC001205901781 1133628179 /nfs/dbraw/zinc/62/81/79/1133628179.db2.gz GFRWADXMHYEEQF-IRXDYDNUSA-N 1 3 286.463 3.558 20 0 CHADHO C[C@H]1[C@H](CN)CCC[N@H+]1CC1(c2ccccc2)CCCC1 ZINC001205901781 1133628184 /nfs/dbraw/zinc/62/81/84/1133628184.db2.gz GFRWADXMHYEEQF-IRXDYDNUSA-N 1 3 286.463 3.558 20 0 CHADHO N[C@@H]1CCCC[N@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001205932294 1133633364 /nfs/dbraw/zinc/63/33/64/1133633364.db2.gz PZCMJOXNQOWKCU-OAHLLOKOSA-N 1 3 294.398 3.899 20 0 CHADHO N[C@@H]1CCCC[N@@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001205932294 1133633368 /nfs/dbraw/zinc/63/33/68/1133633368.db2.gz PZCMJOXNQOWKCU-OAHLLOKOSA-N 1 3 294.398 3.899 20 0 CHADHO CCc1cccc2c(CN3CCCC[C@](C)(C[NH3+])C3)c[nH]c21 ZINC001206547124 1133715484 /nfs/dbraw/zinc/71/54/84/1133715484.db2.gz BVZYRBFHZVBVKR-LJQANCHMSA-N 1 3 299.462 3.681 20 0 CHADHO CC(C)(C)c1cccc(CN2CCCC[C@@](C)(C[NH3+])C2)c1 ZINC001206556434 1133716914 /nfs/dbraw/zinc/71/69/14/1133716914.db2.gz RRZKFGYWILHKMT-IBGZPJMESA-N 1 3 288.479 3.935 20 0 CHADHO CSc1ccccc1CN(C(C)C)[C@@H]1CCC[NH2+]CC1 ZINC001206591354 1133722800 /nfs/dbraw/zinc/72/28/00/1133722800.db2.gz SBSKATZRKMEROE-MRXNPFEDSA-N 1 3 292.492 3.761 20 0 CHADHO COC(C)(C)CCC[C@@H](C)CC[N@@H+]1CCCC[C@@H](CN)C1 ZINC001206606582 1133726894 /nfs/dbraw/zinc/72/68/94/1133726894.db2.gz PYWPPOWDSWDBMO-SJORKVTESA-N 1 3 298.515 3.669 20 0 CHADHO COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCCC[C@@H](CN)C1 ZINC001206606582 1133726900 /nfs/dbraw/zinc/72/69/00/1133726900.db2.gz PYWPPOWDSWDBMO-SJORKVTESA-N 1 3 298.515 3.669 20 0 CHADHO C[C@H]1CC[C@H](C[NH3+])CN1Cc1cccc2c(F)cccc12 ZINC001206811442 1133751045 /nfs/dbraw/zinc/75/10/45/1133751045.db2.gz UPSZZBCVTAQHJT-UONOGXRCSA-N 1 3 286.394 3.538 20 0 CHADHO C[C@@H]1CCC(C)(C)C[C@@H]1[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC001206827459 1133753124 /nfs/dbraw/zinc/75/31/24/1133753124.db2.gz NVHJANHNKPNGDX-NXHRZFHOSA-N 1 3 292.511 3.913 20 0 CHADHO CC[C@@H](Cc1ccccc1)[NH2+][C@H](C)CCN(CC)CC ZINC001207858173 1133854463 /nfs/dbraw/zinc/85/44/63/1133854463.db2.gz GETGORICOQCKEW-AEFFLSMTSA-N 1 3 276.468 3.718 20 0 CHADHO CCN(CC)CC[C@@H](C)[NH2+][C@@H](C)Cc1ccc(C)cc1 ZINC001207858584 1133854682 /nfs/dbraw/zinc/85/46/82/1133854682.db2.gz VQSIDDMNDPRYHS-SJORKVTESA-N 1 3 276.468 3.636 20 0 CHADHO CC[C@H](Cc1ccccc1)[NH2+][C@@H](C)CCN(CC)CC ZINC001207858174 1133855229 /nfs/dbraw/zinc/85/52/29/1133855229.db2.gz GETGORICOQCKEW-FUHWJXTLSA-N 1 3 276.468 3.718 20 0 CHADHO CCN(CC)CC[C@@H](C)[NH2+]C1CCC(C)(C)CC1 ZINC001207858089 1133855567 /nfs/dbraw/zinc/85/55/67/1133855567.db2.gz DBMDWVVJFSNQPD-CQSZACIVSA-N 1 3 254.462 3.665 20 0 CHADHO Cc1cccc(CN(C[C@@H]2CCC[N@@H+](C)C2)C2CC2)c1C ZINC001208619574 1133920338 /nfs/dbraw/zinc/92/03/38/1133920338.db2.gz YGVBIFSXOOKDJZ-QGZVFWFLSA-N 1 3 286.463 3.610 20 0 CHADHO Cc1cccc(CN(C[C@@H]2CCC[N@H+](C)C2)C2CC2)c1C ZINC001208619574 1133920340 /nfs/dbraw/zinc/92/03/40/1133920340.db2.gz YGVBIFSXOOKDJZ-QGZVFWFLSA-N 1 3 286.463 3.610 20 0 CHADHO CC/C=C\CC[NH+]1CCC2(CN(Cc3ccccc3)C2)CC1 ZINC001208730110 1133935851 /nfs/dbraw/zinc/93/58/51/1133935851.db2.gz OQEZIIBLSAMZSG-ARJAWSKDSA-N 1 3 298.474 3.941 20 0 CHADHO c1ccc(CN2CC[C@H](C[N@@H+]3CCC[C@@H]4CCC[C@@H]43)C2)cc1 ZINC001208954597 1133966174 /nfs/dbraw/zinc/96/61/74/1133966174.db2.gz WOKKQFIIROXDGB-UFYCRDLUSA-N 1 3 298.474 3.773 20 0 CHADHO c1ccc(CN2CC[C@H](C[N@H+]3CCC[C@@H]4CCC[C@@H]43)C2)cc1 ZINC001208954597 1133966177 /nfs/dbraw/zinc/96/61/77/1133966177.db2.gz WOKKQFIIROXDGB-UFYCRDLUSA-N 1 3 298.474 3.773 20 0 CHADHO CCOC(C)(C)CN(C)C1CC[NH+](C2CCCCC2)CC1 ZINC001209078360 1133972195 /nfs/dbraw/zinc/97/21/95/1133972195.db2.gz IBFZDWCGMGYJHN-UHFFFAOYSA-N 1 3 296.499 3.530 20 0 CHADHO CCOC(C)(C)C[N@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001209078360 1133972198 /nfs/dbraw/zinc/97/21/98/1133972198.db2.gz IBFZDWCGMGYJHN-UHFFFAOYSA-N 1 3 296.499 3.530 20 0 CHADHO CCOC(C)(C)C[N@@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001209078360 1133972204 /nfs/dbraw/zinc/97/22/04/1133972204.db2.gz IBFZDWCGMGYJHN-UHFFFAOYSA-N 1 3 296.499 3.530 20 0 CHADHO C[NH2+]Cc1cccc(Nc2ccnc(C3CCC3)c2)c1 ZINC001211136683 1134377991 /nfs/dbraw/zinc/37/79/91/1134377991.db2.gz QJYGKDBXPKUEDP-UHFFFAOYSA-N 1 3 267.376 3.812 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)C1 ZINC000309931833 1135119462 /nfs/dbraw/zinc/11/94/62/1135119462.db2.gz WPFPVZLIVCWSDY-LFZDHENXSA-N 1 3 298.474 3.675 20 0 CHADHO Cc1csc(CN2CCCC[C@]3(CCCC[NH2+]C3)C2)c1 ZINC001222161882 1135202762 /nfs/dbraw/zinc/20/27/62/1135202762.db2.gz SFJALLXKTXSMNX-KRWDZBQOSA-N 1 3 292.492 3.802 20 0 CHADHO Cc1sccc1CN1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222171674 1135204067 /nfs/dbraw/zinc/20/40/67/1135204067.db2.gz DDNNWJIYKSLHNI-KRWDZBQOSA-N 1 3 292.492 3.802 20 0 CHADHO Cc1sccc1CN1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222171675 1135204539 /nfs/dbraw/zinc/20/45/39/1135204539.db2.gz DDNNWJIYKSLHNI-QGZVFWFLSA-N 1 3 292.492 3.802 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@@H+]1CCC[C@@]2(CCCNC2)C1 ZINC001222259385 1135215544 /nfs/dbraw/zinc/21/55/44/1135215544.db2.gz OJUCDPHUSYLGGW-ZWKOTPCHSA-N 1 3 278.484 3.835 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@H+]1CCC[C@@]2(CCCNC2)C1 ZINC001222259385 1135215549 /nfs/dbraw/zinc/21/55/49/1135215549.db2.gz OJUCDPHUSYLGGW-ZWKOTPCHSA-N 1 3 278.484 3.835 20 0 CHADHO CSc1ccccc1CN1CCC[C@]12CCC[NH2+]CC2 ZINC001222314507 1135224033 /nfs/dbraw/zinc/22/40/33/1135224033.db2.gz GYCIQEQBCLKONY-KRWDZBQOSA-N 1 3 290.476 3.517 20 0 CHADHO C[N@@H+]1CC[C@H](NCc2ccc(C3CC3)cc2)[C@H]2CCC[C@@H]21 ZINC000353688043 529806643 /nfs/dbraw/zinc/80/66/43/529806643.db2.gz NVAQHLLNIYEDMM-QYZOEREBSA-N 1 3 284.447 3.526 20 0 CHADHO C[N@H+]1CC[C@H](NCc2ccc(C3CC3)cc2)[C@H]2CCC[C@@H]21 ZINC000353688043 529806645 /nfs/dbraw/zinc/80/66/45/529806645.db2.gz NVAQHLLNIYEDMM-QYZOEREBSA-N 1 3 284.447 3.526 20 0 CHADHO C[NH+](C)CC1CCN([C@@H]2CCc3ccc(Cl)cc32)CC1 ZINC000574527035 335026934 /nfs/dbraw/zinc/02/69/34/335026934.db2.gz QUCDCHKFFARDED-QGZVFWFLSA-N 1 3 292.854 3.601 20 0 CHADHO C[C@@H]([NH3+])[C@@H]1CCCN(Cc2cccc(-c3ccccc3)c2)C1 ZINC000347045668 532984589 /nfs/dbraw/zinc/98/45/89/532984589.db2.gz NVFQACYZBBMNPR-OXQOHEQNSA-N 1 3 294.442 3.913 20 0 CHADHO CC[C@H]([NH2+]CCCN1CCCC1)c1ccc(Cl)cc1 ZINC000020547289 171244811 /nfs/dbraw/zinc/24/48/11/171244811.db2.gz NHBFZXBOMMGDKE-INIZCTEOSA-N 1 3 280.843 3.867 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H]1C[C@@H](C)CC(C)(C)C1 ZINC000021009375 171285966 /nfs/dbraw/zinc/28/59/66/171285966.db2.gz BHFCHRYQDUYFIO-HUUCEWRRSA-N 1 3 254.462 3.523 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCC(C)CC1)c1ccc(F)cc1 ZINC000021010743 171286839 /nfs/dbraw/zinc/28/68/39/171286839.db2.gz PUCVEGCNMPPIDP-OAHLLOKOSA-N 1 3 278.415 3.598 20 0 CHADHO CC1CCN(CCC[NH2+][C@@H]2C[C@H](C)CC(C)(C)C2)CC1 ZINC000021047902 171294448 /nfs/dbraw/zinc/29/44/48/171294448.db2.gz XFGJVNOJFUFHTE-DLBZAZTESA-N 1 3 280.500 3.913 20 0 CHADHO C[NH+](C)C1CCC(N[C@@H](c2ccco2)c2ccccc2)CC1 ZINC000353451693 228105212 /nfs/dbraw/zinc/10/52/12/228105212.db2.gz WXCURQHBGBPVQE-FAFZWHIHSA-N 1 3 298.430 3.831 20 0 CHADHO Cc1oc2ccccc2c1CN[C@@H]1CC[N@@H+](C)[C@H]2CCC[C@H]21 ZINC000353679005 228143949 /nfs/dbraw/zinc/14/39/49/228143949.db2.gz FRHKATPLFHUVEH-JQHSSLGASA-N 1 3 298.430 3.704 20 0 CHADHO Cc1oc2ccccc2c1CN[C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21 ZINC000353679005 228143950 /nfs/dbraw/zinc/14/39/50/228143950.db2.gz FRHKATPLFHUVEH-JQHSSLGASA-N 1 3 298.430 3.704 20 0 CHADHO Cc1oc2ccccc2c1C[NH2+][C@@H]1CCN(C)[C@H]2CCC[C@H]21 ZINC000353679005 228143952 /nfs/dbraw/zinc/14/39/52/228143952.db2.gz FRHKATPLFHUVEH-JQHSSLGASA-N 1 3 298.430 3.704 20 0 CHADHO CCCC[NH+]1CCC(N[C@@H]2CCCc3ccccc32)CC1 ZINC000037150221 260071139 /nfs/dbraw/zinc/07/11/39/260071139.db2.gz PEYHSEVWXNBSOR-LJQANCHMSA-N 1 3 286.463 3.918 20 0 CHADHO C[C@H](CCCC[NH3+])NCc1cc(Cl)sc1Cl ZINC000312755134 260197116 /nfs/dbraw/zinc/19/71/16/260197116.db2.gz BKCGIWCRTJLABS-MRVPVSSYSA-N 1 3 281.252 3.662 20 0 CHADHO C1C[C@H]2C[C@@H]([NH2+][C@H]3CCCC34CCCCC4)CCN2C1 ZINC000313037046 260240449 /nfs/dbraw/zinc/24/04/49/260240449.db2.gz NEKVRRIQQNLPFY-ULQDDVLXSA-N 1 3 276.468 3.706 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCc2c1cccc2F)CN1CCCCC1 ZINC000211628249 260308137 /nfs/dbraw/zinc/30/81/37/260308137.db2.gz DKVXLPJLJZCKDC-KDOFPFPSSA-N 1 3 290.426 3.525 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CNCc2ccc(C(F)F)cc2)cc1 ZINC000517891649 260314893 /nfs/dbraw/zinc/31/48/93/260314893.db2.gz BFBAVVKRJCGKJQ-GFCCVEGCSA-N 1 3 290.357 3.934 20 0 CHADHO C[C@@H]1C[C@H](N[C@@H]2CCC(C)(C)c3ccccc32)CC[N@@H+]1C ZINC000128104829 260372762 /nfs/dbraw/zinc/37/27/62/260372762.db2.gz DOHWLYQXHONYAW-IIDMSEBBSA-N 1 3 286.463 3.871 20 0 CHADHO C[C@@H]1C[C@H](N[C@@H]2CCC(C)(C)c3ccccc32)CC[N@H+]1C ZINC000128104829 260372764 /nfs/dbraw/zinc/37/27/64/260372764.db2.gz DOHWLYQXHONYAW-IIDMSEBBSA-N 1 3 286.463 3.871 20 0 CHADHO CC(C)c1ccc([C@@H](C)N[C@@H]2CCC[NH2+]CC2)cc1 ZINC000129023942 260381174 /nfs/dbraw/zinc/38/11/74/260381174.db2.gz WOKIJJNWYVJXJN-RHSMWYFYSA-N 1 3 260.425 3.603 20 0 CHADHO Cc1ccccc1-c1ccccc1CNCCC[NH+](C)C ZINC000449061788 261142474 /nfs/dbraw/zinc/14/24/74/261142474.db2.gz HGEOBPPGMXZNHN-UHFFFAOYSA-N 1 3 282.431 3.703 20 0 CHADHO C[C@H]1CC[C@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc21 ZINC000249059460 261239405 /nfs/dbraw/zinc/23/94/05/261239405.db2.gz ZQCLAHPYVPZRTG-ADBPUSHGSA-N 1 3 284.447 3.840 20 0 CHADHO C[C@H]1CC[C@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc21 ZINC000249059460 261239407 /nfs/dbraw/zinc/23/94/07/261239407.db2.gz ZQCLAHPYVPZRTG-ADBPUSHGSA-N 1 3 284.447 3.840 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCC(C)CC1)c1cccc(F)c1 ZINC000019230744 262174066 /nfs/dbraw/zinc/17/40/66/262174066.db2.gz CCJWVKXTQUREDR-OAHLLOKOSA-N 1 3 278.415 3.598 20 0 CHADHO CCN(CC)CCC[N@@H+]1CCCC12CCCCC2 ZINC000514088722 262186993 /nfs/dbraw/zinc/18/69/93/262186993.db2.gz IQLDAIYQBDZYDP-UHFFFAOYSA-N 1 3 252.446 3.517 20 0 CHADHO CCN(CC)CCC[N@H+]1CCCC12CCCCC2 ZINC000514088722 262186995 /nfs/dbraw/zinc/18/69/95/262186995.db2.gz IQLDAIYQBDZYDP-UHFFFAOYSA-N 1 3 252.446 3.517 20 0 CHADHO N[C@@H]1C[C@H]([NH2+]C[C@H]2CCCCC2(F)F)c2ccccc21 ZINC000390669869 262237720 /nfs/dbraw/zinc/23/77/20/262237720.db2.gz RTQRAOTVVMYRQY-DFBGVHRSSA-N 1 3 280.362 3.546 20 0 CHADHO C[C@@H]1C[N@H+](C)CC[C@H]1NCc1ccc(-c2ccccc2)cc1 ZINC000319700961 262351066 /nfs/dbraw/zinc/35/10/66/262351066.db2.gz TWZTVUHRUZIFTK-OXQOHEQNSA-N 1 3 294.442 3.783 20 0 CHADHO C[C@@H]1C[N@@H+](C)CC[C@H]1NCc1ccc(-c2ccccc2)cc1 ZINC000319700961 262351067 /nfs/dbraw/zinc/35/10/67/262351067.db2.gz TWZTVUHRUZIFTK-OXQOHEQNSA-N 1 3 294.442 3.783 20 0 CHADHO CCC[N@H+](Cc1ccc(C2CC2)cc1)C1CCNCC1 ZINC000414648241 263021019 /nfs/dbraw/zinc/02/10/19/263021019.db2.gz ASTWRXDMGNWDBJ-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO CCC[N@@H+](Cc1ccc(C2CC2)cc1)C1CCNCC1 ZINC000414648241 263021020 /nfs/dbraw/zinc/02/10/20/263021020.db2.gz ASTWRXDMGNWDBJ-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO CCCN(Cc1ccc(C2CC2)cc1)C1CC[NH2+]CC1 ZINC000414648241 263021021 /nfs/dbraw/zinc/02/10/21/263021021.db2.gz ASTWRXDMGNWDBJ-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO CCC[C@@H](CNCC([NH3+])(CC)CC)c1ccccc1 ZINC000414804433 263051961 /nfs/dbraw/zinc/05/19/61/263051961.db2.gz DYCCCNQHQIYYHW-INIZCTEOSA-N 1 3 262.441 3.677 20 0 CHADHO Cc1ccc(C)c(CNCc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000414804914 263051970 /nfs/dbraw/zinc/05/19/70/263051970.db2.gz FMYULUXZCLSMKM-HNNXBMFYSA-N 1 3 268.404 3.613 20 0 CHADHO CCc1cc(OC)ccc1CNCc1ccc([C@@H](C)[NH3+])cc1 ZINC000414808221 263052384 /nfs/dbraw/zinc/05/23/84/263052384.db2.gz DVCNRJMNBQBWJN-CQSZACIVSA-N 1 3 298.430 3.567 20 0 CHADHO Cc1cc(C)c(CNCc2ccc([C@H](C)[NH3+])cc2)cc1C ZINC000414809261 263052760 /nfs/dbraw/zinc/05/27/60/263052760.db2.gz LVFSNNRAOQWACT-INIZCTEOSA-N 1 3 282.431 3.921 20 0 CHADHO C[C@H]([NH3+])c1ccc(CNCc2cc(Cl)cs2)cc1 ZINC000414816526 263053679 /nfs/dbraw/zinc/05/36/79/263053679.db2.gz PYAIGXVWYUBIQU-JTQLQIEISA-N 1 3 280.824 3.711 20 0 CHADHO CC(C)Oc1ccc(CNCc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000414816221 263054006 /nfs/dbraw/zinc/05/40/06/263054006.db2.gz ZNYBJZWOLITPQE-OAHLLOKOSA-N 1 3 298.430 3.783 20 0 CHADHO Cc1ccc(-c2ccc(CN[C@@H](C)CC[NH3+])s2)cc1 ZINC000414887573 263100597 /nfs/dbraw/zinc/10/05/97/263100597.db2.gz QSJKCCFGAMFCKP-ZDUSSCGKSA-N 1 3 274.433 3.550 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@H]2[NH2+]C[C@@]2(C)CCCNC2)cc1 ZINC000414903626 263111431 /nfs/dbraw/zinc/11/14/31/263111431.db2.gz ISBSVDNDTUICAS-OTWHNJEPSA-N 1 3 286.463 3.610 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+]CC2CCC(c3ccccc3)CC2)C1 ZINC000414919387 263124008 /nfs/dbraw/zinc/12/40/08/263124008.db2.gz UROYYNVHCMRBAK-AWRGBYNESA-N 1 3 286.463 3.820 20 0 CHADHO C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@@H]2CCC[C@H](N)C2)C1 ZINC000414925134 263129628 /nfs/dbraw/zinc/12/96/28/263129628.db2.gz LAPAMEMQCHYMHW-YYTXDEJISA-N 1 3 286.463 3.818 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@@H]2c2ccc(Cl)cc2)C1 ZINC000414928136 263134509 /nfs/dbraw/zinc/13/45/09/263134509.db2.gz PWEMPLRMDAXYQO-YYIAUSFCSA-N 1 3 292.854 3.836 20 0 CHADHO CC1(c2ccccc2)CCC([NH2+][C@H]2CCC[C@H](N)C2)CC1 ZINC000414928990 263135105 /nfs/dbraw/zinc/13/51/05/263135105.db2.gz QXBDKGSACGNRQD-BMHOQUIDSA-N 1 3 286.463 3.746 20 0 CHADHO c1cc(C2CC2)ccc1CN1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000415041065 263257377 /nfs/dbraw/zinc/25/73/77/263257377.db2.gz KVFUGSVVCPMQFV-MOPGFXCFSA-N 1 3 284.447 3.528 20 0 CHADHO Cc1cccc(CN[C@H](CCC[NH3+])c2ccccc2)c1 ZINC000415063334 263258686 /nfs/dbraw/zinc/25/86/86/263258686.db2.gz HWOVCZKWZINSSC-GOSISDBHSA-N 1 3 268.404 3.565 20 0 CHADHO Cc1cccc([C@H](NC[C@H]2CCC[NH2+]C2)C(C)(C)C)c1 ZINC000415086908 263271846 /nfs/dbraw/zinc/27/18/46/263271846.db2.gz VHRVVASSLIQBKB-RDJZCZTQSA-N 1 3 274.452 3.671 20 0 CHADHO Cc1cccc([C@H]([NH2+]C[C@H]2CCCNC2)C(C)(C)C)c1 ZINC000415086908 263271848 /nfs/dbraw/zinc/27/18/48/263271848.db2.gz VHRVVASSLIQBKB-RDJZCZTQSA-N 1 3 274.452 3.671 20 0 CHADHO C[C@H](C[C@H]1CCC[NH2+]1)NCCc1csc2ccccc12 ZINC000415090737 263272456 /nfs/dbraw/zinc/27/24/56/263272456.db2.gz ZKPHAYJELKZCKO-UKRRQHHQSA-N 1 3 288.460 3.564 20 0 CHADHO C[C@H](CCNCC(C)(C)[NH3+])c1cccc(C(F)(F)F)c1 ZINC000415089164 263272661 /nfs/dbraw/zinc/27/26/61/263272661.db2.gz NCLUDPQVOMTYMK-LLVKDONJSA-N 1 3 288.357 3.526 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)N[C@H]1CCC[NH2+]CC1 ZINC000415115609 263274735 /nfs/dbraw/zinc/27/47/35/263274735.db2.gz UGUITFRJCMFVOA-WMZOPIPTSA-N 1 3 274.452 3.814 20 0 CHADHO CC[C@H](N[C@H]1CCC[C@H]1C[NH3+])c1ccc(Cl)cc1 ZINC000251112350 264270634 /nfs/dbraw/zinc/27/06/34/264270634.db2.gz UNFMLHQVANSRCL-QEJZJMRPSA-N 1 3 266.816 3.508 20 0 CHADHO CC[C@@H](N[C@H]1CCC[NH2+]CC1)c1ccc(Cl)cc1 ZINC000129001248 264312659 /nfs/dbraw/zinc/31/26/59/264312659.db2.gz UCXQZXFJWXRXSA-LSDHHAIUSA-N 1 3 266.816 3.523 20 0 CHADHO CC(C)CC1(CN[C@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC000391948177 265032183 /nfs/dbraw/zinc/03/21/83/265032183.db2.gz XUTQBFYVKDUDBU-HOTGVXAUSA-N 1 3 258.409 3.547 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]C[C@@H]2C[C@@H]2c2ccccc2)C1 ZINC000348240490 265147343 /nfs/dbraw/zinc/14/73/43/265147343.db2.gz IBIXIGBDIHYSNH-NZSAHSFTSA-N 1 3 286.463 3.500 20 0 CHADHO CC(C)(C)[C@H]1C[C@@H](NC2CC([NH+]3CCCCC3)C2)CS1 ZINC000369671084 267258072 /nfs/dbraw/zinc/25/80/72/267258072.db2.gz ROLSTCNGPMLYRB-GYTBAZASSA-N 1 3 296.524 3.513 20 0 CHADHO C([NH2+]C1CCN(C2CCCCC2)CC1)[C@@H]1CCCSC1 ZINC000376817458 268020552 /nfs/dbraw/zinc/02/05/52/268020552.db2.gz BTHQSISJXBWJFI-HNNXBMFYSA-N 1 3 296.524 3.516 20 0 CHADHO CN1CCC[C@H]1CC[N@H+](C)Cc1ccc2ccccc2c1 ZINC000534022433 328033011 /nfs/dbraw/zinc/03/30/11/328033011.db2.gz MDMUMAQRPYABSV-IBGZPJMESA-N 1 3 282.431 3.756 20 0 CHADHO CN1CCC[C@H]1CC[N@@H+](C)Cc1ccc2ccccc2c1 ZINC000534022433 328033012 /nfs/dbraw/zinc/03/30/12/328033012.db2.gz MDMUMAQRPYABSV-IBGZPJMESA-N 1 3 282.431 3.756 20 0 CHADHO C[C@@H]1C[C@H]([NH3+])CCN1Cc1cccc(-c2ccccc2)c1 ZINC000571578189 328134847 /nfs/dbraw/zinc/13/48/47/328134847.db2.gz GKKVZHHZFNPFOA-DNVCBOLYSA-N 1 3 280.415 3.665 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+]CCC2CCCCCC2)C1 ZINC000394621104 329125965 /nfs/dbraw/zinc/12/59/65/329125965.db2.gz LNNLSBNGBAZEHZ-KRWDZBQOSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@@H](C[C@H]1CCCCC[NH2+]1)NCCCc1cccs1 ZINC000582719738 329129870 /nfs/dbraw/zinc/12/98/70/329129870.db2.gz VDEBUZVLALMLOX-LSDHHAIUSA-N 1 3 280.481 3.581 20 0 CHADHO Cc1cc2cc(CN[C@@H]3C[C@H]3C3CC[NH2+]CC3)oc2cc1C ZINC000415011985 328298778 /nfs/dbraw/zinc/29/87/78/328298778.db2.gz RRQCALMOCNCFOV-ZWKOTPCHSA-N 1 3 298.430 3.527 20 0 CHADHO Cc1ccsc1CN[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415084332 328302951 /nfs/dbraw/zinc/30/29/51/328302951.db2.gz OTUSGAHRCXOPPJ-CVEARBPZSA-N 1 3 286.444 3.639 20 0 CHADHO CC[C@H](C)[NH2+]CC1CCN(Cc2ccccc2Cl)CC1 ZINC000531975322 328363951 /nfs/dbraw/zinc/36/39/51/328363951.db2.gz RZBQLLNDJQXLOD-AWEZNQCLSA-N 1 3 294.870 3.940 20 0 CHADHO C[C@@H]1C[C@H](N[C@H]2CCCc3ccc(Cl)cc32)CC[N@@H+]1C ZINC000534972181 328372394 /nfs/dbraw/zinc/37/23/94/328372394.db2.gz LIZKAWCPXGJDBL-VMGRFDJRSA-N 1 3 292.854 3.790 20 0 CHADHO C[C@@H]1C[C@H](N[C@H]2CCCc3ccc(Cl)cc32)CC[N@H+]1C ZINC000534972181 328372395 /nfs/dbraw/zinc/37/23/95/328372395.db2.gz LIZKAWCPXGJDBL-VMGRFDJRSA-N 1 3 292.854 3.790 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](N[C@@H]2CCCc3sc(Cl)cc32)C1 ZINC000576240740 327025804 /nfs/dbraw/zinc/02/58/04/327025804.db2.gz HSLJHDLITUWRSV-JFGNBEQYSA-N 1 3 284.856 3.638 20 0 CHADHO C[C@H](c1ccccc1Cl)N1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000584172993 327057373 /nfs/dbraw/zinc/05/73/73/327057373.db2.gz OIFUVJASVIQRHJ-UKRRQHHQSA-N 1 3 292.854 3.723 20 0 CHADHO CC[NH+](CC)CC1CCN(Cc2ccc(C)c(F)c2)CC1 ZINC000506908543 332781912 /nfs/dbraw/zinc/78/19/12/332781912.db2.gz MGMMCUNMLHXNJF-UHFFFAOYSA-N 1 3 292.442 3.688 20 0 CHADHO CC[NH+](CC)CCCN1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000558724376 327117606 /nfs/dbraw/zinc/11/76/06/327117606.db2.gz CRDLEJZEGOULEJ-WMZOPIPTSA-N 1 3 274.452 3.596 20 0 CHADHO CCN(CC)CCC[N@@H+]1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000558724376 327117608 /nfs/dbraw/zinc/11/76/08/327117608.db2.gz CRDLEJZEGOULEJ-WMZOPIPTSA-N 1 3 274.452 3.596 20 0 CHADHO CCN(CC)CCC[N@H+]1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000558724376 327117610 /nfs/dbraw/zinc/11/76/10/327117610.db2.gz CRDLEJZEGOULEJ-WMZOPIPTSA-N 1 3 274.452 3.596 20 0 CHADHO CC(C)C(C)(C)C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCCN1 ZINC000261573886 327384791 /nfs/dbraw/zinc/38/47/91/327384791.db2.gz WDSFFVVKDRTJKD-ARFHVFGLSA-N 1 3 266.473 3.569 20 0 CHADHO CCC[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000582779592 329185120 /nfs/dbraw/zinc/18/51/20/329185120.db2.gz ZKVXHKGEOWJBLL-HDMKZQKVSA-N 1 3 289.467 3.858 20 0 CHADHO CC[C@H]([NH2+]CCCN(C)C(C)C)c1cccs1 ZINC000221915785 329215704 /nfs/dbraw/zinc/21/57/04/329215704.db2.gz BJABGPHJEQLHDK-ZDUSSCGKSA-N 1 3 254.443 3.519 20 0 CHADHO C[C@@H](NC1CCC([NH+]2CCC(C)CC2)CC1)c1ccoc1 ZINC000181664297 329235352 /nfs/dbraw/zinc/23/53/52/329235352.db2.gz XNHQSOAHNDCXCA-FAEJEUNOSA-N 1 3 290.451 3.973 20 0 CHADHO CC(C)[C@@H](C)[NH2+]CC1CCN(Cc2cccs2)CC1 ZINC000125463106 329583153 /nfs/dbraw/zinc/58/31/53/329583153.db2.gz VKKMESXQGAMIGP-CQSZACIVSA-N 1 3 280.481 3.594 20 0 CHADHO CCc1ccc([C@H](N[C@@H]2CCC[NH2+]CC2)C(C)C)cc1 ZINC000261596732 329972374 /nfs/dbraw/zinc/97/23/74/329972374.db2.gz PJZDLDIAAPQJPL-QZTJIDSGSA-N 1 3 274.452 3.678 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@@H](C)[C@H]2CCC[NH2+]C2)cc1 ZINC000422693204 330150830 /nfs/dbraw/zinc/15/08/30/330150830.db2.gz LGYDFIFTVUUBRL-MPGHIAIKSA-N 1 3 274.452 3.849 20 0 CHADHO C[C@@H]1CCNCC[C@H]1[NH2+]CC(C)(C)c1ccccc1Cl ZINC000422714022 330151874 /nfs/dbraw/zinc/15/18/74/330151874.db2.gz QONWDAYTDIXVCJ-CZUORRHYSA-N 1 3 294.870 3.595 20 0 CHADHO C[C@@H]1CC[NH2+]CC[C@H]1NCC(C)(C)c1ccccc1Cl ZINC000422714022 330151876 /nfs/dbraw/zinc/15/18/76/330151876.db2.gz QONWDAYTDIXVCJ-CZUORRHYSA-N 1 3 294.870 3.595 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H]1NCCC(c1ccccc1)c1ccccc1 ZINC000422727644 330152504 /nfs/dbraw/zinc/15/25/04/330152504.db2.gz HRWJEMOXNUVSOR-UXHICEINSA-N 1 3 294.442 3.678 20 0 CHADHO CC(C)c1ccc([C@H](N[C@H](C)C2C[NH2+]C2)C(C)C)cc1 ZINC000422775025 330154457 /nfs/dbraw/zinc/15/44/57/330154457.db2.gz ZMAQMKUOAKXIEC-RDTXWAMCSA-N 1 3 274.452 3.705 20 0 CHADHO CC(C)c1ccc([C@H]([NH2+][C@H](C)C2CNC2)C(C)C)cc1 ZINC000422775025 330154458 /nfs/dbraw/zinc/15/44/58/330154458.db2.gz ZMAQMKUOAKXIEC-RDTXWAMCSA-N 1 3 274.452 3.705 20 0 CHADHO C[C@H](CN[C@@H]1C[C@H]([NH3+])c2ccccc21)Cc1cccs1 ZINC000422775681 330154561 /nfs/dbraw/zinc/15/45/61/330154561.db2.gz BEELQQJTJSGLTC-AFAVFJNCSA-N 1 3 286.444 3.661 20 0 CHADHO CC(C)c1ccc([C@@H](N[C@H](C)C2C[NH2+]C2)C(C)C)cc1 ZINC000422775023 330154605 /nfs/dbraw/zinc/15/46/05/330154605.db2.gz ZMAQMKUOAKXIEC-KDOFPFPSSA-N 1 3 274.452 3.705 20 0 CHADHO CC(C)c1ccc([C@@H]([NH2+][C@H](C)C2CNC2)C(C)C)cc1 ZINC000422775023 330154607 /nfs/dbraw/zinc/15/46/07/330154607.db2.gz ZMAQMKUOAKXIEC-KDOFPFPSSA-N 1 3 274.452 3.705 20 0 CHADHO Cc1cccc([C@H](C)C[NH2+][C@@H](C)c2ccc(CN)nc2C)c1 ZINC000422792036 330155283 /nfs/dbraw/zinc/15/52/83/330155283.db2.gz WSBCXYSKWFKIJM-CABCVRRESA-N 1 3 297.446 3.611 20 0 CHADHO C[C@@H](N)C[C@H](C)[NH2+]CCCc1ccc(Cl)cc1Cl ZINC000422817881 330156197 /nfs/dbraw/zinc/15/61/97/330156197.db2.gz FDFCHVYCAALBPF-MNOVXSKESA-N 1 3 289.250 3.641 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCCCc1ccc(Cl)cc1Cl ZINC000422817881 330156198 /nfs/dbraw/zinc/15/61/98/330156198.db2.gz FDFCHVYCAALBPF-MNOVXSKESA-N 1 3 289.250 3.641 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2CN[C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000422809879 330156227 /nfs/dbraw/zinc/15/62/27/330156227.db2.gz SOIUKBFDVNMFAB-RSPOEFSDSA-N 1 3 298.474 3.617 20 0 CHADHO CC(C)[C@H](CN[C@H]1C[C@@H]([NH3+])c2ccccc21)c1cccnc1 ZINC000422835550 330156935 /nfs/dbraw/zinc/15/69/35/330156935.db2.gz PPLFDFCPLFDHDB-OTWHNJEPSA-N 1 3 295.430 3.556 20 0 CHADHO CC(C)CCOc1ccc([C@@H](C)[NH2+]C2CCNCC2)cc1 ZINC000422862247 330158125 /nfs/dbraw/zinc/15/81/25/330158125.db2.gz PNCUNBSAMWHMNX-OAHLLOKOSA-N 1 3 290.451 3.514 20 0 CHADHO NC[C@H]1CCCC[C@@H]1[NH2+]CC1(Cc2ccccc2)CCC1 ZINC000422927916 330160847 /nfs/dbraw/zinc/16/08/47/330160847.db2.gz HUOYCGNOWHAJRD-MSOLQXFVSA-N 1 3 286.463 3.507 20 0 CHADHO C[C@H](CCC[NH3+])N[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000422935099 330161482 /nfs/dbraw/zinc/16/14/82/330161482.db2.gz KPNPUYVOTGFABM-KDOFPFPSSA-N 1 3 286.394 3.632 20 0 CHADHO C[C@@H](N[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccccc1 ZINC000422986452 330162909 /nfs/dbraw/zinc/16/29/09/330162909.db2.gz GVLNCSFTFZLYJS-ATZDWAIDSA-N 1 3 280.415 3.831 20 0 CHADHO C[C@@H](N[C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccccc1 ZINC000422986453 330163036 /nfs/dbraw/zinc/16/30/36/330163036.db2.gz GVLNCSFTFZLYJS-AYOQOUSVSA-N 1 3 280.415 3.831 20 0 CHADHO CC(C)C[C@H](N[C@@H](C)C[C@H](C)[NH3+])c1cccs1 ZINC000422950263 330163795 /nfs/dbraw/zinc/16/37/95/330163795.db2.gz VOQKSMQPUJEONA-AVGNSLFASA-N 1 3 254.443 3.551 20 0 CHADHO c1ccc([C@H](CC2CCC2)N[C@@H]2CCC[NH2+]CC2)cc1 ZINC000423038881 330166556 /nfs/dbraw/zinc/16/65/56/330166556.db2.gz DJCPNIMXOQUFHS-MSOLQXFVSA-N 1 3 272.436 3.650 20 0 CHADHO C[C@@H]1CCCc2ccccc2[C@@H]1NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423048073 330166949 /nfs/dbraw/zinc/16/69/49/330166949.db2.gz IDLNKUPMRKNEQP-WNBQKTHNSA-N 1 3 284.447 3.573 20 0 CHADHO C[C@@H]1CCCc2ccccc2[C@H]1NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423048075 330167236 /nfs/dbraw/zinc/16/72/36/330167236.db2.gz IDLNKUPMRKNEQP-XTLBQKNCSA-N 1 3 284.447 3.573 20 0 CHADHO c1ccc([C@@H]2CCC[C@@H](NC3C[C@H]4CC[C@@H](C3)[NH2+]4)C2)cc1 ZINC000423078102 330168574 /nfs/dbraw/zinc/16/85/74/330168574.db2.gz NTRVGNUXINWLHM-ZWRCUJBNSA-N 1 3 284.447 3.585 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[C@H](c2ccccc2F)C1 ZINC000423097614 330169736 /nfs/dbraw/zinc/16/97/36/330169736.db2.gz QWQWZSKMHBGDJD-AFIMGQEJSA-N 1 3 290.426 3.569 20 0 CHADHO [NH3+][C@H]1CCC[C@@H]1N[C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000423100590 330170096 /nfs/dbraw/zinc/17/00/96/330170096.db2.gz MYUBHDWBKQKRKO-GVARAGBVSA-N 1 3 299.245 3.709 20 0 CHADHO N[C@H]1CCCCC[C@H]1[NH2+]Cc1ccc2sccc2c1 ZINC000423130037 330171506 /nfs/dbraw/zinc/17/15/06/330171506.db2.gz XXFQIHHLNRMFKF-LSDHHAIUSA-N 1 3 274.433 3.651 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NC[C@H]2CCCCC(F)(F)C2)c2ccccc21 ZINC000423128132 330171689 /nfs/dbraw/zinc/17/16/89/330171689.db2.gz KFLUDEXVDIGROG-APHBMKBZSA-N 1 3 294.389 3.936 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@H]1NCCc1cc2ccccc2s1 ZINC000423132576 330171825 /nfs/dbraw/zinc/17/18/25/330171825.db2.gz JIMJTNXGPIGGIF-HZPDHXFCSA-N 1 3 288.460 3.693 20 0 CHADHO [NH3+][C@H]1CCCCC[C@@H]1N[C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423146043 330172454 /nfs/dbraw/zinc/17/24/54/330172454.db2.gz NPZDMSXMGZDSBR-PYTWLRIVSA-N 1 3 292.854 3.836 20 0 CHADHO NC[C@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423142552 330172579 /nfs/dbraw/zinc/17/25/79/330172579.db2.gz ANEQGSREAJBTEL-VMUDFCTBSA-N 1 3 292.854 3.693 20 0 CHADHO N[C@@H]1C[C@H]([NH2+]C2(Cc3ccc(F)cc3)CC2)c2ccccc21 ZINC000423150725 330172835 /nfs/dbraw/zinc/17/28/35/330172835.db2.gz CCPZBVQLDBKFHB-MSOLQXFVSA-N 1 3 296.389 3.635 20 0 CHADHO CC(C)=CCC[C@H](C)N[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423150606 330172916 /nfs/dbraw/zinc/17/29/16/330172916.db2.gz BLKSXMAKTMGSFD-XKQJLSEDSA-N 1 3 258.409 3.856 20 0 CHADHO CCC[C@@H]([NH2+][C@H](C)c1ccc(CN)nc1C)C1CCCC1 ZINC000423169036 330174183 /nfs/dbraw/zinc/17/41/83/330174183.db2.gz IPTOQCNYSFKCQU-RDTXWAMCSA-N 1 3 289.467 3.858 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@@H]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000423170754 330174448 /nfs/dbraw/zinc/17/44/48/330174448.db2.gz YTHVIOLLRGOHFE-LMRQPLJMSA-N 1 3 280.843 3.692 20 0 CHADHO NC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000423170961 330174470 /nfs/dbraw/zinc/17/44/70/330174470.db2.gz ZCFFOLYRRNUVEG-OHFALNGGSA-N 1 3 292.854 3.693 20 0 CHADHO Cc1cccc(C[C@@H](NCC2([NH3+])CCCCC2)C2CC2)c1 ZINC000423182226 330175417 /nfs/dbraw/zinc/17/54/17/330175417.db2.gz QFWAUTUDOPUGGX-GOSISDBHSA-N 1 3 286.463 3.567 20 0 CHADHO CCc1ccc([C@H](C)[NH2+]CC2(N)CCCCC2)s1 ZINC000423184493 330175814 /nfs/dbraw/zinc/17/58/14/330175814.db2.gz UBBLVOXYANSRIY-LBPRGKRZSA-N 1 3 266.454 3.623 20 0 CHADHO Cc1ccc([C@@H](NC2CC[NH2+]CC2)C2CCCC2)cc1 ZINC000423191499 330175904 /nfs/dbraw/zinc/17/59/04/330175904.db2.gz UHHBIUBAHVBQFY-SFHVURJKSA-N 1 3 272.436 3.568 20 0 CHADHO Cc1ccc([C@@H]([NH2+]C2CCNCC2)C2CCCC2)cc1 ZINC000423191499 330175905 /nfs/dbraw/zinc/17/59/05/330175905.db2.gz UHHBIUBAHVBQFY-SFHVURJKSA-N 1 3 272.436 3.568 20 0 CHADHO CCCCCOc1ccc([C@@H](C)[NH2+]C2CCNCC2)cc1 ZINC000423192538 330175975 /nfs/dbraw/zinc/17/59/75/330175975.db2.gz VUOKECNXMKYWPB-OAHLLOKOSA-N 1 3 290.451 3.658 20 0 CHADHO NC1(C[NH2+][C@H](c2cccnc2)C2CCC2)CCCCCC1 ZINC000423198438 330176553 /nfs/dbraw/zinc/17/65/53/330176553.db2.gz FWAZWCLYOLPOPX-KRWDZBQOSA-N 1 3 287.451 3.564 20 0 CHADHO CNCCC[NH2+][C@H]1CCC[C@@H](c2ccc(Cl)cc2)C1 ZINC000423208077 330177267 /nfs/dbraw/zinc/17/72/67/330177267.db2.gz YQXKUQLQEDKBHU-ZBFHGGJFSA-N 1 3 280.843 3.565 20 0 CHADHO C[NH2+]CCCN[C@H]1CCC[C@@H](c2ccc(Cl)cc2)C1 ZINC000423208077 330177268 /nfs/dbraw/zinc/17/72/68/330177268.db2.gz YQXKUQLQEDKBHU-ZBFHGGJFSA-N 1 3 280.843 3.565 20 0 CHADHO C[C@H](N)CC[NH2+][C@H]1CCC[C@H](c2cccc(Cl)c2)C1 ZINC000423222643 330179796 /nfs/dbraw/zinc/17/97/96/330179796.db2.gz BYQQXPIOWAKZFS-NOLJZWGESA-N 1 3 280.843 3.693 20 0 CHADHO CCC[C@H](NCC[C@H](C)[NH3+])c1ccc(Cl)cc1 ZINC000423232031 330180687 /nfs/dbraw/zinc/18/06/87/330180687.db2.gz MDGDXCWIBUXDGJ-FZMZJTMJSA-N 1 3 254.805 3.508 20 0 CHADHO [NH3+]C[C@H](N[C@H]1CCCc2c3ccccc3sc21)C1CC1 ZINC000423276187 330185048 /nfs/dbraw/zinc/18/50/48/330185048.db2.gz MPJOECTZEPLEFE-GJZGRUSLSA-N 1 3 286.444 3.606 20 0 CHADHO C[C@H]1C[C@H](N[C@@H]2CCCC[C@@H]2C[NH3+])c2ccsc2S1 ZINC000423277509 330185073 /nfs/dbraw/zinc/18/50/73/330185073.db2.gz OICFXBWNACDWCG-UNJBNNCHSA-N 1 3 296.505 3.781 20 0 CHADHO C[C@@H]([NH2+]CC(C)(C)N)c1ccc(-c2ccccc2)cc1 ZINC000423282165 330185852 /nfs/dbraw/zinc/18/58/52/330185852.db2.gz CDDKGVKYXRYXLA-CQSZACIVSA-N 1 3 268.404 3.742 20 0 CHADHO CCC([NH3+])(CC)CN[C@H](Cc1ccccc1Cl)C1CC1 ZINC000423290765 330186687 /nfs/dbraw/zinc/18/66/87/330186687.db2.gz FJHYWZSHAVDZBU-MRXNPFEDSA-N 1 3 294.870 3.768 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@H]2c3cc(F)ccc3C[C@@H]2C)cc1 ZINC000423291684 330187051 /nfs/dbraw/zinc/18/70/51/330187051.db2.gz JKVZRHSQFQWKIN-WTOJCKNJSA-N 1 3 298.405 3.869 20 0 CHADHO Cc1ccccc1[C@@H](C)NCc1ccc([C@H](C)[NH3+])cc1 ZINC000423292509 330187608 /nfs/dbraw/zinc/18/76/08/330187608.db2.gz NFMJUDUXRNXIII-LSDHHAIUSA-N 1 3 268.404 3.866 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2cc(F)cc(F)c2)cc1 ZINC000423293156 330187786 /nfs/dbraw/zinc/18/77/86/330187786.db2.gz PZWKKVQIQGNNJK-VXGBXAGGSA-N 1 3 290.357 3.835 20 0 CHADHO CC[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccccc1OC ZINC000423296826 330188485 /nfs/dbraw/zinc/18/84/85/330188485.db2.gz ZZVWXQDHJZRTLS-KBXCAEBGSA-N 1 3 298.430 3.956 20 0 CHADHO C[C@H](C[NH3+])CN[C@H](CCc1ccccc1)c1ccccc1 ZINC000423297578 330188721 /nfs/dbraw/zinc/18/87/21/330188721.db2.gz KWQGGMIURRKVFC-VQIMIIECSA-N 1 3 282.431 3.545 20 0 CHADHO CC[C@@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccccc1OC ZINC000423296829 330188728 /nfs/dbraw/zinc/18/87/28/330188728.db2.gz ZZVWXQDHJZRTLS-RDTXWAMCSA-N 1 3 298.430 3.956 20 0 CHADHO CC(C)[C@@H]([NH2+]CC1(N)CCC1)c1cc2ccccc2o1 ZINC000423326990 330190696 /nfs/dbraw/zinc/19/06/96/330190696.db2.gz MQLUCQIGOGCWLK-MRXNPFEDSA-N 1 3 272.392 3.601 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]C[C@]1(C)CCCNC1 ZINC000423329843 330191246 /nfs/dbraw/zinc/19/12/46/330191246.db2.gz FLAIEPPSYCDFSL-UWWQBHOKSA-N 1 3 272.436 3.523 20 0 CHADHO C[C@H](NCC1=CC[NH2+]CC1)c1ccc(-c2cccs2)cc1 ZINC000423346785 330192701 /nfs/dbraw/zinc/19/27/01/330192701.db2.gz PPSOLNGUATUVDD-AWEZNQCLSA-N 1 3 298.455 3.985 20 0 CHADHO CC[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccc(F)cc1 ZINC000423352441 330192895 /nfs/dbraw/zinc/19/28/95/330192895.db2.gz ATEGXIDDCBSZIT-SFHVURJKSA-N 1 3 284.378 3.670 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCCc3ccc(Cl)cc32)CCN1 ZINC000423363521 330193929 /nfs/dbraw/zinc/19/39/29/330193929.db2.gz AMXIAZOBJMZCIM-ISTRZQFTSA-N 1 3 292.854 3.838 20 0 CHADHO Clc1ccc([C@H]2CC[C@@H](NCC[C@H]3CCC[NH2+]3)C2)cc1 ZINC000423362949 330193965 /nfs/dbraw/zinc/19/39/65/330193965.db2.gz UGAPFSGOYNPNGI-USXIJHARSA-N 1 3 292.854 3.708 20 0 CHADHO c1cc(C[NH2+][C@H]2CCCCC23CCCC3)cc2c1CNC2 ZINC000423366801 330194685 /nfs/dbraw/zinc/19/46/85/330194685.db2.gz CHDZSTLQXNXBCC-SFHVURJKSA-N 1 3 284.447 3.882 20 0 CHADHO CC[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1cccc(OC)c1 ZINC000423366167 330194712 /nfs/dbraw/zinc/19/47/12/330194712.db2.gz BPYRJMRACSCBRZ-LJQANCHMSA-N 1 3 296.414 3.539 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1cc2ccccc2s1 ZINC000423368661 330195083 /nfs/dbraw/zinc/19/50/83/330195083.db2.gz BGUULYUCCKUOET-MBNYWOFBSA-N 1 3 274.433 3.692 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1ccc2ccccc2c1 ZINC000423372762 330195356 /nfs/dbraw/zinc/19/53/56/330195356.db2.gz ITGJSFDGAYFCKR-HBUWYVDXSA-N 1 3 268.404 3.631 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@H]1N[C@@H](Cc1ccccc1)c1ccccc1 ZINC000423400388 330195873 /nfs/dbraw/zinc/19/58/73/330195873.db2.gz QHGCSGQQVLNRHU-AHRSYUTCSA-N 1 3 294.442 3.558 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@@H](Cc1ccccc1)c1ccccc1 ZINC000423400388 330195875 /nfs/dbraw/zinc/19/58/75/330195875.db2.gz QHGCSGQQVLNRHU-AHRSYUTCSA-N 1 3 294.442 3.558 20 0 CHADHO C[C@H](N[C@@H]1CC[NH2+]C[C@@H]1C)c1cc2ccccc2s1 ZINC000423397757 330196050 /nfs/dbraw/zinc/19/60/50/330196050.db2.gz OLFSNWBZUFHJIR-SGMGOOAPSA-N 1 3 274.433 3.550 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCNC[C@@H]1C)c1cc2ccccc2s1 ZINC000423397757 330196052 /nfs/dbraw/zinc/19/60/52/330196052.db2.gz OLFSNWBZUFHJIR-SGMGOOAPSA-N 1 3 274.433 3.550 20 0 CHADHO C[C@@H](CCC(C)(C)C)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423402831 330196428 /nfs/dbraw/zinc/19/64/28/330196428.db2.gz WSDZPSVQLOOSAB-ZDUSSCGKSA-N 1 3 260.425 3.594 20 0 CHADHO CCC[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccsc1 ZINC000423376897 330198701 /nfs/dbraw/zinc/19/87/01/330198701.db2.gz JFTBRZUGPRYTPH-QGZVFWFLSA-N 1 3 286.444 3.982 20 0 CHADHO c1ccc([C@@H]2CC[C@@H]([NH2+]Cc3ccc4c(c3)CNC4)C2)cc1 ZINC000423376055 330198707 /nfs/dbraw/zinc/19/87/07/330198707.db2.gz JABQOFJHSIIPQV-YLJYHZDGSA-N 1 3 292.426 3.716 20 0 CHADHO COc1ccc2cc([C@H](C)[NH2+][C@@H]3CCN[C@@H](C)C3)ccc2c1 ZINC000423374355 330198722 /nfs/dbraw/zinc/19/87/22/330198722.db2.gz JUHKTGGXGJNNMA-SUNYJGFJSA-N 1 3 298.430 3.640 20 0 CHADHO C[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423383047 330199319 /nfs/dbraw/zinc/19/93/19/330199319.db2.gz KHUNFVNJBAIWJZ-GJZGRUSLSA-N 1 3 280.415 3.572 20 0 CHADHO CC(C)[C@H](CSc1ccccc1)[NH2+][C@H]1CCN[C@H](C)C1 ZINC000423384686 330199593 /nfs/dbraw/zinc/19/95/93/330199593.db2.gz QGSJHDWNUBFZAA-VYDXJSESSA-N 1 3 292.492 3.533 20 0 CHADHO CC(C)[C@H](CSc1ccccc1)N[C@H]1CC[NH2+][C@H](C)C1 ZINC000423384686 330199595 /nfs/dbraw/zinc/19/95/95/330199595.db2.gz QGSJHDWNUBFZAA-VYDXJSESSA-N 1 3 292.492 3.533 20 0 CHADHO CC(C)Cc1cccc([C@H](C)[NH2+][C@H]2CCNC[C@H]2C)c1 ZINC000423387140 330200087 /nfs/dbraw/zinc/20/00/87/330200087.db2.gz HPWDTKBOMUHBMJ-VKJFTORMSA-N 1 3 274.452 3.534 20 0 CHADHO CC(C)[C@H]([NH2+][C@H](C)[C@@H](C)N)c1cccc(C(F)(F)F)c1 ZINC000423449445 330202570 /nfs/dbraw/zinc/20/25/70/330202570.db2.gz RMPAAZCJBSOMJZ-GYSYKLTISA-N 1 3 288.357 3.728 20 0 CHADHO C[C@@H](N)[C@H](C)[NH2+][C@@H](C)c1ccc(-c2ccc(F)cc2)s1 ZINC000423449789 330202904 /nfs/dbraw/zinc/20/29/04/330202904.db2.gz SDELTIGUQTVCPK-WOPDTQHZSA-N 1 3 292.423 3.941 20 0 CHADHO CC[C@H](N)C[NH2+][C@H](C)c1ccc(-c2ccccc2)s1 ZINC000423456988 330203616 /nfs/dbraw/zinc/20/36/16/330203616.db2.gz FCHYRJGZBTVZBH-OCCSQVGLSA-N 1 3 274.433 3.803 20 0 CHADHO CC[C@@H](N)C[NH2+][C@H](C)c1ccc(SC(C)C)cc1 ZINC000423465031 330204348 /nfs/dbraw/zinc/20/43/48/330204348.db2.gz MJHYRGOGLFEYLO-TZMCWYRMSA-N 1 3 266.454 3.575 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CNCC[C@@H]1c1ccc(F)cc1)C(C)(C)C ZINC000423466689 330204626 /nfs/dbraw/zinc/20/46/26/330204626.db2.gz ITXGDAZIHXKYSW-UKPHBRMFSA-N 1 3 292.442 3.543 20 0 CHADHO CC[C@H](N)C[NH2+][C@@H](c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000423471010 330205031 /nfs/dbraw/zinc/20/50/31/330205031.db2.gz PMULTLFKRHVVBG-SMDDNHRTSA-N 1 3 287.234 3.771 20 0 CHADHO COc1ccc(Cl)cc1[C@H](C)NCCC[C@H]1CCC[NH2+]1 ZINC000423474813 330205348 /nfs/dbraw/zinc/20/53/48/330205348.db2.gz HNRDPPPTBLLQCC-JSGCOSHPSA-N 1 3 296.842 3.531 20 0 CHADHO C[C@H](N[C@@H]1CC[C@@H](C[NH3+])C1)c1ccc(Cl)cc1Cl ZINC000423485286 330206741 /nfs/dbraw/zinc/20/67/41/330206741.db2.gz AZJXGJWJPLALGN-HOSYDEDBSA-N 1 3 287.234 3.771 20 0 CHADHO Cc1ccncc1[C@@H](C)N[C@H](CCC[NH3+])c1ccccc1 ZINC000423497044 330207996 /nfs/dbraw/zinc/20/79/96/330207996.db2.gz FWTDTUDQRODZPN-CRAIPNDOSA-N 1 3 283.419 3.521 20 0 CHADHO CC[C@@H](NCCC1=CC[NH2+]CC1)c1cccc(Cl)c1F ZINC000423537492 330210949 /nfs/dbraw/zinc/21/09/49/330210949.db2.gz KCSWKBIVTDQALU-OAHLLOKOSA-N 1 3 296.817 3.830 20 0 CHADHO CCC[C@H](C)[C@H](CC)[NH2+]CCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000536859112 330252511 /nfs/dbraw/zinc/25/25/11/330252511.db2.gz UTUZSIUAURSIAI-FJIDUMEYSA-N 1 3 298.515 3.680 20 0 CHADHO Cc1cccc([C@H](N[C@H]2CC[N@@H+]3CCC[C@H]3C2)C(C)C)c1 ZINC000527810207 330284644 /nfs/dbraw/zinc/28/46/44/330284644.db2.gz OVVYPMPEYRFMJV-GBESFXJTSA-N 1 3 286.463 3.909 20 0 CHADHO Cc1cccc([C@H](N[C@H]2CC[N@H+]3CCC[C@H]3C2)C(C)C)c1 ZINC000527810207 330284645 /nfs/dbraw/zinc/28/46/45/330284645.db2.gz OVVYPMPEYRFMJV-GBESFXJTSA-N 1 3 286.463 3.909 20 0 CHADHO C[C@H]([NH2+]C1CCN(C2CCCCC2)CC1)[C@@H]1CC12CC2 ZINC000527868947 330286035 /nfs/dbraw/zinc/28/60/35/330286035.db2.gz VGKPNVFRTABWEY-YOEHRIQHSA-N 1 3 276.468 3.562 20 0 CHADHO CC(C)[C@H](CNC1CC(c2ccccc2)C1)[NH+]1CCCC1 ZINC000036840564 330291971 /nfs/dbraw/zinc/29/19/71/330291971.db2.gz DSCMULOFFIYQMG-ACBHZAAOSA-N 1 3 286.463 3.643 20 0 CHADHO CC[C@H](C)[C@H](C)[NH2+][C@H](C)c1ccc(OCCN(C)C)cc1 ZINC000536878743 330313386 /nfs/dbraw/zinc/31/33/86/330313386.db2.gz STKSPPQOTGZJLN-HRCADAONSA-N 1 3 292.467 3.712 20 0 CHADHO C1CC([C@@H]([NH2+][C@H]2CCN3CCC[C@H]3C2)C2CCCCC2)C1 ZINC000424273272 330333248 /nfs/dbraw/zinc/33/32/48/330333248.db2.gz WGACJLHUNYJCMQ-FHWLQOOXSA-N 1 3 290.495 3.952 20 0 CHADHO C[C@@H](CCc1ccc(Cl)s1)N[C@@H]1CCCC[C@H]1[NH3+] ZINC000424366793 330347912 /nfs/dbraw/zinc/34/79/12/330347912.db2.gz JRASXLYROXFZLM-CYZMBNFOSA-N 1 3 286.872 3.582 20 0 CHADHO C[C@H](N[C@H]1CCCC[C@@H]1C[NH3+])c1ccc(Cl)s1 ZINC000089142302 330380768 /nfs/dbraw/zinc/38/07/68/330380768.db2.gz FTHRTAIJYPNNSH-AXFHLTTASA-N 1 3 272.845 3.570 20 0 CHADHO C[C@]1(C[NH2+]C2CCN(C3CCCCC3)CC2)CCCS1 ZINC000120392309 330388463 /nfs/dbraw/zinc/38/84/63/330388463.db2.gz LCLHBJIHCCBFLC-QGZVFWFLSA-N 1 3 296.524 3.659 20 0 CHADHO C1=CC[C@@H](C[NH2+]C2CCN(CC3CCCC3)CC2)CC1 ZINC000120494905 330388884 /nfs/dbraw/zinc/38/88/84/330388884.db2.gz XKMDBFHYNPHFAP-MRXNPFEDSA-N 1 3 276.468 3.587 20 0 CHADHO C[C@@H](NC1CCC([NH+]2CCC(C)CC2)CC1)c1ccco1 ZINC000090775391 330395964 /nfs/dbraw/zinc/39/59/64/330395964.db2.gz QWQFKYOCSKUZPN-KLAILNCOSA-N 1 3 290.451 3.973 20 0 CHADHO Cc1cc(Cl)cc(C)c1CN1CCC2(CC[NH2+]C2)CC1 ZINC000430919063 330576848 /nfs/dbraw/zinc/57/68/48/330576848.db2.gz PDZCYTYRNAHHSH-UHFFFAOYSA-N 1 3 292.854 3.532 20 0 CHADHO Cc1cc([C@@H](C)[NH2+]C[C@H]2CCCN(C(C)C)C2)cs1 ZINC000453113600 331090333 /nfs/dbraw/zinc/09/03/33/331090333.db2.gz UMMPEFPTURWKJS-HUUCEWRRSA-N 1 3 280.481 3.828 20 0 CHADHO CCC1([NH2+]C2CCN([C@@H]3CCCC[C@@H]3C)CC2)CC1 ZINC000453290026 331111683 /nfs/dbraw/zinc/11/16/83/331111683.db2.gz NAQOLSHILFLDIR-GOEBONIOSA-N 1 3 264.457 3.562 20 0 CHADHO CCC1(NC2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)CC1 ZINC000453290026 331111684 /nfs/dbraw/zinc/11/16/84/331111684.db2.gz NAQOLSHILFLDIR-GOEBONIOSA-N 1 3 264.457 3.562 20 0 CHADHO CCC(C)(C)OCC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000453401061 331128682 /nfs/dbraw/zinc/12/86/82/331128682.db2.gz DJBSVXYYVBNPGX-UHFFFAOYSA-N 1 3 296.499 3.578 20 0 CHADHO c1ccc([C@@H]2C[C@H]2CN2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000459352788 331277707 /nfs/dbraw/zinc/27/77/07/331277707.db2.gz VZXIKUFMBLGGRH-ZCNNSNEGSA-N 1 3 298.474 3.740 20 0 CHADHO CC1(C)[C@@H](CN[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)[C@@H]1c1ccccc1 ZINC000459724457 331295923 /nfs/dbraw/zinc/29/59/23/331295923.db2.gz YSLFIJXYYHYBQG-YRXWBPOGSA-N 1 3 298.474 3.643 20 0 CHADHO CC1(C)[C@@H](CN[C@@H]2CC[N@H+]3CCC[C@@H]3C2)[C@@H]1c1ccccc1 ZINC000459724457 331295924 /nfs/dbraw/zinc/29/59/24/331295924.db2.gz YSLFIJXYYHYBQG-YRXWBPOGSA-N 1 3 298.474 3.643 20 0 CHADHO CC(C)[C@H](CN[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000166088380 331306574 /nfs/dbraw/zinc/30/65/74/331306574.db2.gz GYWXZQZCHBRBHL-QRVBRYPASA-N 1 3 286.463 3.643 20 0 CHADHO CC(C)[C@H](CN[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000166088380 331306575 /nfs/dbraw/zinc/30/65/75/331306575.db2.gz GYWXZQZCHBRBHL-QRVBRYPASA-N 1 3 286.463 3.643 20 0 CHADHO CC[C@H]([NH2+]CCCN1CCCCC1)c1cccc(F)c1 ZINC000166427022 331307129 /nfs/dbraw/zinc/30/71/29/331307129.db2.gz GLEFNEZWDCICEK-KRWDZBQOSA-N 1 3 278.415 3.742 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+][C@H]1CCCCC12CCCC2 ZINC000463444236 331347650 /nfs/dbraw/zinc/34/76/50/331347650.db2.gz MEDCLFYVEXVJLX-CVEARBPZSA-N 1 3 264.457 3.563 20 0 CHADHO Clc1cccc(C2(NC[C@H]3CCC[NH2+]C3)CCCC2)c1 ZINC000469985626 331468495 /nfs/dbraw/zinc/46/84/95/331468495.db2.gz PIJTZNGMMVQCBT-AWEZNQCLSA-N 1 3 292.854 3.699 20 0 CHADHO C[C@H](C[NH2+]C[C@H](C)c1cccc(Cl)c1)CN1CCCC1 ZINC000470195980 331474861 /nfs/dbraw/zinc/47/48/61/331474861.db2.gz ROYHHAOREJLCBB-CABCVRRESA-N 1 3 294.870 3.765 20 0 CHADHO CC(C)[C@@H]1C[C@@H](NCCC[N@H+](C)C2CCCCC2)CS1 ZINC000488419649 332006027 /nfs/dbraw/zinc/00/60/27/332006027.db2.gz HGALUJJZROOULT-WBVHZDCISA-N 1 3 298.540 3.761 20 0 CHADHO CC(C)[C@@H]1C[C@@H](NCCC[N@@H+](C)C2CCCCC2)CS1 ZINC000488419649 332006028 /nfs/dbraw/zinc/00/60/28/332006028.db2.gz HGALUJJZROOULT-WBVHZDCISA-N 1 3 298.540 3.761 20 0 CHADHO CC[C@@H]1C[C@H](C)CN1CCC[N@@H+]1C[C@H](C)C[C@@H]1CC ZINC000489296640 332045929 /nfs/dbraw/zinc/04/59/29/332045929.db2.gz SKGPLVRTXLAOLG-ZYGGUILKSA-N 1 3 266.473 3.617 20 0 CHADHO CC[C@@H]1C[C@H](C)CN1CCC[N@H+]1C[C@H](C)C[C@@H]1CC ZINC000489296640 332045930 /nfs/dbraw/zinc/04/59/30/332045930.db2.gz SKGPLVRTXLAOLG-ZYGGUILKSA-N 1 3 266.473 3.617 20 0 CHADHO CC[C@@H]1C[C@H](C)C[N@H+]1CCCN1C[C@H](C)C[C@@H]1CC ZINC000489296640 332045931 /nfs/dbraw/zinc/04/59/31/332045931.db2.gz SKGPLVRTXLAOLG-ZYGGUILKSA-N 1 3 266.473 3.617 20 0 CHADHO CC[C@@H]1C[C@H](C)C[N@@H+]1CCCN1C[C@H](C)C[C@@H]1CC ZINC000489296640 332045932 /nfs/dbraw/zinc/04/59/32/332045932.db2.gz SKGPLVRTXLAOLG-ZYGGUILKSA-N 1 3 266.473 3.617 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCc1cccc(-c2ccccc2)c1 ZINC000575749201 335111835 /nfs/dbraw/zinc/11/18/35/335111835.db2.gz NIXZPZFJVHWBNH-GJZGRUSLSA-N 1 3 268.404 3.569 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCCN1)c1ccccc1 ZINC000251121963 334356962 /nfs/dbraw/zinc/35/69/62/334356962.db2.gz RHBKXUHYFOHPTB-QXCFHYIPSA-N 1 3 286.463 3.691 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCCN1)c1ccccc1 ZINC000251121966 334356998 /nfs/dbraw/zinc/35/69/98/334356998.db2.gz RHBKXUHYFOHPTB-XGXHKWSGSA-N 1 3 286.463 3.691 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)CCc2ccccc2Cl)[C@H](C)C1 ZINC000174773361 333007043 /nfs/dbraw/zinc/00/70/43/333007043.db2.gz HJPLCBBLVXQASX-RHSMWYFYSA-N 1 3 294.870 3.545 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)CCc2ccccc2Cl)[C@H](C)C1 ZINC000174773361 333007045 /nfs/dbraw/zinc/00/70/45/333007045.db2.gz HJPLCBBLVXQASX-RHSMWYFYSA-N 1 3 294.870 3.545 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1)C1CC1 ZINC000310019498 333052920 /nfs/dbraw/zinc/05/29/20/333052920.db2.gz QLXWCOULYWROTP-WMZOPIPTSA-N 1 3 286.463 3.677 20 0 CHADHO C[C@@H]([NH2+]C1CCN(CC2CC2)CC1)c1cccc(Cl)c1 ZINC000516945888 333087537 /nfs/dbraw/zinc/08/75/37/333087537.db2.gz PKOYVTIZEGZHQO-CYBMUJFWSA-N 1 3 292.854 3.865 20 0 CHADHO COc1ccsc1[C@@H](C)[NH2+]CC1(CN(C)C)CCCC1 ZINC000186287905 333158103 /nfs/dbraw/zinc/15/81/03/333158103.db2.gz NEECNVVZMHWESD-CYBMUJFWSA-N 1 3 296.480 3.529 20 0 CHADHO Cc1cc(C)c([C@H](C)N[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1C ZINC000224117462 333216946 /nfs/dbraw/zinc/21/69/46/333216946.db2.gz LAKPSIZFUSHSMK-ULQDDVLXSA-N 1 3 274.452 3.745 20 0 CHADHO Cc1cc(C)c([C@H](C)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1C ZINC000224117462 333216947 /nfs/dbraw/zinc/21/69/47/333216947.db2.gz LAKPSIZFUSHSMK-ULQDDVLXSA-N 1 3 274.452 3.745 20 0 CHADHO C[C@H](N[C@H](CC[NH+](C)C)C(C)(C)C)c1ccccc1 ZINC000522545223 333289583 /nfs/dbraw/zinc/28/95/83/333289583.db2.gz IBSFFYKUQICELI-GOEBONIOSA-N 1 3 262.441 3.704 20 0 CHADHO C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(CC2CCCC2)C1 ZINC000524356423 333360518 /nfs/dbraw/zinc/36/05/18/333360518.db2.gz OBNCLYCAXKJPHS-SJLPKXTDSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(CC2CCCC2)C1 ZINC000524356423 333360520 /nfs/dbraw/zinc/36/05/20/333360520.db2.gz OBNCLYCAXKJPHS-SJLPKXTDSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@@H]1CCCCN1C[C@@H]1CCC[N@H+](CC2CCCC2)C1 ZINC000524356423 333360522 /nfs/dbraw/zinc/36/05/22/333360522.db2.gz OBNCLYCAXKJPHS-SJLPKXTDSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@@H]1CCCCN1C[C@@H]1CCC[N@@H+](CC2CCCC2)C1 ZINC000524356423 333360523 /nfs/dbraw/zinc/36/05/23/333360523.db2.gz OBNCLYCAXKJPHS-SJLPKXTDSA-N 1 3 278.484 3.763 20 0 CHADHO CCC[NH+]1CCC(N[C@@H](CC)c2cccc(C)c2)CC1 ZINC000312538376 333375380 /nfs/dbraw/zinc/37/53/80/333375380.db2.gz FFZAFHOZLXYJFT-SFHVURJKSA-N 1 3 274.452 3.910 20 0 CHADHO C[NH+](C)CCCC1CCN(C/C=C/c2ccccc2)CC1 ZINC000123469746 333536742 /nfs/dbraw/zinc/53/67/42/333536742.db2.gz FWFGLDJEPWOLMI-YRNVUSSQSA-N 1 3 286.463 3.754 20 0 CHADHO C[C@@H]1CCC[C@@H](N2CCC([NH2+]C[C@H]3CC3(C)C)CC2)C1 ZINC000537976844 333553143 /nfs/dbraw/zinc/55/31/43/333553143.db2.gz LMIHIFPYSJWHRR-BFYDXBDKSA-N 1 3 278.484 3.665 20 0 CHADHO CC[C@@H](NCC1(C[NH+](C)C)CCCC1)c1cccs1 ZINC000546224743 334020344 /nfs/dbraw/zinc/02/03/44/334020344.db2.gz MAMYCFBPWAJXOZ-CQSZACIVSA-N 1 3 280.481 3.911 20 0 CHADHO C[C@H]([NH2+]CC1(CN(C)C)CCCC1)c1ccc(F)c(F)c1 ZINC000546932680 334055997 /nfs/dbraw/zinc/05/59/97/334055997.db2.gz YZLOMSXWKOTMNY-ZDUSSCGKSA-N 1 3 296.405 3.737 20 0 CHADHO C[C@H]1CCCCN1CCC[NH2+]C1CCC(C)(C)CC1 ZINC000079619865 334158200 /nfs/dbraw/zinc/15/82/00/334158200.db2.gz YTEHEIDRIKSARV-HNNXBMFYSA-N 1 3 266.473 3.809 20 0 CHADHO CC(C)CC[C@@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)C1CC1 ZINC000549228203 334188234 /nfs/dbraw/zinc/18/82/34/334188234.db2.gz HMCGCEVBCWIFBT-SJLPKXTDSA-N 1 3 280.500 3.911 20 0 CHADHO CC1(C)CC([NH2+][C@@H]2CCC[C@H](C3CC3)C2)CC(C)(C)N1 ZINC000081625770 334200997 /nfs/dbraw/zinc/20/09/97/334200997.db2.gz KDLQVGYITWPBDT-LSDHHAIUSA-N 1 3 278.484 3.854 20 0 CHADHO C[C@@H]1CN(CC[C@H]2CCC[N@@H+]2C)CC[C@@H]1c1ccccc1 ZINC000245688341 334212794 /nfs/dbraw/zinc/21/27/94/334212794.db2.gz PYKGCJGKGOSFAL-QRQLOZEOSA-N 1 3 286.463 3.596 20 0 CHADHO C[C@@H]1CN(CC[C@H]2CCC[N@H+]2C)CC[C@@H]1c1ccccc1 ZINC000245688341 334212795 /nfs/dbraw/zinc/21/27/95/334212795.db2.gz PYKGCJGKGOSFAL-QRQLOZEOSA-N 1 3 286.463 3.596 20 0 CHADHO C[C@@H](NCCCCC[NH+]1CCCC1)c1ccc(F)cc1F ZINC000550881999 334231463 /nfs/dbraw/zinc/23/14/63/334231463.db2.gz GZVGUENNQALHRK-CQSZACIVSA-N 1 3 296.405 3.882 20 0 CHADHO CSc1cc(C)ccc1C[NH2+][C@@H]1C[C@@H](C)N(C)C[C@H]1C ZINC000247034300 334274409 /nfs/dbraw/zinc/27/44/09/334274409.db2.gz LLDZLMIAFUHIBP-IIAWOOMASA-N 1 3 292.492 3.535 20 0 CHADHO C[C@H](C[NH2+][C@H](C)c1cccc(C2CC2)c1)CN1CCCC1 ZINC000551008506 334236179 /nfs/dbraw/zinc/23/61/79/334236179.db2.gz WNQMQZCHZUBNFJ-HZPDHXFCSA-N 1 3 286.463 3.947 20 0 CHADHO C[C@@H]1C[C@H](N[C@H](c2ccc(F)cc2)C(C)(C)C)CC[N@@H+]1C ZINC000247065282 334274986 /nfs/dbraw/zinc/27/49/86/334274986.db2.gz PUUMSKAMCQQZLR-KBRIMQKVSA-N 1 3 292.442 3.985 20 0 CHADHO C[C@@H]1C[C@H](N[C@H](c2ccc(F)cc2)C(C)(C)C)CC[N@H+]1C ZINC000247065282 334274988 /nfs/dbraw/zinc/27/49/88/334274988.db2.gz PUUMSKAMCQQZLR-KBRIMQKVSA-N 1 3 292.442 3.985 20 0 CHADHO CCCN(CCC)CCC[NH2+]C1CCCCCC1 ZINC000551394644 334248880 /nfs/dbraw/zinc/24/88/80/334248880.db2.gz JHXDZUAZTXHEHZ-UHFFFAOYSA-N 1 3 254.462 3.811 20 0 CHADHO C[C@H](CCC(C)(C)C)[NH2+][C@H]1CCC[C@@H](N(C)C)C1 ZINC000551787757 334261109 /nfs/dbraw/zinc/26/11/09/334261109.db2.gz LWBIVFXJVXMQRO-QLFBSQMISA-N 1 3 254.462 3.664 20 0 CHADHO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)cc1 ZINC000247231208 334278056 /nfs/dbraw/zinc/27/80/56/334278056.db2.gz WZTRFVSULVPTKM-USXIJHARSA-N 1 3 260.425 3.518 20 0 CHADHO C[C@@H]1CCc2c(F)cccc2[C@@H]1N[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000247949352 334292123 /nfs/dbraw/zinc/29/21/23/334292123.db2.gz DXAVUFMQUADJBK-KHSSZTOVSA-N 1 3 290.426 3.521 20 0 CHADHO C[C@@H]1CCc2c(F)cccc2[C@@H]1N[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000247949352 334292124 /nfs/dbraw/zinc/29/21/24/334292124.db2.gz DXAVUFMQUADJBK-KHSSZTOVSA-N 1 3 290.426 3.521 20 0 CHADHO CC[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@H]2[C@H](CCCN2C)C1 ZINC000248157360 334296226 /nfs/dbraw/zinc/29/62/26/334296226.db2.gz RNQSWNDTVRPTIZ-NXHRZFHOSA-N 1 3 290.426 3.693 20 0 CHADHO CC[C@H](c1ccc(F)cc1)[N@H+]1CC[C@H]2[C@H](CCCN2C)C1 ZINC000248157360 334296227 /nfs/dbraw/zinc/29/62/27/334296227.db2.gz RNQSWNDTVRPTIZ-NXHRZFHOSA-N 1 3 290.426 3.693 20 0 CHADHO C[C@H](CC[N@@H+]1CC[C@H]2[C@@H](CCCN2C)C1)c1ccccc1 ZINC000248744287 334315671 /nfs/dbraw/zinc/31/56/71/334315671.db2.gz AQUZMLVODMBMNT-NEWSRXKRSA-N 1 3 286.463 3.596 20 0 CHADHO C[C@H](CC[N@H+]1CC[C@H]2[C@@H](CCCN2C)C1)c1ccccc1 ZINC000248744287 334315672 /nfs/dbraw/zinc/31/56/72/334315672.db2.gz AQUZMLVODMBMNT-NEWSRXKRSA-N 1 3 286.463 3.596 20 0 CHADHO CCCN1CC[C@H](C[NH2+]C[C@H](C)c2cccc(Cl)c2)C1 ZINC000249250160 334330379 /nfs/dbraw/zinc/33/03/79/334330379.db2.gz BWZBXTVZQLCQEC-LSDHHAIUSA-N 1 3 294.870 3.765 20 0 CHADHO C(CN1CCCCC1)C[N@@H+]1CCC[C@H]2CCCC[C@H]21 ZINC000249319608 334331957 /nfs/dbraw/zinc/33/19/57/334331957.db2.gz FYGJSYCMNMOEAN-IAGOWNOFSA-N 1 3 264.457 3.517 20 0 CHADHO C(CN1CCCCC1)C[N@H+]1CCC[C@H]2CCCC[C@H]21 ZINC000249319608 334331959 /nfs/dbraw/zinc/33/19/59/334331959.db2.gz FYGJSYCMNMOEAN-IAGOWNOFSA-N 1 3 264.457 3.517 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](Cc2ccccc2)C(C)C)C1 ZINC000249773832 334340283 /nfs/dbraw/zinc/34/02/83/334340283.db2.gz BZEVSBDEVZHCQV-RBUKOAKNSA-N 1 3 288.479 3.575 20 0 CHADHO CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCN2CCC[C@H]2C1 ZINC000250689124 334348582 /nfs/dbraw/zinc/34/85/82/334348582.db2.gz INPYPYTZPSAZOS-TWMKSMIVSA-N 1 3 278.484 3.808 20 0 CHADHO CC(C)C[C@H](N[C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000251383845 334360522 /nfs/dbraw/zinc/36/05/22/334360522.db2.gz IEDOGMLVVNUSIJ-FHWLQOOXSA-N 1 3 286.463 3.990 20 0 CHADHO CC(C)C[C@H](N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000251383845 334360523 /nfs/dbraw/zinc/36/05/23/334360523.db2.gz IEDOGMLVVNUSIJ-FHWLQOOXSA-N 1 3 286.463 3.990 20 0 CHADHO C[C@H](Cc1cccs1)N[C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000252658072 334384356 /nfs/dbraw/zinc/38/43/56/334384356.db2.gz RSZITHBBFVYVFR-RBSFLKMASA-N 1 3 280.481 3.580 20 0 CHADHO C1=C(CC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCCN2)CCCC1 ZINC000252658323 334384453 /nfs/dbraw/zinc/38/44/53/334384453.db2.gz YPZCODHOTFPPOF-KZNAEPCWSA-N 1 3 276.468 3.777 20 0 CHADHO C[C@H]1CCCCN1CCC[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000252711955 334386095 /nfs/dbraw/zinc/38/60/95/334386095.db2.gz LAMSXIJRCYUMQY-KSSFIOAISA-N 1 3 290.426 3.667 20 0 CHADHO C[C@@H]([NH2+]C1CCCCC1)c1ccc(OCCN(C)C)cc1 ZINC000152975563 334534225 /nfs/dbraw/zinc/53/42/25/334534225.db2.gz HTEKGCFDLHJZFO-OAHLLOKOSA-N 1 3 290.451 3.610 20 0 CHADHO Cc1cc(CN[C@@H](CCC[NH3+])c2ccccc2)c(C)s1 ZINC000579448673 335758534 /nfs/dbraw/zinc/75/85/34/335758534.db2.gz JNXFZMORGFTYAZ-KRWDZBQOSA-N 1 3 288.460 3.935 20 0 CHADHO [NH3+]Cc1ccc(CN[C@@H](c2ccc(F)cc2)C2CC2)cc1 ZINC000580774697 335965237 /nfs/dbraw/zinc/96/52/37/335965237.db2.gz AETCKQSIATUXAZ-GOSISDBHSA-N 1 3 284.378 3.525 20 0 CHADHO CC[C@H]([NH2+]CCCN1CCCCC1)c1ccsc1 ZINC000382159728 336083054 /nfs/dbraw/zinc/08/30/54/336083054.db2.gz UITYNDWDYURTPK-HNNXBMFYSA-N 1 3 266.454 3.665 20 0 CHADHO CSCC1CCC(N[C@@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC000385349141 336144640 /nfs/dbraw/zinc/14/46/40/336144640.db2.gz ZYXHZAQVXMZDOF-CXMPNGEBSA-N 1 3 290.476 3.643 20 0 CHADHO C[NH+](C)CCCC(C)(C)NCc1csc(C(C)(C)C)n1 ZINC000387274200 336190881 /nfs/dbraw/zinc/19/08/81/336190881.db2.gz DXHBUQJJBLMMPO-UHFFFAOYSA-N 1 3 297.512 3.651 20 0 CHADHO Cc1cc2cc(CN3CCC([C@@H](C)[NH3+])CC3)oc2cc1C ZINC000347111816 534085235 /nfs/dbraw/zinc/08/52/35/534085235.db2.gz PXPNRMYIDCCQJT-CQSZACIVSA-N 1 3 286.419 3.609 20 0 CHADHO C[C@@H](C[NH2+]CC(C)(C)CN1CCCC1)c1ccc(F)cc1 ZINC000480926655 518177425 /nfs/dbraw/zinc/17/74/25/518177425.db2.gz LIYUWXNKRUXQEV-HNNXBMFYSA-N 1 3 292.442 3.641 20 0 CHADHO CC(C)(CN[C@H]1C[C@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000157410267 519270805 /nfs/dbraw/zinc/27/08/05/519270805.db2.gz LGKSKJJUMUAKSC-ROUUACIJSA-N 1 3 280.415 3.699 20 0 CHADHO CC(C)Oc1cccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC000130111065 519783701 /nfs/dbraw/zinc/78/37/01/519783701.db2.gz KNMSIVAUNCBAMG-HLLBOEOZSA-N 1 3 290.451 3.607 20 0 CHADHO CC(C)Oc1cccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1 ZINC000130111065 519783702 /nfs/dbraw/zinc/78/37/02/519783702.db2.gz KNMSIVAUNCBAMG-HLLBOEOZSA-N 1 3 290.451 3.607 20 0 CHADHO CCCCN1CCC([NH2+][C@H](C)c2ccsc2)CC1 ZINC000050343284 520577592 /nfs/dbraw/zinc/57/75/92/520577592.db2.gz IUVQFSZLNSBSDU-CYBMUJFWSA-N 1 3 266.454 3.663 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N[C@H](C)c1ccc(C)o1 ZINC000019915077 520631799 /nfs/dbraw/zinc/63/17/99/520631799.db2.gz IOZYKTZJERQTRY-UKRRQHHQSA-N 1 3 266.429 3.749 20 0 CHADHO CC[NH+](CC)Cc1ccccc1CNCc1cccs1 ZINC000020129472 520759330 /nfs/dbraw/zinc/75/93/30/520759330.db2.gz GMKZFKJADNIRQC-UHFFFAOYSA-N 1 3 288.460 3.880 20 0 CHADHO CCC[C@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC000037062479 521153515 /nfs/dbraw/zinc/15/35/15/521153515.db2.gz LXDGQVIVYCZIGQ-FBVQUNGASA-N 1 3 272.436 3.743 20 0 CHADHO CCC[C@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC000037062479 521153519 /nfs/dbraw/zinc/15/35/19/521153519.db2.gz LXDGQVIVYCZIGQ-FBVQUNGASA-N 1 3 272.436 3.743 20 0 CHADHO CCC[C@H]([NH2+]CC(C)(C)CN1CCCC1)c1cccnc1 ZINC000276594622 521155128 /nfs/dbraw/zinc/15/51/28/521155128.db2.gz AMRCPDOFHYHNGP-KRWDZBQOSA-N 1 3 289.467 3.634 20 0 CHADHO C[NH+](C)Cc1cccc(CNCc2cccc3cc[nH]c32)c1 ZINC000237072274 521924873 /nfs/dbraw/zinc/92/48/73/521924873.db2.gz CIDUJBILSURTRV-UHFFFAOYSA-N 1 3 293.414 3.519 20 0 CHADHO C[NH2+]C[C@H]1CCCN([C@@H](C)c2ccc3ccccc3c2)C1 ZINC000040592687 522084817 /nfs/dbraw/zinc/08/48/17/522084817.db2.gz HUMWSHVFQIWHNJ-JKSUJKDBSA-N 1 3 282.431 3.832 20 0 CHADHO CC[C@@H](NCC1CC[NH+](C2CC2)CC1)c1ccccc1F ZINC000278449587 522820327 /nfs/dbraw/zinc/82/03/27/522820327.db2.gz LIOYNVHXQGSEDM-GOSISDBHSA-N 1 3 290.426 3.741 20 0 CHADHO CC[C@@H]1CCC[C@@H]([NH2+]C2CCN(c3ccncc3)CC2)C1 ZINC000068591791 523279838 /nfs/dbraw/zinc/27/98/38/523279838.db2.gz KUQATEJTLOYYMF-NVXWUHKLSA-N 1 3 287.451 3.609 20 0 CHADHO COc1cccc([C@H](C)[NH2+]C2CCN(C(C)(C)C)CC2)c1 ZINC000037786209 524151544 /nfs/dbraw/zinc/15/15/44/524151544.db2.gz ICEAVEWNVWCMGY-AWEZNQCLSA-N 1 3 290.451 3.609 20 0 CHADHO Cc1ccccc1C[C@H](C)N[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227538861 525198820 /nfs/dbraw/zinc/19/88/20/525198820.db2.gz MYRORJRFFBDDPQ-GDIGMMSISA-N 1 3 280.415 3.660 20 0 CHADHO C[C@H](NC1CCC([NH3+])CC1)c1cccc(Cl)c1Cl ZINC000235495305 525289639 /nfs/dbraw/zinc/28/96/39/525289639.db2.gz ALASNMWTRFVPSO-WHXUTIOJSA-N 1 3 287.234 3.914 20 0 CHADHO CC(C)(C)OCCCCN1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000354890197 526549507 /nfs/dbraw/zinc/54/95/07/526549507.db2.gz KETJUXAZEVOXDM-QGZVFWFLSA-N 1 3 296.499 3.532 20 0 CHADHO CCN1CC[C@H]([N@H+](C)Cc2ccc3ccccc3n2)C[C@H]1C ZINC000353749441 527834363 /nfs/dbraw/zinc/83/43/63/527834363.db2.gz KYYQWUJWBFSMNV-QAPCUYQASA-N 1 3 297.446 3.539 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)Cc2ccc3ccccc3n2)C[C@H]1C ZINC000353749441 527834367 /nfs/dbraw/zinc/83/43/67/527834367.db2.gz KYYQWUJWBFSMNV-QAPCUYQASA-N 1 3 297.446 3.539 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000417909174 529014861 /nfs/dbraw/zinc/01/48/61/529014861.db2.gz IBIXIGBDIHYSNH-WDSOQIARSA-N 1 3 286.463 3.500 20 0 CHADHO CC[C@@H](NCCC1CC[NH+](CC)CC1)c1ccccc1F ZINC000352794689 529160040 /nfs/dbraw/zinc/16/00/40/529160040.db2.gz HQJHMKNMPACESA-GOSISDBHSA-N 1 3 292.442 3.988 20 0 CHADHO CC[C@@H](NC1CC[NH+](CC)CC1)c1ccc(Cl)cc1 ZINC000037886393 1118043348 /nfs/dbraw/zinc/04/33/48/1118043348.db2.gz GDSUVTDTKIWNAL-MRXNPFEDSA-N 1 3 280.843 3.865 20 0 CHADHO CC[C@@H]([NH3+])CCN[C@@H](C)Cc1ccc(Cl)cc1Cl ZINC001246307713 1131456763 /nfs/dbraw/zinc/45/67/63/1131456763.db2.gz NXOKGETZQQVMMQ-GXFFZTMASA-N 1 3 289.250 3.641 20 0 CHADHO CCCC[N@@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001201723339 1123140960 /nfs/dbraw/zinc/14/09/60/1123140960.db2.gz YYZDWHJBXCFXFY-UHFFFAOYSA-N 1 3 252.446 3.515 20 0 CHADHO CCC[C@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccsc1 ZINC000191200544 1123396858 /nfs/dbraw/zinc/39/68/58/1123396858.db2.gz YGFOEIHFJVIEKP-CJNGLKHVSA-N 1 3 278.465 3.663 20 0 CHADHO CCC[C@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1ccsc1 ZINC000191200544 1123396863 /nfs/dbraw/zinc/39/68/63/1123396863.db2.gz YGFOEIHFJVIEKP-CJNGLKHVSA-N 1 3 278.465 3.663 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)C1CCC(F)(F)CC1 ZINC000474059250 1123406831 /nfs/dbraw/zinc/40/68/31/1123406831.db2.gz NYKUSFRUWIUPKP-QEJZJMRPSA-N 1 3 288.426 3.663 20 0 CHADHO CC[C@H](NCC1=CC[N@H+](C)CC1)c1sccc1Cl ZINC000883210410 1125378334 /nfs/dbraw/zinc/37/83/34/1125378334.db2.gz TWAWVNBJHICVBG-ZDUSSCGKSA-N 1 3 284.856 3.704 20 0 CHADHO CC[C@H](NCC1=CC[N@@H+](C)CC1)c1sccc1Cl ZINC000883210410 1125378336 /nfs/dbraw/zinc/37/83/36/1125378336.db2.gz TWAWVNBJHICVBG-ZDUSSCGKSA-N 1 3 284.856 3.704 20 0 CHADHO CC[C@H](C)C[C@H](CC)N1CCC[C@]2(CCCC[NH2+]2)C1 ZINC001246614258 1131718424 /nfs/dbraw/zinc/71/84/24/1131718424.db2.gz NMDJOMUSOZZGAC-YESZJQIVSA-N 1 3 266.473 3.809 20 0 CHADHO CC[C@H](C)C[C@H](CC)[N@@H+]1CCC[C@]2(CCCCN2)C1 ZINC001246614258 1131718429 /nfs/dbraw/zinc/71/84/29/1131718429.db2.gz NMDJOMUSOZZGAC-YESZJQIVSA-N 1 3 266.473 3.809 20 0 CHADHO CC[C@H](C)C[C@H](CC)[N@H+]1CCC[C@]2(CCCCN2)C1 ZINC001246614258 1131718434 /nfs/dbraw/zinc/71/84/34/1131718434.db2.gz NMDJOMUSOZZGAC-YESZJQIVSA-N 1 3 266.473 3.809 20 0 CHADHO CCCC[C@H]1C[C@@H]([N@@H+]2CCC3(CCCC3)C2)CCN1 ZINC001246810141 1131783779 /nfs/dbraw/zinc/78/37/79/1131783779.db2.gz YEDPAAAWXPKVQM-HOTGVXAUSA-N 1 3 264.457 3.563 20 0 CHADHO CCCC[C@H]1C[C@@H]([N@H+]2CCC3(CCCC3)C2)CCN1 ZINC001246810141 1131783785 /nfs/dbraw/zinc/78/37/85/1131783785.db2.gz YEDPAAAWXPKVQM-HOTGVXAUSA-N 1 3 264.457 3.563 20 0 CHADHO CCSC[C@H](C)N(C)C1CC[NH+](C2CCCCC2)CC1 ZINC001173308606 1132449442 /nfs/dbraw/zinc/44/94/42/1132449442.db2.gz NKNUOUJVACRVAE-HNNXBMFYSA-N 1 3 298.540 3.857 20 0 CHADHO CCSC[C@H](C)[N@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001173308606 1132449444 /nfs/dbraw/zinc/44/94/44/1132449444.db2.gz NKNUOUJVACRVAE-HNNXBMFYSA-N 1 3 298.540 3.857 20 0 CHADHO CCSC[C@H](C)[N@@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001173308606 1132449447 /nfs/dbraw/zinc/44/94/47/1132449447.db2.gz NKNUOUJVACRVAE-HNNXBMFYSA-N 1 3 298.540 3.857 20 0 CHADHO CSc1cc(C)ccc1C[NH2+][C@@H]1C[C@H](C)N(C)C[C@@H]1C ZINC000119274183 1125531358 /nfs/dbraw/zinc/53/13/58/1125531358.db2.gz LLDZLMIAFUHIBP-OFQRWUPVSA-N 1 3 292.492 3.535 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](C)c2ccc(SC)c(F)c2)C1 ZINC000247106803 1125654836 /nfs/dbraw/zinc/65/48/36/1125654836.db2.gz QGJOWYCIVHVYIH-OLZOCXBDSA-N 1 3 296.455 3.540 20 0 CHADHO Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H](N(C)C)C2)s1 ZINC000247156477 1125655319 /nfs/dbraw/zinc/65/53/19/1125655319.db2.gz RSRSTIPJWHDMNS-MELADBBJSA-N 1 3 266.454 3.580 20 0 CHADHO CC[C@@H]1CN([C@H](C)c2ccc(C(C)C)cc2)CC[C@H]1[NH3+] ZINC000251899226 1126800057 /nfs/dbraw/zinc/80/00/57/1126800057.db2.gz WQNYHCPRIPLOBK-IIDMSEBBSA-N 1 3 274.452 3.930 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCc3cc(Cl)ccc32)C1 ZINC000484467587 1126817105 /nfs/dbraw/zinc/81/71/05/1126817105.db2.gz AALNQNYLLPEOGJ-INMHGKMJSA-N 1 3 292.854 3.790 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1ccc2c(c1)CCC2 ZINC000484488290 1126819585 /nfs/dbraw/zinc/81/95/85/1126819585.db2.gz HHWDMDPOAZDZJX-ZOCIIQOWSA-N 1 3 286.463 3.699 20 0 CHADHO C[C@@H]([NH2+]C1CCN(C2CCCCC2)CC1)[C@H]1CC1(C)C ZINC000487275470 1127027522 /nfs/dbraw/zinc/02/75/22/1127027522.db2.gz PFSQUBINSIQHME-RHSMWYFYSA-N 1 3 278.484 3.808 20 0 CHADHO Cc1cccc([C@H](C)NC2CC[NH+](C3CCC3)CC2)c1C ZINC000269003767 1127031402 /nfs/dbraw/zinc/03/14/02/1127031402.db2.gz MENGLDGYJIXQKM-INIZCTEOSA-N 1 3 286.463 3.971 20 0 CHADHO Cc1ccc([C@H](C)NC2CC[NH+](C3CCC3)CC2)cc1C ZINC000269031820 1127033073 /nfs/dbraw/zinc/03/30/73/1127033073.db2.gz RYVMFESZTLMKFK-INIZCTEOSA-N 1 3 286.463 3.971 20 0 CHADHO c1ccc([C@@H]2C[C@@H]2C[NH2+]C[C@@H]2CCCN(CC3CC3)C2)cc1 ZINC000668819679 1127054241 /nfs/dbraw/zinc/05/42/41/1127054241.db2.gz PSHPKJLUBUDFAN-SXLOBPIMSA-N 1 3 298.474 3.502 20 0 CHADHO Cc1cc([C@H](N[C@H]2CC[N@H+](C)[C@@H](C)C2)C2CC2)ccc1F ZINC000271540235 1127090028 /nfs/dbraw/zinc/09/00/28/1127090028.db2.gz QSXOZFJPAXQQGG-QANKJYHBSA-N 1 3 290.426 3.658 20 0 CHADHO Cc1cc([C@H](N[C@H]2CC[N@@H+](C)[C@@H](C)C2)C2CC2)ccc1F ZINC000271540235 1127090031 /nfs/dbraw/zinc/09/00/31/1127090031.db2.gz QSXOZFJPAXQQGG-QANKJYHBSA-N 1 3 290.426 3.658 20 0 CHADHO C[N@H+](Cc1cccc(Cl)c1)C1CCN(CC2CC2)CC1 ZINC001168379395 1127162681 /nfs/dbraw/zinc/16/26/81/1127162681.db2.gz JJUZEHMCISWIEO-UHFFFAOYSA-N 1 3 292.854 3.646 20 0 CHADHO C[N@@H+](Cc1cccc(Cl)c1)C1CCN(CC2CC2)CC1 ZINC001168379395 1127162684 /nfs/dbraw/zinc/16/26/84/1127162684.db2.gz JJUZEHMCISWIEO-UHFFFAOYSA-N 1 3 292.854 3.646 20 0 CHADHO CCCC[C@H](C)[C@H](C)[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000571960811 1127183523 /nfs/dbraw/zinc/18/35/23/1127183523.db2.gz OAQMJWGDTSFBHR-JYJNAYRXSA-N 1 3 254.462 3.521 20 0 CHADHO CCCC[C@H](C)[C@H](C)[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000571960810 1127184078 /nfs/dbraw/zinc/18/40/78/1127184078.db2.gz OAQMJWGDTSFBHR-HRCADAONSA-N 1 3 254.462 3.521 20 0 CHADHO CC(C)C(CN1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1)C(C)C ZINC000572489932 1127201625 /nfs/dbraw/zinc/20/16/25/1127201625.db2.gz JUHCEHRWOYNVDA-VQIMIIECSA-N 1 3 292.511 3.863 20 0 CHADHO CC(C)C(CN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)C(C)C ZINC000572489932 1127201626 /nfs/dbraw/zinc/20/16/26/1127201626.db2.gz JUHCEHRWOYNVDA-VQIMIIECSA-N 1 3 292.511 3.863 20 0 CHADHO CC1(C)C[N@@H+](C2CCN(CC3CC3)CC2)Cc2ccccc21 ZINC001168388666 1127216816 /nfs/dbraw/zinc/21/68/16/1127216816.db2.gz FATBCAWANRCQCM-UHFFFAOYSA-N 1 3 298.474 3.654 20 0 CHADHO CC1(C)C[N@H+](C2CCN(CC3CC3)CC2)Cc2ccccc21 ZINC001168388666 1127216819 /nfs/dbraw/zinc/21/68/19/1127216819.db2.gz FATBCAWANRCQCM-UHFFFAOYSA-N 1 3 298.474 3.654 20 0 CHADHO CN1[C@@H]2CC[C@H]1CC([N@H+](C)Cc1ccc(C(F)F)cc1)C2 ZINC000285669185 1127240841 /nfs/dbraw/zinc/24/08/41/1127240841.db2.gz ZPABMDWLAOZWRT-XYPWUTKMSA-N 1 3 294.389 3.681 20 0 CHADHO CN1[C@@H]2CC[C@H]1CC([N@@H+](C)Cc1ccc(C(F)F)cc1)C2 ZINC000285669185 1127240843 /nfs/dbraw/zinc/24/08/43/1127240843.db2.gz ZPABMDWLAOZWRT-XYPWUTKMSA-N 1 3 294.389 3.681 20 0 CHADHO CCC[N@@H+]1CCC[C@@H]1CN[C@@H](CC)c1ccc(OC)cc1 ZINC000353973018 1127282341 /nfs/dbraw/zinc/28/23/41/1127282341.db2.gz PCXYSGREXDIMJX-AEFFLSMTSA-N 1 3 290.451 3.610 20 0 CHADHO CCC[N@H+]1CCC[C@@H]1CN[C@@H](CC)c1ccc(OC)cc1 ZINC000353973018 1127282344 /nfs/dbraw/zinc/28/23/44/1127282344.db2.gz PCXYSGREXDIMJX-AEFFLSMTSA-N 1 3 290.451 3.610 20 0 CHADHO Cc1ccc(C2=CC[N@H+](CC[C@H]3CCCCN3C)CC2)cc1 ZINC000760804939 1127283008 /nfs/dbraw/zinc/28/30/08/1127283008.db2.gz GTDSPGAVZAQQJP-HXUWFJFHSA-N 1 3 298.474 3.959 20 0 CHADHO Cc1ccc(C2=CC[N@@H+](CC[C@H]3CCCCN3C)CC2)cc1 ZINC000760804939 1127283011 /nfs/dbraw/zinc/28/30/11/1127283011.db2.gz GTDSPGAVZAQQJP-HXUWFJFHSA-N 1 3 298.474 3.959 20 0 CHADHO CC[C@H](CN[C@H](CC)c1ccc(OC)cc1)[NH+]1CCCC1 ZINC000360089451 1127489164 /nfs/dbraw/zinc/48/91/64/1127489164.db2.gz UANNJFSODIPWHW-SJLPKXTDSA-N 1 3 290.451 3.610 20 0 CHADHO CC[NH+]1CCC(NCc2cc(C)cc3c(C)c(C)[nH]c32)CC1 ZINC000360250047 1127494307 /nfs/dbraw/zinc/49/43/07/1127494307.db2.gz GSFORTFZLNGAOU-UHFFFAOYSA-N 1 3 299.462 3.667 20 0 CHADHO CC[C@@H]1CCC[C@@H](CN2CCC([NH2+]C3CCC3)CC2)C1 ZINC001308970073 1127623462 /nfs/dbraw/zinc/62/34/62/1127623462.db2.gz BJAKSGODTNEOIN-HZPDHXFCSA-N 1 3 278.484 3.809 20 0 CHADHO c1cc2cc(CNC3CC[NH+](C4CC4)CC3)ccc2s1 ZINC000297349494 1127693948 /nfs/dbraw/zinc/69/39/48/1127693948.db2.gz FWUZUBYXNVIZPO-UHFFFAOYSA-N 1 3 286.444 3.618 20 0 CHADHO C/C(=C\c1ccccc1)C[N@H+]1CCCC12CCN(C)CC2 ZINC000669712935 1127702174 /nfs/dbraw/zinc/70/21/74/1127702174.db2.gz ALCXJCYXZBCDPU-BMRADRMJSA-N 1 3 284.447 3.650 20 0 CHADHO C/C(=C\c1ccccc1)C[N@@H+]1CCCC12CCN(C)CC2 ZINC000669712935 1127702176 /nfs/dbraw/zinc/70/21/76/1127702176.db2.gz ALCXJCYXZBCDPU-BMRADRMJSA-N 1 3 284.447 3.650 20 0 CHADHO CCN(CC)CCC[NH2+][C@]1(C)CCCc2ccccc21 ZINC001168422793 1127798019 /nfs/dbraw/zinc/79/80/19/1127798019.db2.gz AZFFKPPGAGOPEZ-GOSISDBHSA-N 1 3 274.452 3.560 20 0 CHADHO C[C@H](CN[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cccc(Cl)c1 ZINC000372459311 1127799886 /nfs/dbraw/zinc/79/98/86/1127799886.db2.gz BVYJZJYUNYHRCO-XOKHGSTOSA-N 1 3 292.854 3.660 20 0 CHADHO C[C@H](CN[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc(Cl)c1 ZINC000372459311 1127799887 /nfs/dbraw/zinc/79/98/87/1127799887.db2.gz BVYJZJYUNYHRCO-XOKHGSTOSA-N 1 3 292.854 3.660 20 0 CHADHO CCCc1ccc(CNC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC000608065579 1127843088 /nfs/dbraw/zinc/84/30/88/1127843088.db2.gz OEKRFSXHSTZHPD-YQQQUEKLSA-N 1 3 286.463 3.744 20 0 CHADHO CCCc1ccc(CNC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC000608065579 1127843092 /nfs/dbraw/zinc/84/30/92/1127843092.db2.gz OEKRFSXHSTZHPD-YQQQUEKLSA-N 1 3 286.463 3.744 20 0 CHADHO CC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCCN(CC(C)C)C1 ZINC000540147243 1127963292 /nfs/dbraw/zinc/96/32/92/1127963292.db2.gz HUZCLOZOELOZCM-BRWVUGGUSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)[NH+]1CCC(N[C@@H](CC2CC2)c2ccccc2)CC1 ZINC000540172870 1127965951 /nfs/dbraw/zinc/96/59/51/1127965951.db2.gz BJLHYWMHIBEHPS-IBGZPJMESA-N 1 3 286.463 3.990 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]CC[C@@H](C)N2CCCCC2)s1 ZINC000544373896 1127970365 /nfs/dbraw/zinc/97/03/65/1127970365.db2.gz XIGVRJXOVPAHCV-HIFRSBDPSA-N 1 3 280.481 3.972 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](c2ccc(C)o2)C2CCCC2)C1 ZINC000540475301 1127979524 /nfs/dbraw/zinc/97/95/24/1127979524.db2.gz MLAVUTAKUITNTG-MAUKXSAKSA-N 1 3 290.451 3.751 20 0 CHADHO C[C@H]1C[C@@H](NCc2cccc(-c3ccccc3)c2)CC[N@@H+]1C ZINC000540606898 1127985918 /nfs/dbraw/zinc/98/59/18/1127985918.db2.gz INVUPOGQARTBOV-JXFKEZNVSA-N 1 3 294.442 3.926 20 0 CHADHO C[C@H]1C[C@@H](NCc2cccc(-c3ccccc3)c2)CC[N@H+]1C ZINC000540606898 1127985919 /nfs/dbraw/zinc/98/59/19/1127985919.db2.gz INVUPOGQARTBOV-JXFKEZNVSA-N 1 3 294.442 3.926 20 0 CHADHO CC[C@H](c1ccccc1)[C@H]1CCC[N@@H+]1C[C@H]1CCCNC1 ZINC000469873907 1128057031 /nfs/dbraw/zinc/05/70/31/1128057031.db2.gz OJCKOMXSKLRRCO-QXAKKESOSA-N 1 3 286.463 3.644 20 0 CHADHO CC[C@H](c1ccccc1)[C@H]1CCC[N@H+]1C[C@H]1CCCNC1 ZINC000469873907 1128057035 /nfs/dbraw/zinc/05/70/35/1128057035.db2.gz OJCKOMXSKLRRCO-QXAKKESOSA-N 1 3 286.463 3.644 20 0 CHADHO CC(C)([NH3+])CN1CCC[C@H]1c1cccc2ccccc21 ZINC000469874223 1128057256 /nfs/dbraw/zinc/05/72/56/1128057256.db2.gz WMOIMKYTRYTFPY-KRWDZBQOSA-N 1 3 268.404 3.714 20 0 CHADHO CC(C)CCN1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000303209972 1128059927 /nfs/dbraw/zinc/05/99/27/1128059927.db2.gz QYONEGNIWBXOPO-KRWDZBQOSA-N 1 3 266.473 3.621 20 0 CHADHO Cc1cc(CN2CCC([C@@H]3CCC[NH2+]3)CC2)ccc1Cl ZINC000470014491 1128061351 /nfs/dbraw/zinc/06/13/51/1128061351.db2.gz APLXGGBBLXBUJC-KRWDZBQOSA-N 1 3 292.854 3.612 20 0 CHADHO CC(C)[NH+](CCCNc1ccnc2ccccc21)C(C)C ZINC000470862170 1128078932 /nfs/dbraw/zinc/07/89/32/1128078932.db2.gz FMNDSJQUOANXDK-UHFFFAOYSA-N 1 3 285.435 3.578 20 0 CHADHO CCC[C@@H](CC)[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001257251551 1128094112 /nfs/dbraw/zinc/09/41/12/1128094112.db2.gz RSXOVTLPLOARAP-CYBMUJFWSA-N 1 3 254.462 3.806 20 0 CHADHO CC(C)(C)[C@H]([NH2+]C1CCN(C2CCCC2)CC1)C1CC1 ZINC000925222431 1128125903 /nfs/dbraw/zinc/12/59/03/1128125903.db2.gz VSSLVIYHQDVMGI-QGZVFWFLSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@H](Cc1ccccc1Cl)[NH2+][C@H]1CCC[C@H](N(C)C)C1 ZINC000715278261 1128360158 /nfs/dbraw/zinc/36/01/58/1128360158.db2.gz PTBADRMSGITFFY-KBMXLJTQSA-N 1 3 294.870 3.733 20 0 CHADHO Cc1ccc([C@@H]([NH2+]CCCN2CCCC2)C2CC2)cc1 ZINC000037229480 1128424806 /nfs/dbraw/zinc/42/48/06/1128424806.db2.gz BOGZMPVHZXSVRR-GOSISDBHSA-N 1 3 272.436 3.522 20 0 CHADHO Cc1ccc([C@@H](NCCC[NH+]2CCCC2)C2CC2)cc1 ZINC000037229480 1128424808 /nfs/dbraw/zinc/42/48/08/1128424808.db2.gz BOGZMPVHZXSVRR-GOSISDBHSA-N 1 3 272.436 3.522 20 0 CHADHO CCCc1ccc([C@H](C)NC[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000037649258 1128435136 /nfs/dbraw/zinc/43/51/36/1128435136.db2.gz LTGCRVDHINGBPX-DOTOQJQBSA-N 1 3 286.463 3.774 20 0 CHADHO CCCc1ccc([C@H](C)NC[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000037649258 1128435139 /nfs/dbraw/zinc/43/51/39/1128435139.db2.gz LTGCRVDHINGBPX-DOTOQJQBSA-N 1 3 286.463 3.774 20 0 CHADHO Cc1cc(C)c(C[NH2+]C2CCN(C(C)(C)C)CC2)c(C)c1 ZINC000037786301 1128436051 /nfs/dbraw/zinc/43/60/51/1128436051.db2.gz RDPOMFRBCDVCGD-UHFFFAOYSA-N 1 3 288.479 3.964 20 0 CHADHO C[C@H](CN[C@@H](C)c1ccc2c(c1)CCC2)C[NH+]1CCCC1 ZINC000062078268 1128437076 /nfs/dbraw/zinc/43/70/76/1128437076.db2.gz QWDHFTIDIJGWAA-CVEARBPZSA-N 1 3 286.463 3.558 20 0 CHADHO CC(C)[C@@H](NC[C@@H](C)C[NH+]1CCCC1)c1ccccc1 ZINC000062078836 1128437200 /nfs/dbraw/zinc/43/72/00/1128437200.db2.gz NZARNNYHUSSJMF-SJLPKXTDSA-N 1 3 274.452 3.705 20 0 CHADHO CC(C)[C@@H]([NH2+]C[C@@H](C)CN1CCCC1)c1ccccc1 ZINC000062078836 1128437202 /nfs/dbraw/zinc/43/72/02/1128437202.db2.gz NZARNNYHUSSJMF-SJLPKXTDSA-N 1 3 274.452 3.705 20 0 CHADHO C[C@H](C[NH2+]C[C@H](C)c1ccccc1)CN1CCCCC1 ZINC000037997576 1128438258 /nfs/dbraw/zinc/43/82/58/1128438258.db2.gz HAKFHFURGFSVKZ-SJORKVTESA-N 1 3 274.452 3.502 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCc1ccc(-c2ccc(F)cc2)s1 ZINC000563135066 1128451772 /nfs/dbraw/zinc/45/17/72/1128451772.db2.gz DSYJWRHZALBCNI-RYUDHWBXSA-N 1 3 292.423 3.770 20 0 CHADHO C[C@@H](N[C@H](CC[NH+](C)C)C(C)(C)C)c1cccs1 ZINC000125890792 1128455730 /nfs/dbraw/zinc/45/57/30/1128455730.db2.gz OHJYFKSDQWJIDW-TZMCWYRMSA-N 1 3 268.470 3.765 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]C2CCC3(CCCC3)CC2)C1 ZINC000129343319 1128537483 /nfs/dbraw/zinc/53/74/83/1128537483.db2.gz DULUREKXFCZWKT-MRXNPFEDSA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H]2CCCC23CCCC3)C1 ZINC000556076216 1128544729 /nfs/dbraw/zinc/54/47/29/1128544729.db2.gz LIYRRDRCNBCCML-IAGOWNOFSA-N 1 3 278.484 3.809 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCCC23CCCC3)C1 ZINC000556104427 1128545713 /nfs/dbraw/zinc/54/57/13/1128545713.db2.gz WIKLUMJBJSWMEM-XHSDSOJGSA-N 1 3 264.457 3.562 20 0 CHADHO CN1CCC2(CCC[N@@H+]2CCCC2CCCCC2)CC1 ZINC000566824432 1128552256 /nfs/dbraw/zinc/55/22/56/1128552256.db2.gz XNSOBBMTSGSHCU-UHFFFAOYSA-N 1 3 278.484 3.907 20 0 CHADHO CN1CCC2(CCC[N@H+]2CCCC2CCCCC2)CC1 ZINC000566824432 1128552258 /nfs/dbraw/zinc/55/22/58/1128552258.db2.gz XNSOBBMTSGSHCU-UHFFFAOYSA-N 1 3 278.484 3.907 20 0 CHADHO C[C@H]1C[C@@H]([NH2+]CC(C)(C)CN(C)C)c2ccsc2S1 ZINC000130163330 1128569719 /nfs/dbraw/zinc/56/97/19/1128569719.db2.gz HPLLKWWWQCKTSF-WCQYABFASA-N 1 3 298.521 3.851 20 0 CHADHO CCN1CCC[C@@H](C[NH2+][C@@H](C)c2cc3ccccc3o2)C1 ZINC000567718567 1128570651 /nfs/dbraw/zinc/57/06/51/1128570651.db2.gz GYAXLBMSWDYBOV-GJZGRUSLSA-N 1 3 286.419 3.815 20 0 CHADHO CC(C)[C@H](CN(C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1 ZINC000567864806 1128572908 /nfs/dbraw/zinc/57/29/08/1128572908.db2.gz RSPUYPZKNOZNOQ-SWDXFRIISA-N 1 3 286.463 3.641 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC(C)(C)C1)[C@@H]1CCCN(C2CCC2)C1 ZINC000568137408 1128579030 /nfs/dbraw/zinc/57/90/30/1128579030.db2.gz AXTWFTLUTGVJQA-XHSDSOJGSA-N 1 3 278.484 3.808 20 0 CHADHO CC[NH+]1CCC(N[C@@H]2C[C@H](C)c3c2cccc3C)CC1 ZINC000152627232 1128614971 /nfs/dbraw/zinc/61/49/71/1128614971.db2.gz AMGMWHGOZXHJQP-WMLDXEAASA-N 1 3 272.436 3.617 20 0 CHADHO CC[NH+]1CCC(N[C@H]2C[C@H](C)c3c2cccc3C)CC1 ZINC000152627343 1128615154 /nfs/dbraw/zinc/61/51/54/1128615154.db2.gz AMGMWHGOZXHJQP-YOEHRIQHSA-N 1 3 272.436 3.617 20 0 CHADHO CC1=C[C@H](C)C[C@@H](C[NH2+]C[C@H]2CCCN(C(C)C)C2)C1 ZINC000578513864 1128720249 /nfs/dbraw/zinc/72/02/49/1128720249.db2.gz POSDZQTZSVWRDY-CGTJXYLNSA-N 1 3 278.484 3.689 20 0 CHADHO CCC(CC)(CNC1CC[NH+](C2CCCCC2)CC1)OC ZINC000430154527 1117786416 /nfs/dbraw/zinc/78/64/16/1117786416.db2.gz XIQONBJWYSHODO-UHFFFAOYSA-N 1 3 296.499 3.578 20 0 CHADHO CCC(CC)(C[NH2+]C1CCN(C2CCCCC2)CC1)OC ZINC000430154527 1117786421 /nfs/dbraw/zinc/78/64/21/1117786421.db2.gz XIQONBJWYSHODO-UHFFFAOYSA-N 1 3 296.499 3.578 20 0 CHADHO CC[NH+]1CCC(N[C@H](C)c2ccc(C(C)C)cc2)CC1 ZINC000034996120 1117789657 /nfs/dbraw/zinc/78/96/57/1117789657.db2.gz FXEUJFWGLXYICM-OAHLLOKOSA-N 1 3 274.452 3.945 20 0 CHADHO c1ccc([C@H](CC2CC2)N[C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000643546016 1117792049 /nfs/dbraw/zinc/79/20/49/1117792049.db2.gz HAYCSKQGBPAMIE-MSOLQXFVSA-N 1 3 284.447 3.792 20 0 CHADHO c1ccc([C@H](CC2CC2)N[C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000643546018 1117792723 /nfs/dbraw/zinc/79/27/23/1117792723.db2.gz HAYCSKQGBPAMIE-ROUUACIJSA-N 1 3 284.447 3.792 20 0 CHADHO C[C@H]([NH2+][C@H]1CCNC2(CCC2)C1)[C@@H](C)C1CCCCC1 ZINC000643546866 1117794720 /nfs/dbraw/zinc/79/47/20/1117794720.db2.gz VZCDHCMBYYHSDY-VYDXJSESSA-N 1 3 278.484 3.856 20 0 CHADHO CCC[C@@H]([NH2+][C@@H]1CCNC2(CCC2)C1)C1CCCC1 ZINC000643547244 1117797847 /nfs/dbraw/zinc/79/78/47/1117797847.db2.gz BVJZOTOAJZBYES-HZPDHXFCSA-N 1 3 264.457 3.610 20 0 CHADHO C[C@H](CN1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1)C(C)(C)C ZINC000670265660 1117828327 /nfs/dbraw/zinc/82/83/27/1117828327.db2.gz PAEJAAUEDXDFKP-BFYDXBDKSA-N 1 3 278.484 3.617 20 0 CHADHO C[C@H](CN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)C(C)(C)C ZINC000670265660 1117828331 /nfs/dbraw/zinc/82/83/31/1117828331.db2.gz PAEJAAUEDXDFKP-BFYDXBDKSA-N 1 3 278.484 3.617 20 0 CHADHO CC[C@@H](N[C@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(OC)cc1 ZINC000623339767 1117838402 /nfs/dbraw/zinc/83/84/02/1117838402.db2.gz JNDPLNFGKHLEAB-DOTOQJQBSA-N 1 3 290.451 3.609 20 0 CHADHO CC[C@@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(OC)cc1 ZINC000623339767 1117838410 /nfs/dbraw/zinc/83/84/10/1117838410.db2.gz JNDPLNFGKHLEAB-DOTOQJQBSA-N 1 3 290.451 3.609 20 0 CHADHO C[C@H](CC[NH2+]C[C@@H](C)C(C)(C)C)N1CCCCC1 ZINC000670269053 1117848791 /nfs/dbraw/zinc/84/87/91/1117848791.db2.gz LDXARHGUSLQCHE-HUUCEWRRSA-N 1 3 254.462 3.523 20 0 CHADHO CC[C@@H]([NH2+][C@H]1CCN(C)C(C)(C)C1)c1ccc(F)cc1F ZINC000623426461 1117853500 /nfs/dbraw/zinc/85/35/00/1117853500.db2.gz MNRNYZOXSRKUGD-XJKSGUPXSA-N 1 3 296.405 3.878 20 0 CHADHO CCCN1C[C@@H]2C[N@@H+](CC[C@H](C)CC(C)(C)C)C[C@@H]2C1 ZINC001208667087 1117906303 /nfs/dbraw/zinc/90/63/03/1117906303.db2.gz XLJKIWQPRSBJLZ-YESZJQIVSA-N 1 3 280.500 3.722 20 0 CHADHO CCCN1C[C@@H]2C[N@H+](CC[C@H](C)CC(C)(C)C)C[C@@H]2C1 ZINC001208667087 1117906306 /nfs/dbraw/zinc/90/63/06/1117906306.db2.gz XLJKIWQPRSBJLZ-YESZJQIVSA-N 1 3 280.500 3.722 20 0 CHADHO CCC[N@H+]1C[C@H]2CN(CC[C@H](C)CC(C)(C)C)C[C@H]2C1 ZINC001208667087 1117906309 /nfs/dbraw/zinc/90/63/09/1117906309.db2.gz XLJKIWQPRSBJLZ-YESZJQIVSA-N 1 3 280.500 3.722 20 0 CHADHO CCC[N@@H+]1C[C@H]2CN(CC[C@H](C)CC(C)(C)C)C[C@H]2C1 ZINC001208667087 1117906311 /nfs/dbraw/zinc/90/63/11/1117906311.db2.gz XLJKIWQPRSBJLZ-YESZJQIVSA-N 1 3 280.500 3.722 20 0 CHADHO Cc1cc([C@@H](C)NC2CC[NH+](C3CC3)CC2)c(C)s1 ZINC000037140811 1117969988 /nfs/dbraw/zinc/96/99/88/1117969988.db2.gz PNOIJTCTVODDMV-GFCCVEGCSA-N 1 3 278.465 3.642 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@@H](C)Cc2ccc(Cl)cc2)C1 ZINC000232649253 1117972118 /nfs/dbraw/zinc/97/21/18/1117972118.db2.gz MLYBTVPKRWLRNP-HOCLYGCPSA-N 1 3 294.870 3.591 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000624123077 1117984676 /nfs/dbraw/zinc/98/46/76/1117984676.db2.gz FNNGLJWSOUWZCO-LVQVYYBASA-N 1 3 292.492 3.562 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@@H]2CCc3cc(Cl)ccc32)C1 ZINC000624120889 1117985427 /nfs/dbraw/zinc/98/54/27/1117985427.db2.gz JJOSSXXSVVUCJJ-CXAGYDPISA-N 1 3 292.854 3.649 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)C(C)(C)c1ccccc1 ZINC000624122078 1117985832 /nfs/dbraw/zinc/98/58/32/1117985832.db2.gz JFNKEVITKRHERS-SJORKVTESA-N 1 3 288.479 3.674 20 0 CHADHO CCc1ccc([C@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)cc1 ZINC000624120220 1117986170 /nfs/dbraw/zinc/98/61/70/1117986170.db2.gz UOKPMHVXUIUPNQ-RDJZCZTQSA-N 1 3 274.452 3.632 20 0 CHADHO CC(C)[C@@H](C[NH2+]C[C@H]1CCN(C(C)C)C1)c1ccccc1 ZINC000232717112 1117988728 /nfs/dbraw/zinc/98/87/28/1117988728.db2.gz ULQLUEHZVOXXFG-IEBWSBKVSA-N 1 3 288.479 3.746 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]C[C@@H](C)Cc2ccccc2)C1 ZINC000182060533 1118013020 /nfs/dbraw/zinc/01/30/20/1118013020.db2.gz DVDMLAHUYYUNHQ-PKOBYXMFSA-N 1 3 288.479 3.575 20 0 CHADHO Clc1cc(Cl)cc(C[NH2+]C[C@@H]2CCN(C3CC3)C2)c1 ZINC000037649484 1118034207 /nfs/dbraw/zinc/03/42/07/1118034207.db2.gz FZNMKULXZOTGGN-NSHDSACASA-N 1 3 299.245 3.567 20 0 CHADHO Clc1cc(Cl)cc(C[NH2+]C[C@H]2CCN(C3CC3)C2)c1 ZINC000037649485 1118034937 /nfs/dbraw/zinc/03/49/37/1118034937.db2.gz FZNMKULXZOTGGN-LLVKDONJSA-N 1 3 299.245 3.567 20 0 CHADHO CCC[C@@H]([NH2+]CCCN1CCC(C)CC1)c1cccnc1 ZINC000184898319 1118058018 /nfs/dbraw/zinc/05/80/18/1118058018.db2.gz ZZJFJBYBFLHXQX-GOSISDBHSA-N 1 3 289.467 3.634 20 0 CHADHO C[C@H](C[NH2+][C@H](C)CSC(C)(C)C)CN1CCCCC1 ZINC000765240684 1118140178 /nfs/dbraw/zinc/14/01/78/1118140178.db2.gz WCELPZFMKDVMJI-HUUCEWRRSA-N 1 3 286.529 3.618 20 0 CHADHO C[C@@H]([NH2+][C@H]1CC[C@@H](C)SC1)[C@H]1CCCN(C2CCC2)C1 ZINC000655750401 1118202357 /nfs/dbraw/zinc/20/23/57/1118202357.db2.gz AEYIZONCNPBFKY-WCVJEAGWSA-N 1 3 296.524 3.513 20 0 CHADHO C[C@H]([NH2+][C@H]1CC[C@@H](C)SC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000655750399 1118203533 /nfs/dbraw/zinc/20/35/33/1118203533.db2.gz AEYIZONCNPBFKY-QXSJWSMHSA-N 1 3 296.524 3.513 20 0 CHADHO C[C@H]([NH2+][C@H]1CC[C@@H](C)SC1)[C@H]1CCCN(C2CCC2)C1 ZINC000655750400 1118203638 /nfs/dbraw/zinc/20/36/38/1118203638.db2.gz AEYIZONCNPBFKY-UGUYLWEFSA-N 1 3 296.524 3.513 20 0 CHADHO c1cc(CCNC2CC[NH+](C3CCCCC3)CC2)cs1 ZINC000122952359 1118300346 /nfs/dbraw/zinc/30/03/46/1118300346.db2.gz IIXMGDLZNYTWOP-UHFFFAOYSA-N 1 3 292.492 3.677 20 0 CHADHO C[C@H]([NH2+]CC1(N)CC1)c1ccccc1SC(C)(C)C ZINC000902406578 1118337265 /nfs/dbraw/zinc/33/72/65/1118337265.db2.gz OGHUVQFJHQFQIT-LBPRGKRZSA-N 1 3 278.465 3.719 20 0 CHADHO C[C@@H]([NH2+]CC1(N)CC1)c1ccccc1SC(C)(C)C ZINC000902406577 1118337934 /nfs/dbraw/zinc/33/79/34/1118337934.db2.gz OGHUVQFJHQFQIT-GFCCVEGCSA-N 1 3 278.465 3.719 20 0 CHADHO CC[C@@H](C)[C@@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000580226044 1118406028 /nfs/dbraw/zinc/40/60/28/1118406028.db2.gz MCHFVVOWTRKWCL-HUUCEWRRSA-N 1 3 266.473 3.808 20 0 CHADHO CCCCN1CCC([NH2+]Cc2cc3ccccc3[nH]2)CC1 ZINC000683926301 1118445582 /nfs/dbraw/zinc/44/55/82/1118445582.db2.gz DZHKNKTZZNQWMQ-UHFFFAOYSA-N 1 3 285.435 3.522 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@@H](C)c2cccc(C3CC3)c2)C1 ZINC000580906657 1118519547 /nfs/dbraw/zinc/51/95/47/1118519547.db2.gz HVGMUEUXCMGCSL-HOTGVXAUSA-N 1 3 286.463 3.947 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@@H](C)c2cccc(C3CC3)c2)C1 ZINC000580906657 1118519549 /nfs/dbraw/zinc/51/95/49/1118519549.db2.gz HVGMUEUXCMGCSL-HOTGVXAUSA-N 1 3 286.463 3.947 20 0 CHADHO NC[C@@H]1CCCC[C@H]1[NH2+]C1CCC(c2ccccc2)CC1 ZINC000089141232 1118528924 /nfs/dbraw/zinc/52/89/24/1118528924.db2.gz RKDZTDLYCRFSIM-VLOYRQLPSA-N 1 3 286.463 3.820 20 0 CHADHO C[NH+](C)Cc1cccc(CN[C@H]2CCc3ccc(F)cc32)c1 ZINC000123666155 1118556588 /nfs/dbraw/zinc/55/65/88/1118556588.db2.gz VTPDETIIOSUDLJ-IBGZPJMESA-N 1 3 298.405 3.664 20 0 CHADHO CC(C)C[C@H]([NH2+]CC[C@@H]1CCCN1C)c1ccccc1 ZINC000341036122 1118592228 /nfs/dbraw/zinc/59/22/28/1118592228.db2.gz ITISMTWGLKPGES-ROUUACIJSA-N 1 3 274.452 3.848 20 0 CHADHO CC(C)C[C@H](NCC[C@@H]1CCC[N@@H+]1C)c1ccccc1 ZINC000341036122 1118592234 /nfs/dbraw/zinc/59/22/34/1118592234.db2.gz ITISMTWGLKPGES-ROUUACIJSA-N 1 3 274.452 3.848 20 0 CHADHO CC(C)C[C@H](NCC[C@@H]1CCC[N@H+]1C)c1ccccc1 ZINC000341036122 1118592258 /nfs/dbraw/zinc/59/22/58/1118592258.db2.gz ITISMTWGLKPGES-ROUUACIJSA-N 1 3 274.452 3.848 20 0 CHADHO CC(C)(C)CC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000155498452 1118687036 /nfs/dbraw/zinc/68/70/36/1118687036.db2.gz CKIZJFPHBOQKBM-UHFFFAOYSA-N 1 3 266.473 3.809 20 0 CHADHO C[C@H]([NH2+]CC1=CCCC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000401090820 1118778735 /nfs/dbraw/zinc/77/87/35/1118778735.db2.gz VLRPRKUJBQPAAI-LPHOPBHVSA-N 1 3 284.447 3.597 20 0 CHADHO C1CC([C@H]2CC[C@H]2[NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000510721262 1118796458 /nfs/dbraw/zinc/79/64/58/1118796458.db2.gz MMFRSVZVDMDRSH-RTBURBONSA-N 1 3 290.495 3.952 20 0 CHADHO CC[C@@H]1CCCC[C@@H]1C[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000401383557 1118902866 /nfs/dbraw/zinc/90/28/66/1118902866.db2.gz IDUPPFQJBMRZAH-BRWVUGGUSA-N 1 3 266.473 3.523 20 0 CHADHO CC[C@H]1CCC[C@@H]1C[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000449433551 1118906430 /nfs/dbraw/zinc/90/64/30/1118906430.db2.gz MUCMYZKPIIBQKH-LSDHHAIUSA-N 1 3 266.473 3.665 20 0 CHADHO C[N@H+](C[C@@H]1CCCNC1)C1CCC(c2ccccc2)CC1 ZINC000226436662 1118927621 /nfs/dbraw/zinc/92/76/21/1118927621.db2.gz ZHWDRPBYAZTIFR-IPJUCJBFSA-N 1 3 286.463 3.644 20 0 CHADHO C[N@@H+](C[C@@H]1CCCNC1)C1CCC(c2ccccc2)CC1 ZINC000226436662 1118927624 /nfs/dbraw/zinc/92/76/24/1118927624.db2.gz ZHWDRPBYAZTIFR-IPJUCJBFSA-N 1 3 286.463 3.644 20 0 CHADHO CCCN1CCC([NH2+]Cc2cc3c(ccc(C)c3C)[nH]2)CC1 ZINC000472075753 1118960088 /nfs/dbraw/zinc/96/00/88/1118960088.db2.gz SUXSXYFJWBDJAS-UHFFFAOYSA-N 1 3 299.462 3.749 20 0 CHADHO Cc1ccc2[nH]c(C[NH2+][C@H]3CCC[C@H](N(C)C)C3)cc2c1C ZINC000472080384 1118960404 /nfs/dbraw/zinc/96/04/04/1118960404.db2.gz OENPAYCVJOSKFE-RDJZCZTQSA-N 1 3 299.462 3.747 20 0 CHADHO Cc1cccc(CN2CCC(C[N@@H+](C)C(C)C)CC2)c1F ZINC000582043296 1118994041 /nfs/dbraw/zinc/99/40/41/1118994041.db2.gz YAGFCZODWSRQTG-UHFFFAOYSA-N 1 3 292.442 3.686 20 0 CHADHO Cc1cccc(CN2CCC(C[N@H+](C)C(C)C)CC2)c1F ZINC000582043296 1118994043 /nfs/dbraw/zinc/99/40/43/1118994043.db2.gz YAGFCZODWSRQTG-UHFFFAOYSA-N 1 3 292.442 3.686 20 0 CHADHO C[C@@H]1C[C@H](NCc2cccc(C3CCCC3)c2)CC[N@@H+]1C ZINC000657376477 1119040122 /nfs/dbraw/zinc/04/01/22/1119040122.db2.gz RADBEBPCCIAQAA-DNVCBOLYSA-N 1 3 286.463 3.917 20 0 CHADHO C[C@@H]1C[C@H](NCc2cccc(C3CCCC3)c2)CC[N@H+]1C ZINC000657376477 1119040126 /nfs/dbraw/zinc/04/01/26/1119040126.db2.gz RADBEBPCCIAQAA-DNVCBOLYSA-N 1 3 286.463 3.917 20 0 CHADHO CC(C)(F)CC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000657644792 1119219861 /nfs/dbraw/zinc/21/98/61/1119219861.db2.gz DTBDGWBOTKAXLJ-UHFFFAOYSA-N 1 3 270.436 3.511 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC000343090264 1119307608 /nfs/dbraw/zinc/30/76/08/1119307608.db2.gz DPSOSMPNGOVSSV-BHIYHBOVSA-N 1 3 286.463 3.644 20 0 CHADHO C[NH2+]Cc1ccccc1CNCc1ccc(C(F)F)cc1 ZINC000650720434 1119379039 /nfs/dbraw/zinc/37/90/39/1119379039.db2.gz OWRWHXRUWHSYNF-UHFFFAOYSA-N 1 3 290.357 3.633 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@@H](C)c2cc(C)ccc2C)C1 ZINC000151106172 1119395978 /nfs/dbraw/zinc/39/59/78/1119395978.db2.gz PGGMEVOQMIJOOQ-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@@H](C)c2cc(C)ccc2C)C1 ZINC000151106172 1119395979 /nfs/dbraw/zinc/39/59/79/1119395979.db2.gz PGGMEVOQMIJOOQ-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO CC(C)(C)C[C@@H]1C[C@H]1[NH2+][C@H]1C[C@@H](N)c2ccccc21 ZINC000650741631 1119396319 /nfs/dbraw/zinc/39/63/19/1119396319.db2.gz IFDHTJDAFKAOLY-SRMUXQRQSA-N 1 3 258.409 3.546 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@@H]1CCSc2ccccc21 ZINC000650758841 1119417486 /nfs/dbraw/zinc/41/74/86/1119417486.db2.gz YXJFEYMOCKDMML-QGZVFWFLSA-N 1 3 298.455 3.733 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN([C@@H](C)c2ccccc2C)C1 ZINC000151337059 1119451109 /nfs/dbraw/zinc/45/11/09/1119451109.db2.gz LPDIDHCWKPFNJB-IRXDYDNUSA-N 1 3 274.452 3.720 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN([C@@H](C)c2ccccc2C)C1 ZINC000151337059 1119451114 /nfs/dbraw/zinc/45/11/14/1119451114.db2.gz LPDIDHCWKPFNJB-IRXDYDNUSA-N 1 3 274.452 3.720 20 0 CHADHO CCCCC[C@@H](C)[NH2+]CCCN1CCCC[C@H]1C ZINC000250819675 1119497862 /nfs/dbraw/zinc/49/78/62/1119497862.db2.gz KRHOFVWLKKLGMJ-HZPDHXFCSA-N 1 3 254.462 3.809 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCc1cc(-c2ccccc2)cs1 ZINC000584409726 1119528801 /nfs/dbraw/zinc/52/88/01/1119528801.db2.gz DEHWUZZFRZJRSM-CHWSQXEVSA-N 1 3 274.433 3.631 20 0 CHADHO C[C@H]1CCCC[C@@H]1[NH+]1CCC(NCCC(C)(C)F)CC1 ZINC000658192279 1119699735 /nfs/dbraw/zinc/69/97/35/1119699735.db2.gz FDOWPJODDSEUQH-HOCLYGCPSA-N 1 3 284.463 3.757 20 0 CHADHO C[C@H](CCc1ccco1)N[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000658226166 1119706070 /nfs/dbraw/zinc/70/60/70/1119706070.db2.gz GUGDBZRHHZNLMJ-CVEARBPZSA-N 1 3 290.451 3.597 20 0 CHADHO C[C@H](CCc1ccco1)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000658226166 1119706073 /nfs/dbraw/zinc/70/60/73/1119706073.db2.gz GUGDBZRHHZNLMJ-CVEARBPZSA-N 1 3 290.451 3.597 20 0 CHADHO Cc1cccc2c1CCC[C@@H]2NC1CC[NH+](CC2CC2)CC1 ZINC000658340415 1119727918 /nfs/dbraw/zinc/72/79/18/1119727918.db2.gz YTOKNCLWWCBFRZ-FQEVSTJZSA-N 1 3 298.474 3.836 20 0 CHADHO CC(C)(C)N1CCC([NH2+]C[C@@H]2CCC[C@H]2C2CC2)CC1 ZINC000414207161 1119939133 /nfs/dbraw/zinc/93/91/33/1119939133.db2.gz ZENXGGYHNWJDTQ-RDJZCZTQSA-N 1 3 278.484 3.665 20 0 CHADHO C[C@@H]1C[C@H](NC2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)CS1 ZINC000414230398 1119948573 /nfs/dbraw/zinc/94/85/73/1119948573.db2.gz NWFBFLABTJCDMK-TXCZRRACSA-N 1 3 296.524 3.513 20 0 CHADHO CC[N@@H+]1CCC[C@H](CN[C@@H](c2ccc(F)cc2)C2CC2)C1 ZINC001116473028 1120127523 /nfs/dbraw/zinc/12/75/23/1120127523.db2.gz JHCBZZJDPMBLRJ-RDTXWAMCSA-N 1 3 290.426 3.598 20 0 CHADHO CC[N@H+]1CCC[C@H](CN[C@@H](c2ccc(F)cc2)C2CC2)C1 ZINC001116473028 1120127526 /nfs/dbraw/zinc/12/75/26/1120127526.db2.gz JHCBZZJDPMBLRJ-RDTXWAMCSA-N 1 3 290.426 3.598 20 0 CHADHO C[N@@H+]1CCCC[C@@H]1CCN1CCC(c2ccccc2)CC1 ZINC000472773653 1120170366 /nfs/dbraw/zinc/17/03/66/1120170366.db2.gz OOQABIVGOGKFLY-LJQANCHMSA-N 1 3 286.463 3.740 20 0 CHADHO C[N@H+]1CCCC[C@@H]1CCN1CCC(c2ccccc2)CC1 ZINC000472773653 1120170371 /nfs/dbraw/zinc/17/03/71/1120170371.db2.gz OOQABIVGOGKFLY-LJQANCHMSA-N 1 3 286.463 3.740 20 0 CHADHO CCCC[N@H+](C)CCCN[C@H]1Cc2cccc(Cl)c2C1 ZINC001168684591 1120244768 /nfs/dbraw/zinc/24/47/68/1120244768.db2.gz KPMANAHJOBSIHG-HNNXBMFYSA-N 1 3 294.870 3.519 20 0 CHADHO CCCC[N@@H+](C)CCCN[C@H]1Cc2cccc(Cl)c2C1 ZINC001168684591 1120244773 /nfs/dbraw/zinc/24/47/73/1120244773.db2.gz KPMANAHJOBSIHG-HNNXBMFYSA-N 1 3 294.870 3.519 20 0 CHADHO CCCCN(C)CCC[NH2+][C@H]1Cc2cccc(Cl)c2C1 ZINC001168684591 1120244777 /nfs/dbraw/zinc/24/47/77/1120244777.db2.gz KPMANAHJOBSIHG-HNNXBMFYSA-N 1 3 294.870 3.519 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2c2cccs2)C1 ZINC000417336391 1120429759 /nfs/dbraw/zinc/42/97/59/1120429759.db2.gz HWQFPYVZLFMLLV-LVQVYYBASA-N 1 3 292.492 3.562 20 0 CHADHO CCCN1CC[C@@H](C[NH2+]CCCC2CCCCC2)C1 ZINC000584746198 1120429980 /nfs/dbraw/zinc/42/99/80/1120429980.db2.gz CPAKZDVSYYNHOF-KRWDZBQOSA-N 1 3 266.473 3.668 20 0 CHADHO C[C@H](N[C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(C2CC2)cc1 ZINC000417356889 1120435721 /nfs/dbraw/zinc/43/57/21/1120435721.db2.gz QNRJSGXHKSMEFO-QWQRMKEZSA-N 1 3 272.436 3.697 20 0 CHADHO C[C@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(C2CC2)cc1 ZINC000417356889 1120435723 /nfs/dbraw/zinc/43/57/23/1120435723.db2.gz QNRJSGXHKSMEFO-QWQRMKEZSA-N 1 3 272.436 3.697 20 0 CHADHO c1csc(-c2ccc(CNCCC[NH+]3CCC3)cc2)c1 ZINC000657423036 1120453389 /nfs/dbraw/zinc/45/33/89/1120453389.db2.gz DVGQNCKCCDXCEA-UHFFFAOYSA-N 1 3 286.444 3.601 20 0 CHADHO C[C@H]([NH2+]CC(C)(C)CN(C)C)c1cccc(Cl)c1 ZINC000019905885 1120490518 /nfs/dbraw/zinc/49/05/18/1120490518.db2.gz LXNGIDWVMLMOMA-LBPRGKRZSA-N 1 3 268.832 3.578 20 0 CHADHO C[C@H]([NH2+]CC(C)(C)CN(C)C)c1cc2ccccc2o1 ZINC000019905915 1120490810 /nfs/dbraw/zinc/49/08/10/1120490810.db2.gz BMIWUEMVHYHQOO-ZDUSSCGKSA-N 1 3 274.408 3.671 20 0 CHADHO CC[C@@H](c1ccc(F)cc1)[N@H+](C)CCCN1CCCC1 ZINC000499910639 1120550404 /nfs/dbraw/zinc/55/04/04/1120550404.db2.gz CPQJXMAXHUXWTR-KRWDZBQOSA-N 1 3 278.415 3.695 20 0 CHADHO CC[C@@H](c1ccc(F)cc1)[N@@H+](C)CCCN1CCCC1 ZINC000499910639 1120550407 /nfs/dbraw/zinc/55/04/07/1120550407.db2.gz CPQJXMAXHUXWTR-KRWDZBQOSA-N 1 3 278.415 3.695 20 0 CHADHO CC[C@H]1CCC[C@H]([NH2+]CCCN(C)C(C)C)CC1 ZINC000226334600 1120602140 /nfs/dbraw/zinc/60/21/40/1120602140.db2.gz ZQDCZGQTJCTVIL-HOTGVXAUSA-N 1 3 254.462 3.665 20 0 CHADHO C[C@@H]([NH3+])[C@H](NC1CCC2(CC2(F)F)CC1)c1ccccc1 ZINC000925710529 1120656002 /nfs/dbraw/zinc/65/60/02/1120656002.db2.gz XIGZQTGCOMGNCO-SMOPSLFNSA-N 1 3 294.389 3.633 20 0 CHADHO CC[C@H](c1ccccc1)N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000150758588 1120777125 /nfs/dbraw/zinc/77/71/25/1120777125.db2.gz UWNPGIRYSBHHRT-SJLPKXTDSA-N 1 3 272.436 3.555 20 0 CHADHO CC[C@H](c1ccccc1)[N@@H+]1CC[C@H](CN2CCCC2)C1 ZINC000150758588 1120777126 /nfs/dbraw/zinc/77/71/26/1120777126.db2.gz UWNPGIRYSBHHRT-SJLPKXTDSA-N 1 3 272.436 3.555 20 0 CHADHO CC[C@H](c1ccccc1)[N@H+]1CC[C@H](CN2CCCC2)C1 ZINC000150758588 1120777127 /nfs/dbraw/zinc/77/71/27/1120777127.db2.gz UWNPGIRYSBHHRT-SJLPKXTDSA-N 1 3 272.436 3.555 20 0 CHADHO Cc1ccc2[nH]c(CN3CCC(C[NH+](C)C)CC3)cc2c1C ZINC000473140777 1120805430 /nfs/dbraw/zinc/80/54/30/1120805430.db2.gz SCIPZPQJHLGATA-UHFFFAOYSA-N 1 3 299.462 3.558 20 0 CHADHO C[C@@H](CN1CCC[C@@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000247249060 1120875787 /nfs/dbraw/zinc/87/57/87/1120875787.db2.gz ZQSCIXLAENBPKK-PKOBYXMFSA-N 1 3 286.463 3.740 20 0 CHADHO C[C@@H]([NH3+])[C@H]1CCCN(Cc2cccc(C(C)(C)C)c2)C1 ZINC000662244492 1120910701 /nfs/dbraw/zinc/91/07/01/1120910701.db2.gz HKODRFHRVGZZLB-ZBFHGGJFSA-N 1 3 274.452 3.543 20 0 CHADHO Cc1cccc(CC[C@H](C)[NH2+]CCCN(C)C(C)C)c1 ZINC000221918159 1120937772 /nfs/dbraw/zinc/93/77/72/1120937772.db2.gz KELFIALNRTYVBW-KRWDZBQOSA-N 1 3 276.468 3.636 20 0 CHADHO CCC[C@H]([NH2+]C[C@H]1CCCN(CC2CC2)C1)C1CCC1 ZINC000663466204 1120980898 /nfs/dbraw/zinc/98/08/98/1120980898.db2.gz PKIPYTHMCCEQGS-AEFFLSMTSA-N 1 3 278.484 3.667 20 0 CHADHO CC(C)=CCC[C@@H](C)[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663467858 1120982236 /nfs/dbraw/zinc/98/22/36/1120982236.db2.gz IIMJNEXYMLJVTI-AEFFLSMTSA-N 1 3 278.484 3.833 20 0 CHADHO CC(C)CC[C@H](C)[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663470218 1120984596 /nfs/dbraw/zinc/98/45/96/1120984596.db2.gz SZGHQTXZRGXBKV-RDJZCZTQSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663469596 1120984915 /nfs/dbraw/zinc/98/49/15/1120984915.db2.gz QWWQMVKWKKGAAA-FGTMMUONSA-N 1 3 278.484 3.523 20 0 CHADHO CC(C)c1ccc([C@@H](C)[NH2+]C[C@H]2CNCCC2(F)F)cc1 ZINC000925777854 1120986552 /nfs/dbraw/zinc/98/65/52/1120986552.db2.gz HOFQEBWWDJNZIO-CZUORRHYSA-N 1 3 296.405 3.705 20 0 CHADHO C[C@H](N[C@@H]1CC12CC[NH2+]CC2)c1ccc(Cl)cc1Cl ZINC000643533895 1121009365 /nfs/dbraw/zinc/00/93/65/1121009365.db2.gz HOYFMNWFNFGSSJ-IINYFYTJSA-N 1 3 299.245 3.786 20 0 CHADHO CN(CC[C@@H]1CCCC[N@@H+]1C)[C@H]1CCCc2ccccc21 ZINC000674771508 1121178676 /nfs/dbraw/zinc/17/86/76/1121178676.db2.gz OBVJDOMEUXUQBK-HKUYNNGSSA-N 1 3 286.463 3.870 20 0 CHADHO CN(CC[C@@H]1CCCC[N@H+]1C)[C@H]1CCCc2ccccc21 ZINC000674771508 1121178680 /nfs/dbraw/zinc/17/86/80/1121178680.db2.gz OBVJDOMEUXUQBK-HKUYNNGSSA-N 1 3 286.463 3.870 20 0 CHADHO C[C@@H](c1cccc(Cl)c1)N1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000063197593 1121201550 /nfs/dbraw/zinc/20/15/50/1121201550.db2.gz QAJDWUCZCGNJHH-GUYCJALGSA-N 1 3 292.854 3.865 20 0 CHADHO [NH3+][C@@H]1C[C@H](N[C@H]2CCSC3(CCC3)C2)c2ccccc21 ZINC000925857787 1121294189 /nfs/dbraw/zinc/29/41/89/1121294189.db2.gz IOSDUSWETHWPNJ-MAZHCROVSA-N 1 3 288.460 3.539 20 0 CHADHO Fc1ccc(C[NH2+]C[C@@H]2CCN(C3CC3)C2)c2ccccc12 ZINC000631039851 1128979858 /nfs/dbraw/zinc/97/98/58/1128979858.db2.gz NBHAUDNOQAZTIK-AWEZNQCLSA-N 1 3 298.405 3.553 20 0 CHADHO Fc1ccc(CNC[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc12 ZINC000631039851 1128979862 /nfs/dbraw/zinc/97/98/62/1128979862.db2.gz NBHAUDNOQAZTIK-AWEZNQCLSA-N 1 3 298.405 3.553 20 0 CHADHO Fc1ccc(CNC[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc12 ZINC000631039851 1128979867 /nfs/dbraw/zinc/97/98/67/1128979867.db2.gz NBHAUDNOQAZTIK-AWEZNQCLSA-N 1 3 298.405 3.553 20 0 CHADHO C[C@@H](CCc1ccccc1)C[N@@H+]1CCC[C@H](N(C)C)CC1 ZINC000432801632 1121367240 /nfs/dbraw/zinc/36/72/40/1121367240.db2.gz XHHUTUPTCRNYSN-HKUYNNGSSA-N 1 3 288.479 3.671 20 0 CHADHO C[C@@H](CCc1ccccc1)C[N@H+]1CCC[C@H](N(C)C)CC1 ZINC000432801632 1121367248 /nfs/dbraw/zinc/36/72/48/1121367248.db2.gz XHHUTUPTCRNYSN-HKUYNNGSSA-N 1 3 288.479 3.671 20 0 CHADHO C[C@@H](CC1CCC1)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000675925749 1121384109 /nfs/dbraw/zinc/38/41/09/1121384109.db2.gz APSIUXLXWNVDJE-HNNXBMFYSA-N 1 3 278.484 3.952 20 0 CHADHO c1ccc2c(c1)cccc2CN1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1 ZINC000314763621 1121444662 /nfs/dbraw/zinc/44/46/62/1121444662.db2.gz RDKABHUUHFICEH-QUCCMNQESA-N 1 3 294.442 3.804 20 0 CHADHO CC1CC[NH+](C[C@@H]2CCCN(CC3(C)CCC3)C2)CC1 ZINC000432941695 1121490041 /nfs/dbraw/zinc/49/00/41/1121490041.db2.gz XJIKOQQZIHRHDB-KRWDZBQOSA-N 1 3 278.484 3.621 20 0 CHADHO CCCC[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000512669169 1121519872 /nfs/dbraw/zinc/51/98/72/1121519872.db2.gz YZLWFGIGWQXOHV-GBESFXJTSA-N 1 3 286.463 3.677 20 0 CHADHO CC(C)CCC[N@@H+]1CCC[C@H](N2[C@@H](C)CC[C@@H]2C)C1 ZINC000429324990 1121527609 /nfs/dbraw/zinc/52/76/09/1121527609.db2.gz GXMVEPCUCUXZSU-ULQDDVLXSA-N 1 3 266.473 3.760 20 0 CHADHO CC(C)CCC[N@H+]1CCC[C@H](N2[C@@H](C)CC[C@@H]2C)C1 ZINC000429324990 1121527611 /nfs/dbraw/zinc/52/76/11/1121527611.db2.gz GXMVEPCUCUXZSU-ULQDDVLXSA-N 1 3 266.473 3.760 20 0 CHADHO CCC1(N2CCC2)CC[NH+](CCC2=CCCCC2)CC1 ZINC001176234592 1121582611 /nfs/dbraw/zinc/58/26/11/1121582611.db2.gz DSOHPOBHIGWLIM-UHFFFAOYSA-N 1 3 276.468 3.827 20 0 CHADHO CCC1([NH+]2CCC2)CCN(CCC2=CCCCC2)CC1 ZINC001176234592 1121582615 /nfs/dbraw/zinc/58/26/15/1121582615.db2.gz DSOHPOBHIGWLIM-UHFFFAOYSA-N 1 3 276.468 3.827 20 0 CHADHO CCCC[C@H](CC)CC[NH2+]C[C@H]1CCN(CC)C1 ZINC000535597497 1121744850 /nfs/dbraw/zinc/74/48/50/1121744850.db2.gz HZJFVINHLIIMQA-JKSUJKDBSA-N 1 3 254.462 3.524 20 0 CHADHO CC(C)C1CCC([NH2+]C[C@H]2CCCN(CC3CC3)C2)CC1 ZINC001179259132 1121866509 /nfs/dbraw/zinc/86/65/09/1121866509.db2.gz RJPZVXHJQULHLI-LMDPOFIKSA-N 1 3 292.511 3.913 20 0 CHADHO CC(C)[NH+]1CCC(CCNCc2cccc(F)c2F)CC1 ZINC001179277620 1121870843 /nfs/dbraw/zinc/87/08/43/1121870843.db2.gz KBDGLDAPCCSWBY-UHFFFAOYSA-N 1 3 296.405 3.565 20 0 CHADHO CC1(C)CCC[C@H](C[N@@H+]2CC[C@H](CN3CCCC3)C2)C1 ZINC001179873171 1121923081 /nfs/dbraw/zinc/92/30/81/1121923081.db2.gz FANLFAHEOHCCFK-DLBZAZTESA-N 1 3 278.484 3.621 20 0 CHADHO CC1(C)CCC[C@H](C[N@H+]2CC[C@H](CN3CCCC3)C2)C1 ZINC001179873171 1121923085 /nfs/dbraw/zinc/92/30/85/1121923085.db2.gz FANLFAHEOHCCFK-DLBZAZTESA-N 1 3 278.484 3.621 20 0 CHADHO CC(C)c1ccc(C[NH2+]C[C@H]2CCCCN(C)C2)cc1 ZINC000700812978 1121933230 /nfs/dbraw/zinc/93/32/30/1121933230.db2.gz MCCQNHDNTIJCJD-QGZVFWFLSA-N 1 3 274.452 3.632 20 0 CHADHO CCN(CC[C@@H]1CCC[NH2+]C1)Cc1ccccc1Cl ZINC000420302915 1121997705 /nfs/dbraw/zinc/99/77/05/1121997705.db2.gz JZSHSGQAWKUYPG-AWEZNQCLSA-N 1 3 280.843 3.552 20 0 CHADHO C[C@@H]([NH2+]CC[C@H](C)N1CCCCC1)C1CCCCC1 ZINC001180809263 1122017658 /nfs/dbraw/zinc/01/76/58/1122017658.db2.gz CHLBFDBQGICQBR-JKSUJKDBSA-N 1 3 266.473 3.809 20 0 CHADHO C[C@H](Cc1ccc(F)cc1)[NH2+]CC[C@H](C)N1CCCCC1 ZINC001180809126 1122017727 /nfs/dbraw/zinc/01/77/27/1122017727.db2.gz ARZAVLJDNFDUOO-CVEARBPZSA-N 1 3 292.442 3.611 20 0 CHADHO CC(C)[C@@H]1CCC[C@H]1[NH2+]CC[C@@H](C)N1CCCCC1 ZINC001180811141 1122018473 /nfs/dbraw/zinc/01/84/73/1122018473.db2.gz QSBGYEYTBSIGLC-IXDOHACOSA-N 1 3 266.473 3.665 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1C[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC001203263050 1122078101 /nfs/dbraw/zinc/07/81/01/1122078101.db2.gz FIIKEEAWIXTPLZ-UHOSZYNNSA-N 1 3 290.495 3.690 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)C1 ZINC000502413710 1122084009 /nfs/dbraw/zinc/08/40/09/1122084009.db2.gz IDTZMBWMTBSFGY-TVFCKZIOSA-N 1 3 278.484 3.523 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]C2CC3(C2)CCCCC3)C1 ZINC000421322070 1122092924 /nfs/dbraw/zinc/09/29/24/1122092924.db2.gz FODICIGADVRNFH-MRXNPFEDSA-N 1 3 278.484 3.809 20 0 CHADHO CC[C@H]([NH2+]CC1=CCN(C)CC1)c1ccc(Cl)s1 ZINC000271888289 1122181559 /nfs/dbraw/zinc/18/15/59/1122181559.db2.gz RFLVYGVABHBCKY-LBPRGKRZSA-N 1 3 284.856 3.704 20 0 CHADHO CC1(C)CC[N@H+](Cc2ccc(C3CC3)cc2)CC(C)(C)N1 ZINC001184375689 1122273681 /nfs/dbraw/zinc/27/36/81/1122273681.db2.gz WLIHRWFMPHRVAO-UHFFFAOYSA-N 1 3 286.463 3.917 20 0 CHADHO CC1(C)CC[N@@H+](Cc2ccc(C3CC3)cc2)CC(C)(C)N1 ZINC001184375689 1122273687 /nfs/dbraw/zinc/27/36/87/1122273687.db2.gz WLIHRWFMPHRVAO-UHFFFAOYSA-N 1 3 286.463 3.917 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CC[C@@H](C)[C@@H](CN)C1 ZINC001205296216 1122274355 /nfs/dbraw/zinc/27/43/55/1122274355.db2.gz JGMBHJSSQWDJAZ-BBWFWOEESA-N 1 3 266.473 3.676 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CC[C@@H](C)[C@@H](CN)C1 ZINC001205296216 1122274361 /nfs/dbraw/zinc/27/43/61/1122274361.db2.gz JGMBHJSSQWDJAZ-BBWFWOEESA-N 1 3 266.473 3.676 20 0 CHADHO C[C@@H]1CCNCC[N@@H+]1Cc1ccc(-c2ccccc2)cc1 ZINC001205324702 1122322409 /nfs/dbraw/zinc/32/24/09/1122322409.db2.gz FLDZQXIBVPCMNZ-MRXNPFEDSA-N 1 3 280.415 3.537 20 0 CHADHO C[C@@H]1CCNCC[N@H+]1Cc1ccc(-c2ccccc2)cc1 ZINC001205324702 1122322413 /nfs/dbraw/zinc/32/24/13/1122322413.db2.gz FLDZQXIBVPCMNZ-MRXNPFEDSA-N 1 3 280.415 3.537 20 0 CHADHO CCN(CC)CCC[NH2+][C@H](C)[C@@H](C)c1ccc(OC)cc1 ZINC000514248433 1122391216 /nfs/dbraw/zinc/39/12/16/1122391216.db2.gz QBJCWUDJLFRWHA-HZPDHXFCSA-N 1 3 292.467 3.509 20 0 CHADHO Cc1ccccc1C[N@H+]1CCCC[C@H]1C[C@@H]1CCCN1C ZINC001203709607 1122517792 /nfs/dbraw/zinc/51/77/92/1122517792.db2.gz KLUBMZMKRVGUEL-OALUTQOASA-N 1 3 286.463 3.834 20 0 CHADHO Cc1ccccc1C[N@@H+]1CCCC[C@H]1C[C@@H]1CCCN1C ZINC001203709607 1122517795 /nfs/dbraw/zinc/51/77/95/1122517795.db2.gz KLUBMZMKRVGUEL-OALUTQOASA-N 1 3 286.463 3.834 20 0 CHADHO Cc1oc2ccccc2c1[C@@H](C)NC[C@@H]1CCC[N@H+](C)C1 ZINC000925009405 1122562952 /nfs/dbraw/zinc/56/29/52/1122562952.db2.gz HGOJCAPVDYQGDY-HIFRSBDPSA-N 1 3 286.419 3.734 20 0 CHADHO Cc1oc2ccccc2c1[C@@H](C)NC[C@@H]1CCC[N@@H+](C)C1 ZINC000925009405 1122562956 /nfs/dbraw/zinc/56/29/56/1122562956.db2.gz HGOJCAPVDYQGDY-HIFRSBDPSA-N 1 3 286.419 3.734 20 0 CHADHO CCC[C@@H](CCc1ccccc1)[NH2+]C[C@@H](C)CN(C)C ZINC000425947146 1122675513 /nfs/dbraw/zinc/67/55/13/1122675513.db2.gz RMCQLXZFXYMJAV-AEFFLSMTSA-N 1 3 276.468 3.575 20 0 CHADHO C[C@H](C[NH2+][C@H](C)c1cc(Cl)cc(Cl)c1)CN(C)C ZINC000425947209 1122675884 /nfs/dbraw/zinc/67/58/84/1122675884.db2.gz RQTWKKWQFBPTSW-GHMZBOCLSA-N 1 3 289.250 3.842 20 0 CHADHO c1ccc(C[NH2+]C2CCN(CC3CC4(CCC4)C3)CC2)cc1 ZINC001194525609 1122781774 /nfs/dbraw/zinc/78/17/74/1122781774.db2.gz QQHONTPUVIDVEY-UHFFFAOYSA-N 1 3 298.474 3.821 20 0 CHADHO CCCCC[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167965360 1122811117 /nfs/dbraw/zinc/81/11/17/1122811117.db2.gz CBDDLQITTKSTPD-MIGBEJBISA-N 1 3 278.484 3.950 20 0 CHADHO CCN(CC)CCC[N@H+](CC)C[C@@H]1C[C@H]1c1ccccc1 ZINC001205684390 1122837763 /nfs/dbraw/zinc/83/77/63/1122837763.db2.gz GTKXAVLJCWNNQW-OALUTQOASA-N 1 3 288.479 3.844 20 0 CHADHO CCN(CC)CCC[N@@H+](CC)C[C@@H]1C[C@H]1c1ccccc1 ZINC001205684390 1122837773 /nfs/dbraw/zinc/83/77/73/1122837773.db2.gz GTKXAVLJCWNNQW-OALUTQOASA-N 1 3 288.479 3.844 20 0 CHADHO CCCC[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167979048 1122895298 /nfs/dbraw/zinc/89/52/98/1122895298.db2.gz UBEJNGXYESMEJL-HZTRTUMWSA-N 1 3 264.457 3.560 20 0 CHADHO C[C@H]1CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001167985026 1122939088 /nfs/dbraw/zinc/93/90/88/1122939088.db2.gz SHRFWZKYOXRLTK-QTXGHNMQSA-N 1 3 276.468 3.514 20 0 CHADHO C[C@H]1CCC[N@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001167985026 1122939093 /nfs/dbraw/zinc/93/90/93/1122939093.db2.gz SHRFWZKYOXRLTK-QTXGHNMQSA-N 1 3 276.468 3.514 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1ccccc1 ZINC001203314965 1122983896 /nfs/dbraw/zinc/98/38/96/1122983896.db2.gz XKGLSCIJINDFRP-ROUUACIJSA-N 1 3 272.436 3.525 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC001203314965 1122983897 /nfs/dbraw/zinc/98/38/97/1122983897.db2.gz XKGLSCIJINDFRP-ROUUACIJSA-N 1 3 272.436 3.525 20 0 CHADHO C[N@@H+]1CCC[C@H]1C[C@@H]1CCCCN1Cc1ccccc1 ZINC001203314965 1122983899 /nfs/dbraw/zinc/98/38/99/1122983899.db2.gz XKGLSCIJINDFRP-ROUUACIJSA-N 1 3 272.436 3.525 20 0 CHADHO C[N@H+]1CCC[C@H]1C[C@@H]1CCCCN1Cc1ccccc1 ZINC001203314965 1122983900 /nfs/dbraw/zinc/98/39/00/1122983900.db2.gz XKGLSCIJINDFRP-ROUUACIJSA-N 1 3 272.436 3.525 20 0 CHADHO Cc1ccc(CNCCCC[N@H+]2CCCC[C@@H]2C)c(F)c1 ZINC001199336493 1123027869 /nfs/dbraw/zinc/02/78/69/1123027869.db2.gz PQAIEXXMUKOEQY-INIZCTEOSA-N 1 3 292.442 3.878 20 0 CHADHO Cc1ccc(CNCCCC[N@@H+]2CCCC[C@@H]2C)c(F)c1 ZINC001199336493 1123027874 /nfs/dbraw/zinc/02/78/74/1123027874.db2.gz PQAIEXXMUKOEQY-INIZCTEOSA-N 1 3 292.442 3.878 20 0 CHADHO C[C@@H]1[C@H](C[NH3+])CCCN1Cc1cccc(C(C)(C)C)c1 ZINC001205912782 1123075500 /nfs/dbraw/zinc/07/55/00/1123075500.db2.gz CFTJHIMOPZXRKY-ZBFHGGJFSA-N 1 3 274.452 3.543 20 0 CHADHO CCC(C)(C)CC[N@@H+]1CC[C@H](CN2CCCCC2)C1 ZINC000441461597 1123133633 /nfs/dbraw/zinc/13/36/33/1123133633.db2.gz XEPUCKWHVOAGSZ-MRXNPFEDSA-N 1 3 266.473 3.621 20 0 CHADHO CCC(C)(C)CC[N@H+]1CC[C@H](CN2CCCCC2)C1 ZINC000441461597 1123133637 /nfs/dbraw/zinc/13/36/37/1123133637.db2.gz XEPUCKWHVOAGSZ-MRXNPFEDSA-N 1 3 266.473 3.621 20 0 CHADHO CCCC[N@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001201723339 1123140957 /nfs/dbraw/zinc/14/09/57/1123140957.db2.gz YYZDWHJBXCFXFY-UHFFFAOYSA-N 1 3 252.446 3.515 20 0 CHADHO CC(C)[C@H]1CCC[N@@H+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001168002937 1123173353 /nfs/dbraw/zinc/17/33/53/1123173353.db2.gz FQYMELZDJIWXPV-UJJTZGENSA-N 1 3 276.468 3.512 20 0 CHADHO CC(C)[C@H]1CCC[N@H+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001168002937 1123173354 /nfs/dbraw/zinc/17/33/54/1123173354.db2.gz FQYMELZDJIWXPV-UJJTZGENSA-N 1 3 276.468 3.512 20 0 CHADHO C[C@@H]1CC([NH2+]C2(CF)CC2)C[C@@H](C)N1Cc1ccccc1 ZINC001168005184 1123196805 /nfs/dbraw/zinc/19/68/05/1123196805.db2.gz HQAYYVVXTGZVBX-HUUCEWRRSA-N 1 3 290.426 3.520 20 0 CHADHO COc1ccc([C@@H](C)[NH2+]CC2(N)CCCC2)c2ccccc12 ZINC000665248790 1123259373 /nfs/dbraw/zinc/25/93/73/1123259373.db2.gz CMRGEWPUGVVHEM-CQSZACIVSA-N 1 3 298.430 3.771 20 0 CHADHO [NH3+][C@@H]1C[C@@H](N[C@@H]2CC[C@@H]2c2ccccc2)c2ccccc21 ZINC000665274154 1123303191 /nfs/dbraw/zinc/30/31/91/1123303191.db2.gz KZJGZEJSXOKWHM-UTRMSSBJSA-N 1 3 278.399 3.667 20 0 CHADHO [NH3+][C@H]1C[C@@H](N[C@@H]2CC[C@@H]2c2ccccc2)c2ccccc21 ZINC000665274155 1123303535 /nfs/dbraw/zinc/30/35/35/1123303535.db2.gz KZJGZEJSXOKWHM-ZWQIFLOQSA-N 1 3 278.399 3.667 20 0 CHADHO C[C@H](CC[NH2+]C1CCC(C(F)F)CC1)N1CCCCC1 ZINC000442847743 1123342261 /nfs/dbraw/zinc/34/22/61/1123342261.db2.gz CXJHGBBNUZKUQC-WLYUNCDWSA-N 1 3 288.426 3.664 20 0 CHADHO C[C@@H](CC[NH2+][C@H]1CCC12CCCC2)N1CCCCC1 ZINC000474046014 1123400178 /nfs/dbraw/zinc/40/01/78/1123400178.db2.gz RMIJSDTXJYZDSD-HOTGVXAUSA-N 1 3 264.457 3.563 20 0 CHADHO CCN1CCC[C@H](C[NH2+]C[C@@H](C)CCc2ccccc2)C1 ZINC001648959961 1123439053 /nfs/dbraw/zinc/43/90/53/1123439053.db2.gz HDVINWGIQWAXEL-PKOBYXMFSA-N 1 3 288.479 3.577 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](C[C@H]2C(C)=CCC[C@@H]2C)C1 ZINC000443641376 1123456012 /nfs/dbraw/zinc/45/60/12/1123456012.db2.gz PHFTXZKWDVBWQH-BZSNNMDCSA-N 1 3 278.484 3.643 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](C[C@H]2C(C)=CCC[C@@H]2C)C1 ZINC000443641376 1123456014 /nfs/dbraw/zinc/45/60/14/1123456014.db2.gz PHFTXZKWDVBWQH-BZSNNMDCSA-N 1 3 278.484 3.643 20 0 CHADHO CCN1CC[C@@H](C[NH2+]C[C@@H](CC(C)C)c2ccccc2)C1 ZINC000474497807 1123541261 /nfs/dbraw/zinc/54/12/61/1123541261.db2.gz ZBSRURNBGHKBOI-PKOBYXMFSA-N 1 3 288.479 3.748 20 0 CHADHO CC(C)[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCCN(C(C)C)C2)C1 ZINC000474710299 1123575000 /nfs/dbraw/zinc/57/50/00/1123575000.db2.gz IVPZWGCTLWWHRW-KURKYZTESA-N 1 3 280.500 3.911 20 0 CHADHO C1=CC[C@@H](C[NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000158043055 1129137129 /nfs/dbraw/zinc/13/71/29/1129137129.db2.gz MNPNYMDWOSYMOJ-MRXNPFEDSA-N 1 3 276.468 3.729 20 0 CHADHO Fc1cccc(CN(C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC000346827097 1123724261 /nfs/dbraw/zinc/72/42/61/1123724261.db2.gz HHXCUYLTKAQOJK-MRXNPFEDSA-N 1 3 290.426 3.570 20 0 CHADHO CSc1ccc([C@@H](C)N[C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000281585667 1123729089 /nfs/dbraw/zinc/72/90/89/1123729089.db2.gz LJMYAGNKCUUPPZ-UMVBOHGHSA-N 1 3 278.465 3.542 20 0 CHADHO CSc1ccc([C@@H](C)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000281585667 1123729092 /nfs/dbraw/zinc/72/90/92/1123729092.db2.gz LJMYAGNKCUUPPZ-UMVBOHGHSA-N 1 3 278.465 3.542 20 0 CHADHO Cc1ccsc1[C@H](C)[NH2+]CC[C@@H](C)N1CCCCC1 ZINC000544374995 1123747216 /nfs/dbraw/zinc/74/72/16/1123747216.db2.gz JOYGFELKENUZIE-CABCVRRESA-N 1 3 280.481 3.972 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@H]2CCCc3ccc(C)cc32)C1 ZINC000339072794 1123971463 /nfs/dbraw/zinc/97/14/63/1123971463.db2.gz XTYRZKRWRULIIP-LPHOPBHVSA-N 1 3 286.463 3.694 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@H]2CCCc3ccc(C)cc32)C1 ZINC000339072794 1123971466 /nfs/dbraw/zinc/97/14/66/1123971466.db2.gz XTYRZKRWRULIIP-LPHOPBHVSA-N 1 3 286.463 3.694 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]CC[C@H](C)c2ccccc2)C1 ZINC000249043337 1124029439 /nfs/dbraw/zinc/02/94/39/1124029439.db2.gz VJBXALKRSQCTAC-ZWKOTPCHSA-N 1 3 288.479 3.890 20 0 CHADHO Cc1ccc(CN2CCC(CC[NH+](C)C)CC2)c(Cl)c1 ZINC000447180207 1124454486 /nfs/dbraw/zinc/45/44/86/1124454486.db2.gz FYTVSVAVQKVULB-UHFFFAOYSA-N 1 3 294.870 3.812 20 0 CHADHO C[C@H](Cc1coc2ccccc12)N[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000449091054 1124649068 /nfs/dbraw/zinc/64/90/68/1124649068.db2.gz OZTVGBVUVSAXRB-HYVNUMGLSA-N 1 3 298.430 3.580 20 0 CHADHO C[C@H](Cc1coc2ccccc12)N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000449091054 1124649072 /nfs/dbraw/zinc/64/90/72/1124649072.db2.gz OZTVGBVUVSAXRB-HYVNUMGLSA-N 1 3 298.430 3.580 20 0 CHADHO CCC[C@@H]([NH2+]C[C@@H]1CCN(CCC)C1)C1CCCC1 ZINC000449095468 1124650160 /nfs/dbraw/zinc/65/01/60/1124650160.db2.gz YQICEXRMRKSOFY-DOTOQJQBSA-N 1 3 266.473 3.667 20 0 CHADHO C[NH+](C)Cc1cccc(CNCc2cccc3ccoc32)c1 ZINC000449217846 1124672584 /nfs/dbraw/zinc/67/25/84/1124672584.db2.gz CHJVSOQTGGYOPG-UHFFFAOYSA-N 1 3 294.398 3.784 20 0 CHADHO CCCC[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC[C@@H]2C)CCN1 ZINC001246092130 1131303913 /nfs/dbraw/zinc/30/39/13/1131303913.db2.gz CSCBWAXEZIOFAU-YLFCFFPRSA-N 1 3 266.473 3.713 20 0 CHADHO CCCCCC[C@H](CC)NC[C@]1(C(F)(F)F)CC[NH2+]C1 ZINC001246115943 1131339714 /nfs/dbraw/zinc/33/97/14/1131339714.db2.gz UCDCFHARFLVPNW-KBPBESRZSA-N 1 3 294.405 3.867 20 0 CHADHO CC[C@@H](c1ccccc1)N1CCC(C)([NH+]2CCC2)CC1 ZINC000880472039 1125276525 /nfs/dbraw/zinc/27/65/25/1125276525.db2.gz DXNOSNQIMLYMFC-KRWDZBQOSA-N 1 3 272.436 3.698 20 0 CHADHO CC(C)c1ccc(CNC2CC[NH+](C3CC3)CC2)cc1 ZINC000035054326 1125300978 /nfs/dbraw/zinc/30/09/78/1125300978.db2.gz HGOQVJYZJWEVAY-UHFFFAOYSA-N 1 3 272.436 3.526 20 0 CHADHO Cc1ccc([C@@H](CNc2cc[nH+]cc2C)N2CCCC2)o1 ZINC000192555329 1125334683 /nfs/dbraw/zinc/33/46/83/1125334683.db2.gz YWIYUVQNFAHZCB-MRXNPFEDSA-N 1 3 285.391 3.540 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCCC2(CC2)C1)[C@@H]1CCCN(C2CCC2)C1 ZINC000883216726 1125378916 /nfs/dbraw/zinc/37/89/16/1125378916.db2.gz VNYFDJXGAMBIHW-GVDBMIGSSA-N 1 3 290.495 3.952 20 0 CHADHO C[C@H]([NH2+][C@H]1CCCC2(CC2)C1)[C@@H]1CCCN(C2CCC2)C1 ZINC000883216725 1125379027 /nfs/dbraw/zinc/37/90/27/1125379027.db2.gz VNYFDJXGAMBIHW-BBWFWOEESA-N 1 3 290.495 3.952 20 0 CHADHO Cc1cccc(CC[C@H](C)[NH2+]C[C@H]2CCN(C(C)C)C2)c1 ZINC000040623598 1125388798 /nfs/dbraw/zinc/38/87/98/1125388798.db2.gz UJQWKOAPZJAMAY-PKOBYXMFSA-N 1 3 288.479 3.636 20 0 CHADHO CC(C)CC(CC(C)C)[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000040622367 1125388995 /nfs/dbraw/zinc/38/89/95/1125388995.db2.gz OBLHIZKPGXVSSZ-INIZCTEOSA-N 1 3 268.489 3.767 20 0 CHADHO Cc1cc(C)c(C[N@@H+]2CC[C@@H]3[C@H](CCCN3C)C2)c(C)c1 ZINC000532538400 1125409770 /nfs/dbraw/zinc/40/97/70/1125409770.db2.gz YRGWQLKGTCHGAJ-IEBWSBKVSA-N 1 3 286.463 3.528 20 0 CHADHO Cc1cc(C)c(C[N@H+]2CC[C@@H]3[C@H](CCCN3C)C2)c(C)c1 ZINC000532538400 1125409771 /nfs/dbraw/zinc/40/97/71/1125409771.db2.gz YRGWQLKGTCHGAJ-IEBWSBKVSA-N 1 3 286.463 3.528 20 0 CHADHO Cc1cc(C)c(C[N@@H+]2CC[C@H]3[C@H](CCCN3C)C2)c(C)c1 ZINC000532538401 1125410125 /nfs/dbraw/zinc/41/01/25/1125410125.db2.gz YRGWQLKGTCHGAJ-MJGOQNOKSA-N 1 3 286.463 3.528 20 0 CHADHO Cc1cc(C)c(C[N@H+]2CC[C@H]3[C@H](CCCN3C)C2)c(C)c1 ZINC000532538401 1125410127 /nfs/dbraw/zinc/41/01/27/1125410127.db2.gz YRGWQLKGTCHGAJ-MJGOQNOKSA-N 1 3 286.463 3.528 20 0 CHADHO Cc1ccc2c(c1)[C@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)CCC2 ZINC001202612363 1125444701 /nfs/dbraw/zinc/44/47/01/1125444701.db2.gz WNAXDCKCOAVGKR-FUHWJXTLSA-N 1 3 286.463 3.835 20 0 CHADHO Cc1ccc2c(c1)[C@H](N[C@H]1CC[N@H+](C)C(C)(C)C1)CCC2 ZINC001202612363 1125444702 /nfs/dbraw/zinc/44/47/02/1125444702.db2.gz WNAXDCKCOAVGKR-FUHWJXTLSA-N 1 3 286.463 3.835 20 0 CHADHO CCCCC(CCCC)[NH2+]CC[C@@H]1CCCN1C ZINC001258381110 1129302281 /nfs/dbraw/zinc/30/22/81/1129302281.db2.gz SLINGTTXLWZWCF-INIZCTEOSA-N 1 3 254.462 3.809 20 0 CHADHO [NH3+][C@@H]1C[C@H](NC[C@H]2CCc3ccccc3C2)c2ccccc21 ZINC000643478081 1129442148 /nfs/dbraw/zinc/44/21/48/1129442148.db2.gz WRDNBPGQVZWDBP-KPOBHBOGSA-N 1 3 292.426 3.526 20 0 CHADHO [NH3+][C@H]1C[C@H](NCCCCc2ccccc2)c2ccccc21 ZINC000643458339 1129442499 /nfs/dbraw/zinc/44/24/99/1129442499.db2.gz NTTUMECJVJFHQK-OALUTQOASA-N 1 3 280.415 3.744 20 0 CHADHO CC[C@@H](NC[C@@H]1CCC[NH2+]C1)c1cccc2ccccc21 ZINC000643500811 1129442984 /nfs/dbraw/zinc/44/29/84/1129442984.db2.gz UYQOEEDIHDDYLS-DNVCBOLYSA-N 1 3 282.431 3.880 20 0 CHADHO CC[C@H](NC[C@H]1CCC[NH2+]C1)c1cccc2ccccc21 ZINC000643500813 1129443054 /nfs/dbraw/zinc/44/30/54/1129443054.db2.gz UYQOEEDIHDDYLS-KXBFYZLASA-N 1 3 282.431 3.880 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCCCN1)c1cc2ccccc2s1 ZINC000643502300 1129443322 /nfs/dbraw/zinc/44/33/22/1129443322.db2.gz CDWSMIWQBRZLSU-TZMCWYRMSA-N 1 3 274.433 3.694 20 0 CHADHO Clc1ccc2c(c1)[C@@H](N[C@@H]1CCC[NH2+]CC1)CCCC2 ZINC000643522688 1129444766 /nfs/dbraw/zinc/44/47/66/1129444766.db2.gz RVDDNDWAKJORPK-WBVHZDCISA-N 1 3 292.854 3.839 20 0 CHADHO c1ccc2c(c1)CCCC[C@@H]2N[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643545714 1129445620 /nfs/dbraw/zinc/44/56/20/1129445620.db2.gz BFYWVZVJRUVWFS-AEFFLSMTSA-N 1 3 284.447 3.718 20 0 CHADHO C[C@H](NC1(c2ccccc2Cl)CC1)C1CC[NH+](C)CC1 ZINC000647316176 1129566893 /nfs/dbraw/zinc/56/68/93/1129566893.db2.gz SRBKUVQPCVYNTF-ZDUSSCGKSA-N 1 3 292.854 3.649 20 0 CHADHO C(CN1CCC2(CCCC2)C1)C[N@@H+]1CCC2(CCCC2)C1 ZINC000744421191 1129576286 /nfs/dbraw/zinc/57/62/86/1129576286.db2.gz XKBSSBCHTNMIQK-UHFFFAOYSA-N 1 3 290.495 3.909 20 0 CHADHO C(CN1CCC2(CCCC2)C1)C[N@H+]1CCC2(CCCC2)C1 ZINC000744421191 1129576288 /nfs/dbraw/zinc/57/62/88/1129576288.db2.gz XKBSSBCHTNMIQK-UHFFFAOYSA-N 1 3 290.495 3.909 20 0 CHADHO CCC[N@H+](CCCN)[C@H](Cc1ccccc1)CC(C)C ZINC001169050200 1129692042 /nfs/dbraw/zinc/69/20/42/1129692042.db2.gz NDYRCEVYOWWVOW-SFHVURJKSA-N 1 3 276.468 3.705 20 0 CHADHO CCC[N@@H+](CCCN)[C@H](Cc1ccccc1)CC(C)C ZINC001169050200 1129692044 /nfs/dbraw/zinc/69/20/44/1129692044.db2.gz NDYRCEVYOWWVOW-SFHVURJKSA-N 1 3 276.468 3.705 20 0 CHADHO CCCCc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)N3C)cc1 ZINC001169091694 1129700699 /nfs/dbraw/zinc/70/06/99/1129700699.db2.gz UQHBPQZFVUSCHI-LDLYASANSA-N 1 3 286.463 3.744 20 0 CHADHO Cc1cccc(C)c1[C@H](C)N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169107409 1129702977 /nfs/dbraw/zinc/70/29/77/1129702977.db2.gz GDGMWPVBMOEKIE-NXOAAHMSSA-N 1 3 272.436 3.579 20 0 CHADHO Cc1cccc(C)c1[C@H](C)N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169107409 1129702980 /nfs/dbraw/zinc/70/29/80/1129702980.db2.gz GDGMWPVBMOEKIE-NXOAAHMSSA-N 1 3 272.436 3.579 20 0 CHADHO Cc1ccc(C)c([C@H](C)N[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1 ZINC001169115514 1129704703 /nfs/dbraw/zinc/70/47/03/1129704703.db2.gz KHZXEXSNKYPFTO-NXOAAHMSSA-N 1 3 272.436 3.579 20 0 CHADHO Cc1ccc(C)c([C@H](C)N[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1 ZINC001169115514 1129704707 /nfs/dbraw/zinc/70/47/07/1129704707.db2.gz KHZXEXSNKYPFTO-NXOAAHMSSA-N 1 3 272.436 3.579 20 0 CHADHO C[NH2+]Cc1ccccc1CNCc1ccc(Cl)cc1C ZINC000650719379 1129720807 /nfs/dbraw/zinc/72/08/07/1129720807.db2.gz OAWMRGXTJHMDCJ-UHFFFAOYSA-N 1 3 288.822 3.658 20 0 CHADHO Cc1ccccc1[C@@H]1C[C@H]1N[C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000650742412 1129720999 /nfs/dbraw/zinc/72/09/99/1129720999.db2.gz XRCMONIFFTTZQS-USYVTKNRSA-N 1 3 298.474 3.751 20 0 CHADHO Cc1ccccc1[C@@H]1C[C@H]1[NH2+][C@@H]1C[C@H](N)c2ccccc21 ZINC000650741996 1129721587 /nfs/dbraw/zinc/72/15/87/1129721587.db2.gz PGEZUFZDKFPNNH-INDMIFKZSA-N 1 3 278.399 3.585 20 0 CHADHO Cc1ccccc1[C@@H]1C[C@H]1[NH2+][C@H]1C[C@@H](N)c2ccccc21 ZINC000650741997 1129721690 /nfs/dbraw/zinc/72/16/90/1129721690.db2.gz PGEZUFZDKFPNNH-MANSERQUSA-N 1 3 278.399 3.585 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@@H](C)c1cccc(Cl)c1 ZINC000650759323 1129722041 /nfs/dbraw/zinc/72/20/41/1129722041.db2.gz IKQWWLBRFCTKRQ-ZDUSSCGKSA-N 1 3 288.822 3.910 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCCC(C)(C)CC1)CN1CCCC1 ZINC000086908806 1129829337 /nfs/dbraw/zinc/82/93/37/1129829337.db2.gz AMTYPBMZGRBXBC-HZPDHXFCSA-N 1 3 266.473 3.667 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C[C@H]1CCC=CCCC1 ZINC000902456653 1130012633 /nfs/dbraw/zinc/01/26/33/1130012633.db2.gz PYFRHRQMEGUWRY-ZBFHGGJFSA-N 1 3 287.451 3.636 20 0 CHADHO C[NH+]1CCC(CN(Cc2ccco2)Cc2ccccc2)CC1 ZINC000788474270 1130189408 /nfs/dbraw/zinc/18/94/08/1130189408.db2.gz PBTWLBHXGIXIGL-UHFFFAOYSA-N 1 3 298.430 3.624 20 0 CHADHO CCC(CC)[C@@H](NC[C@H]([NH3+])CC(F)F)c1ccccc1 ZINC000903925598 1130210279 /nfs/dbraw/zinc/21/02/79/1130210279.db2.gz OUMFWYGWWBMGID-GDBMZVCRSA-N 1 3 284.394 3.736 20 0 CHADHO CN(CC[C@@H]1CCCC[N@@H+]1C)C[C@@H]1CCc2ccccc21 ZINC000679535074 1130536261 /nfs/dbraw/zinc/53/62/61/1130536261.db2.gz UNUNPVHNIZIAJU-ROUUACIJSA-N 1 3 286.463 3.523 20 0 CHADHO CN(CC[C@@H]1CCCC[N@H+]1C)C[C@@H]1CCc2ccccc21 ZINC000679535074 1130536268 /nfs/dbraw/zinc/53/62/68/1130536268.db2.gz UNUNPVHNIZIAJU-ROUUACIJSA-N 1 3 286.463 3.523 20 0 CHADHO CN(CC[C@@H]1CCCC[N@@H+]1C)C[C@H]1CCc2ccccc21 ZINC000679535070 1130536327 /nfs/dbraw/zinc/53/63/27/1130536327.db2.gz UNUNPVHNIZIAJU-MSOLQXFVSA-N 1 3 286.463 3.523 20 0 CHADHO CN(CC[C@@H]1CCCC[N@H+]1C)C[C@H]1CCc2ccccc21 ZINC000679535070 1130536331 /nfs/dbraw/zinc/53/63/31/1130536331.db2.gz UNUNPVHNIZIAJU-MSOLQXFVSA-N 1 3 286.463 3.523 20 0 CHADHO c1ccc(C2(C[N@@H+]3CCCC34CCNCC4)CCCC2)cc1 ZINC001235140753 1130714612 /nfs/dbraw/zinc/71/46/12/1130714612.db2.gz MDEIINAVABBQAN-UHFFFAOYSA-N 1 3 298.474 3.716 20 0 CHADHO c1ccc(C2(C[N@H+]3CCCC34CCNCC4)CCCC2)cc1 ZINC001235140753 1130714617 /nfs/dbraw/zinc/71/46/17/1130714617.db2.gz MDEIINAVABBQAN-UHFFFAOYSA-N 1 3 298.474 3.716 20 0 CHADHO Clc1cccc(CN2CCC([C@@H]3CCCC[NH2+]3)CC2)c1 ZINC001235227223 1130724114 /nfs/dbraw/zinc/72/41/14/1130724114.db2.gz FFIXVFVYCIHALL-KRWDZBQOSA-N 1 3 292.854 3.694 20 0 CHADHO C[C@H](C[N@@H+]1CCC[C@@H](CN)C1)c1cccc2ccccc21 ZINC001235675318 1130765305 /nfs/dbraw/zinc/76/53/05/1130765305.db2.gz VQKGUASDKMXFAQ-CVEARBPZSA-N 1 3 282.431 3.614 20 0 CHADHO C[C@H](C[N@H+]1CCC[C@@H](CN)C1)c1cccc2ccccc21 ZINC001235675318 1130765311 /nfs/dbraw/zinc/76/53/11/1130765311.db2.gz VQKGUASDKMXFAQ-CVEARBPZSA-N 1 3 282.431 3.614 20 0 CHADHO CC[C@@H](N)C[NH+]1CCC(CCc2ccc(Cl)cc2)CC1 ZINC001235694997 1130770313 /nfs/dbraw/zinc/77/03/13/1130770313.db2.gz MPRKDDRCGWYJOD-QGZVFWFLSA-N 1 3 294.870 3.722 20 0 CHADHO Cc1cc(CN(C)CCC2CC[NH2+]CC2)c(F)cc1Cl ZINC001235718326 1130772922 /nfs/dbraw/zinc/77/29/22/1130772922.db2.gz YGROIWPGBJUUAD-UHFFFAOYSA-N 1 3 298.833 3.609 20 0 CHADHO CCCCCCc1ccc(CN2CC[C@H](C[NH3+])C2)s1 ZINC001235749627 1130776805 /nfs/dbraw/zinc/77/68/05/1130776805.db2.gz IOZWYONWUIBCGM-CQSZACIVSA-N 1 3 280.481 3.652 20 0 CHADHO CC(C)(C)c1[nH]c2ccccc2c1CN1CCC(C)([NH3+])CC1 ZINC001235749428 1130777378 /nfs/dbraw/zinc/77/73/78/1130777378.db2.gz SUVUJPPGLQQGOR-UHFFFAOYSA-N 1 3 299.462 3.779 20 0 CHADHO CCCCCCc1ccc(CN2CC3(CC([NH3+])C3)C2)s1 ZINC001235820442 1130784255 /nfs/dbraw/zinc/78/42/55/1130784255.db2.gz NDUDYOVIFHJAAH-UHFFFAOYSA-N 1 3 292.492 3.794 20 0 CHADHO CCCCc1ccc(CN2CC3(C2)CCC[NH2+]CC3)s1 ZINC001236008284 1130832577 /nfs/dbraw/zinc/83/25/77/1130832577.db2.gz AQEKBTRXLQXXHG-UHFFFAOYSA-N 1 3 292.492 3.666 20 0 CHADHO [NH3+]CCCCCCN1CCC[C@@H]1c1c(F)cccc1F ZINC001236189286 1130881113 /nfs/dbraw/zinc/88/11/13/1130881113.db2.gz KRSAQUYJQAEJDK-OAHLLOKOSA-N 1 3 282.378 3.621 20 0 CHADHO CCCc1ccc(C[N@@H+](CCC)C2CCNCC2)cc1 ZINC001236182367 1130882514 /nfs/dbraw/zinc/88/25/14/1130882514.db2.gz MSQLKDBVRZHLBC-UHFFFAOYSA-N 1 3 274.452 3.603 20 0 CHADHO CCCc1ccc(C[N@H+](CCC)C2CCNCC2)cc1 ZINC001236182367 1130882521 /nfs/dbraw/zinc/88/25/21/1130882521.db2.gz MSQLKDBVRZHLBC-UHFFFAOYSA-N 1 3 274.452 3.603 20 0 CHADHO CCCc1ccc(CN(CCC)C2CC[NH2+]CC2)cc1 ZINC001236182367 1130882529 /nfs/dbraw/zinc/88/25/29/1130882529.db2.gz MSQLKDBVRZHLBC-UHFFFAOYSA-N 1 3 274.452 3.603 20 0 CHADHO CC(C)c1cccc(C[N@H+](C)[C@H]2CCCC[C@H]2N)c1 ZINC001236214071 1130890825 /nfs/dbraw/zinc/89/08/25/1130890825.db2.gz DUKJBQMQIXDRBZ-SJORKVTESA-N 1 3 260.425 3.512 20 0 CHADHO CC(C)c1cccc(C[N@@H+](C)[C@H]2CCCC[C@H]2N)c1 ZINC001236214071 1130890831 /nfs/dbraw/zinc/89/08/31/1130890831.db2.gz DUKJBQMQIXDRBZ-SJORKVTESA-N 1 3 260.425 3.512 20 0 CHADHO C[N@H+](Cc1c[nH]c2ccc(Cl)cc12)[C@@H]1CCCC[C@H]1N ZINC001236212949 1130891342 /nfs/dbraw/zinc/89/13/42/1130891342.db2.gz MWCLREHYNDGFBT-GDBMZVCRSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@@H+](Cc1c[nH]c2ccc(Cl)cc12)[C@@H]1CCCC[C@H]1N ZINC001236212949 1130891347 /nfs/dbraw/zinc/89/13/47/1130891347.db2.gz MWCLREHYNDGFBT-GDBMZVCRSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@H+](Cc1cccc2sccc21)[C@H]1CCCC[C@H]1N ZINC001236214544 1130891386 /nfs/dbraw/zinc/89/13/86/1130891386.db2.gz FSPQWLVATJOUPH-CABCVRRESA-N 1 3 274.433 3.603 20 0 CHADHO C[N@@H+](Cc1cccc2sccc21)[C@H]1CCCC[C@H]1N ZINC001236214544 1130891390 /nfs/dbraw/zinc/89/13/90/1130891390.db2.gz FSPQWLVATJOUPH-CABCVRRESA-N 1 3 274.433 3.603 20 0 CHADHO C[N@H+](Cc1c[nH]c2cc(Cl)ccc12)[C@H]1CCCC[C@@H]1N ZINC001236217391 1130892946 /nfs/dbraw/zinc/89/29/46/1130892946.db2.gz OUSOCJBSSISPIC-HOCLYGCPSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@@H+](Cc1c[nH]c2cc(Cl)ccc12)[C@H]1CCCC[C@@H]1N ZINC001236217391 1130892953 /nfs/dbraw/zinc/89/29/53/1130892953.db2.gz OUSOCJBSSISPIC-HOCLYGCPSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@H+](Cc1ccc(F)c2ccccc12)[C@H]1CCCC[C@H]1N ZINC001236220629 1130894336 /nfs/dbraw/zinc/89/43/36/1130894336.db2.gz ZCCSGZBJBALBQD-MSOLQXFVSA-N 1 3 286.394 3.681 20 0 CHADHO C[N@@H+](Cc1ccc(F)c2ccccc12)[C@H]1CCCC[C@H]1N ZINC001236220629 1130894341 /nfs/dbraw/zinc/89/43/41/1130894341.db2.gz ZCCSGZBJBALBQD-MSOLQXFVSA-N 1 3 286.394 3.681 20 0 CHADHO c1ccc2c(c1)oc1c2cccc1CN1CCC[NH2+]CCC1 ZINC001236239643 1130901812 /nfs/dbraw/zinc/90/18/12/1130901812.db2.gz KFLDDAJGOSSACU-UHFFFAOYSA-N 1 3 294.398 3.771 20 0 CHADHO Cc1ccccc1-c1ccccc1CN1CCC[NH2+]CCC1 ZINC001236239645 1130902023 /nfs/dbraw/zinc/90/20/23/1130902023.db2.gz KJUSNOGUZJJCFR-UHFFFAOYSA-N 1 3 294.442 3.847 20 0 CHADHO CCC[C@H](C)C[N@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236371815 1130922189 /nfs/dbraw/zinc/92/21/89/1130922189.db2.gz NPKFKXQDZOCDHD-HOTGVXAUSA-N 1 3 266.473 3.667 20 0 CHADHO CCC[C@H](C)C[N@@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236371815 1130922190 /nfs/dbraw/zinc/92/21/90/1130922190.db2.gz NPKFKXQDZOCDHD-HOTGVXAUSA-N 1 3 266.473 3.667 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](CN(C)[C@@H]2[C@H]3C[NH2+]C[C@H]32)CC1 ZINC001236411150 1130931885 /nfs/dbraw/zinc/93/18/85/1130931885.db2.gz MYXBJKPMYYWSOL-YRXWBPOGSA-N 1 3 288.479 3.609 20 0 CHADHO Cc1ccc([C@@H](C)CCN(C[C@H]2CCC[NH2+]C2)C2CC2)o1 ZINC001236584504 1130980337 /nfs/dbraw/zinc/98/03/37/1130980337.db2.gz FUJBVSVJJZDDLJ-HOCLYGCPSA-N 1 3 290.451 3.546 20 0 CHADHO Cc1cc(Cl)cc(CN(C2CCC2)C2CC[NH2+]CC2)c1 ZINC001236636392 1130987010 /nfs/dbraw/zinc/98/70/10/1130987010.db2.gz FGSPRXVWSPGYSR-UHFFFAOYSA-N 1 3 292.854 3.755 20 0 CHADHO CCCN(Cc1cccc2sccc21)C[C@H]1CC[NH2+]C1 ZINC001236845088 1131021810 /nfs/dbraw/zinc/02/18/10/1131021810.db2.gz YRNOGRIAORJKSZ-AWEZNQCLSA-N 1 3 288.460 3.723 20 0 CHADHO C[C@H](N)C[N@H+](C)Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001236894971 1131028476 /nfs/dbraw/zinc/02/84/76/1131028476.db2.gz HNUFIYXQVJUUTG-AWEZNQCLSA-N 1 3 293.414 3.614 20 0 CHADHO C[C@H](N)C[N@@H+](C)Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001236894971 1131028483 /nfs/dbraw/zinc/02/84/83/1131028483.db2.gz HNUFIYXQVJUUTG-AWEZNQCLSA-N 1 3 293.414 3.614 20 0 CHADHO C[C@]1(C[NH3+])CCCN(Cc2ccc(C3CCC3)cc2)C1 ZINC001237083183 1131046580 /nfs/dbraw/zinc/04/65/80/1131046580.db2.gz WXDJPAMDNUNLAN-GOSISDBHSA-N 1 3 272.436 3.515 20 0 CHADHO [NH3+]CC1C[C@H]2CC[C@@H](C1)N2Cc1cc(Cl)cc(Cl)c1 ZINC001237081999 1131047685 /nfs/dbraw/zinc/04/76/85/1131047685.db2.gz OLUHUURONYNHCO-BWXMKOSVSA-N 1 3 299.245 3.695 20 0 CHADHO [NH3+]CC1C[C@H]2CC[C@@H](C1)N2Cc1ccc(Cl)cc1Cl ZINC001237082789 1131047751 /nfs/dbraw/zinc/04/77/51/1131047751.db2.gz SUTKSTCVFACOFP-FTNCPSPGSA-N 1 3 299.245 3.695 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc21 ZINC001237880968 1131147945 /nfs/dbraw/zinc/14/79/45/1131147945.db2.gz LGLCNLCQJBGDCY-OAHLLOKOSA-N 1 3 284.447 3.920 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc21 ZINC001237880968 1131147947 /nfs/dbraw/zinc/14/79/47/1131147947.db2.gz LGLCNLCQJBGDCY-OAHLLOKOSA-N 1 3 284.447 3.920 20 0 CHADHO C[C@@H](N[C@H]1CCC[NH2+]CC1)c1csc2ccccc12 ZINC000817899418 1131186787 /nfs/dbraw/zinc/18/67/87/1131186787.db2.gz OJDSCKPEOMYWAJ-OLZOCXBDSA-N 1 3 274.433 3.694 20 0 CHADHO CCCCC[C@H](C)[NH2+][C@H]1CCN[C@H](CCCC)C1 ZINC001246235214 1131420209 /nfs/dbraw/zinc/42/02/09/1131420209.db2.gz QTSHDPDPXDAVBM-XHSDSOJGSA-N 1 3 254.462 3.856 20 0 CHADHO Cc1cc(CN(C)Cc2ccc(C[NH+](C)C)cc2)cs1 ZINC000824383535 1131467660 /nfs/dbraw/zinc/46/76/60/1131467660.db2.gz PRTDGOYEMZUNPH-UHFFFAOYSA-N 1 3 288.460 3.750 20 0 CHADHO CCC[C@@H](C)CC[C@H](C)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246332884 1131472148 /nfs/dbraw/zinc/47/21/48/1131472148.db2.gz NQMJIPPDWVARKE-ALYAQQCSSA-N 1 3 266.473 3.854 20 0 CHADHO CC[C@@]1(CN[C@H](C)C[C@@H](C)CC(C)C)CCC[NH2+]1 ZINC001246458551 1131507636 /nfs/dbraw/zinc/50/76/36/1131507636.db2.gz YYEICPCFZHGKSE-XHSDSOJGSA-N 1 3 254.462 3.569 20 0 CHADHO CCCCCC[C@@H](CCC)[NH2+][C@@H](C(C)C)C1CNC1 ZINC001246512631 1131538953 /nfs/dbraw/zinc/53/89/53/1131538953.db2.gz BBVBKBWAAYGWTA-SJORKVTESA-N 1 3 268.489 3.959 20 0 CHADHO CCCCCC[C@H](CC)[NH2+][C@@H](C(C)C)C1CNC1 ZINC001246519214 1131545562 /nfs/dbraw/zinc/54/55/62/1131545562.db2.gz QYTFGLMZJQLENO-HOTGVXAUSA-N 1 3 254.462 3.569 20 0 CHADHO CCCCC[C@H](CCC)[N@@H+]1CC[C@@H](C)[C@@H](CN)C1 ZINC001246550740 1131606215 /nfs/dbraw/zinc/60/62/15/1131606215.db2.gz KRJSLTHIMITOKD-PMPSAXMXSA-N 1 3 254.462 3.652 20 0 CHADHO CCCCC[C@H](CCC)[N@H+]1CC[C@@H](C)[C@@H](CN)C1 ZINC001246550740 1131606217 /nfs/dbraw/zinc/60/62/17/1131606217.db2.gz KRJSLTHIMITOKD-PMPSAXMXSA-N 1 3 254.462 3.652 20 0 CHADHO [NH3+][C@@H]1C[C@H](NCCC[C@@H]2CC2(Cl)Cl)c2ccccc21 ZINC000844926065 1131607949 /nfs/dbraw/zinc/60/79/49/1131607949.db2.gz UBFNMKWFEPWGNY-HONMWMINSA-N 1 3 299.245 3.695 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@@H](C)c1ccc(F)cc1C ZINC000844922698 1131607983 /nfs/dbraw/zinc/60/79/83/1131607983.db2.gz CRKIYWNIUMIXCG-AWEZNQCLSA-N 1 3 286.394 3.704 20 0 CHADHO C[C@@H]1[C@@H](CN)CCC[N@@H+]1[C@H]1CCCC2(CCCCC2)C1 ZINC001246565109 1131630869 /nfs/dbraw/zinc/63/08/69/1131630869.db2.gz OORMQGCWPDPDOL-ZACQAIPSSA-N 1 3 278.484 3.939 20 0 CHADHO C[C@@H]1[C@@H](CN)CCC[N@H+]1[C@H]1CCCC2(CCCCC2)C1 ZINC001246565109 1131630872 /nfs/dbraw/zinc/63/08/72/1131630872.db2.gz OORMQGCWPDPDOL-ZACQAIPSSA-N 1 3 278.484 3.939 20 0 CHADHO CCCCCC[C@H](CCC)N1CCC[C@@]12CC[NH2+]C2 ZINC001246648512 1131776986 /nfs/dbraw/zinc/77/69/86/1131776986.db2.gz LZCWUATYXZGUAO-IRXDYDNUSA-N 1 3 266.473 3.953 20 0 CHADHO C=C/C=C\CC[NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000716703099 1132030659 /nfs/dbraw/zinc/03/06/59/1132030659.db2.gz XNQITIVWFZXMOE-WKAYRIQESA-N 1 3 296.458 3.761 20 0 CHADHO CN1C(C)(C)CC([NH2+]C2CCC(F)CC2)CC1(C)C ZINC001171613995 1132066199 /nfs/dbraw/zinc/06/61/99/1132066199.db2.gz SSZOWBFQROLZDV-UHFFFAOYSA-N 1 3 270.436 3.508 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@@H]2CCC(C)(C)C2)CC1(C)C ZINC001171625091 1132067379 /nfs/dbraw/zinc/06/73/79/1132067379.db2.gz BLXKOMABJVTKQO-CYBMUJFWSA-N 1 3 266.473 3.806 20 0 CHADHO Cc1ccc(CC[C@H](C)[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)cc1 ZINC001171664332 1132072917 /nfs/dbraw/zinc/07/29/17/1132072917.db2.gz XWIQTEFHLUFHLT-QXAKKESOSA-N 1 3 288.479 3.779 20 0 CHADHO Cc1ccc([C@@H](C)N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172100551 1132124398 /nfs/dbraw/zinc/12/43/98/1132124398.db2.gz DYOIEYYOWBZRQX-DDBAPUKQSA-N 1 3 272.436 3.661 20 0 CHADHO Cc1ccc([C@@H](C)N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172100551 1132124402 /nfs/dbraw/zinc/12/44/02/1132124402.db2.gz DYOIEYYOWBZRQX-DDBAPUKQSA-N 1 3 272.436 3.661 20 0 CHADHO C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](NCc1cccc3ccccc31)C2 ZINC001172100095 1132126227 /nfs/dbraw/zinc/12/62/27/1132126227.db2.gz MUZCWVNFTOBDCM-LDLYASANSA-N 1 3 294.442 3.945 20 0 CHADHO C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H](NCc1cccc3ccccc31)C2 ZINC001172100095 1132126229 /nfs/dbraw/zinc/12/62/29/1132126229.db2.gz MUZCWVNFTOBDCM-LDLYASANSA-N 1 3 294.442 3.945 20 0 CHADHO C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2C)c1ccc(F)cc1F ZINC001172104331 1132130819 /nfs/dbraw/zinc/13/08/19/1132130819.db2.gz DXKRDXCWDWTJQQ-MHEUCROKSA-N 1 3 294.389 3.631 20 0 CHADHO Cc1ccc([C@H](C)N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1C ZINC001172118611 1132132090 /nfs/dbraw/zinc/13/20/90/1132132090.db2.gz SDEMAWLJCUNUSZ-DSLXNQLJSA-N 1 3 286.463 3.969 20 0 CHADHO Cc1ccc([C@H](C)N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1C ZINC001172118611 1132132093 /nfs/dbraw/zinc/13/20/93/1132132093.db2.gz SDEMAWLJCUNUSZ-DSLXNQLJSA-N 1 3 286.463 3.969 20 0 CHADHO C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](NC(C)(C)c1ccc(F)cc1)C2 ZINC001172114772 1132133170 /nfs/dbraw/zinc/13/31/70/1132133170.db2.gz QADTYRULSDEWLH-OSYLJGHBSA-N 1 3 290.426 3.666 20 0 CHADHO C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H](NC(C)(C)c1ccc(F)cc1)C2 ZINC001172114772 1132133173 /nfs/dbraw/zinc/13/31/73/1132133173.db2.gz QADTYRULSDEWLH-OSYLJGHBSA-N 1 3 290.426 3.666 20 0 CHADHO CCC[C@@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccncc1 ZINC001172113602 1132133200 /nfs/dbraw/zinc/13/32/00/1132133200.db2.gz DSRNFHWLIDSUEK-XMTFNYHQSA-N 1 3 287.451 3.528 20 0 CHADHO CCC[C@@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccncc1 ZINC001172113602 1132133203 /nfs/dbraw/zinc/13/32/03/1132133203.db2.gz DSRNFHWLIDSUEK-XMTFNYHQSA-N 1 3 287.451 3.528 20 0 CHADHO CN(C)CCC[N@H+](C)Cc1ccc(-c2cccs2)cc1 ZINC001231429369 1132294557 /nfs/dbraw/zinc/29/45/57/1132294557.db2.gz IBDAMBFPCNRQIX-UHFFFAOYSA-N 1 3 288.460 3.799 20 0 CHADHO CN(C)CCC[N@@H+](C)Cc1ccc(-c2cccs2)cc1 ZINC001231429369 1132294562 /nfs/dbraw/zinc/29/45/62/1132294562.db2.gz IBDAMBFPCNRQIX-UHFFFAOYSA-N 1 3 288.460 3.799 20 0 CHADHO C[C@H]1C[C@@H]([NH2+]C2CCN(CC3CCCCC3)CC2)CS1 ZINC000840856030 1132295403 /nfs/dbraw/zinc/29/54/03/1132295403.db2.gz OWCDHMKSGPBFSR-WMLDXEAASA-N 1 3 296.524 3.515 20 0 CHADHO C[C@H]1C[C@@H](NC2CC[NH+](CC3CCCCC3)CC2)CS1 ZINC000840856030 1132295409 /nfs/dbraw/zinc/29/54/09/1132295409.db2.gz OWCDHMKSGPBFSR-WMLDXEAASA-N 1 3 296.524 3.515 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+]C2CCN(CC3CCCCC3)CC2)CS1 ZINC000840856027 1132296673 /nfs/dbraw/zinc/29/66/73/1132296673.db2.gz OWCDHMKSGPBFSR-RHSMWYFYSA-N 1 3 296.524 3.515 20 0 CHADHO C[C@@H]1C[C@@H](NC2CC[NH+](CC3CCCCC3)CC2)CS1 ZINC000840856027 1132296682 /nfs/dbraw/zinc/29/66/82/1132296682.db2.gz OWCDHMKSGPBFSR-RHSMWYFYSA-N 1 3 296.524 3.515 20 0 CHADHO CCCC[C@H](CC(C)C)[NH2+]CC[C@H]1CCCN1C ZINC001173248769 1132419365 /nfs/dbraw/zinc/41/93/65/1132419365.db2.gz FYNWSYBACGNXFS-HZPDHXFCSA-N 1 3 254.462 3.665 20 0 CHADHO CCc1ccc(C[C@@H](C)[NH2+]CCCN(CC)CC)cc1 ZINC001173238709 1132440358 /nfs/dbraw/zinc/44/03/58/1132440358.db2.gz WDFFQTQHHRVLCR-MRXNPFEDSA-N 1 3 276.468 3.502 20 0 CHADHO CC(C)[N@H+](CCCN)[C@@H]1CCCC2(CCCCC2)C1 ZINC001173339842 1132467236 /nfs/dbraw/zinc/46/72/36/1132467236.db2.gz QPLSRBZQVIDYMZ-MRXNPFEDSA-N 1 3 266.473 3.939 20 0 CHADHO CC(C)[N@@H+](CCCN)[C@@H]1CCCC2(CCCCC2)C1 ZINC001173339842 1132467239 /nfs/dbraw/zinc/46/72/39/1132467239.db2.gz QPLSRBZQVIDYMZ-MRXNPFEDSA-N 1 3 266.473 3.939 20 0 CHADHO CN(C)Cc1ccccc1Nc1ccc([C@H]2CCC[NH2+]2)cc1 ZINC001159712769 1132897589 /nfs/dbraw/zinc/89/75/89/1132897589.db2.gz NBFZQGQOBLASIN-GOSISDBHSA-N 1 3 295.430 3.916 20 0 CHADHO CC(C)c1ccc(CC[NH2+]C[C@H]2CCCCN(C)C2)cc1 ZINC001206680592 1133125750 /nfs/dbraw/zinc/12/57/50/1133125750.db2.gz NQNPUGAPRCJUFK-GOSISDBHSA-N 1 3 288.479 3.674 20 0 CHADHO [NH3+]C1CCN(Cc2cccc3c4ccccc4sc32)CC1 ZINC001204646363 1133471182 /nfs/dbraw/zinc/47/11/82/1133471182.db2.gz QKIFUZGQYBLEBD-UHFFFAOYSA-N 1 3 296.439 3.978 20 0 CHADHO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ccc3c(c2)CNC3)c1 ZINC001204848240 1133491214 /nfs/dbraw/zinc/49/12/14/1133491214.db2.gz MACXEXYWXIZKBY-HXUWFJFHSA-N 1 3 292.426 3.935 20 0 CHADHO Cc1cccc([C@H]2CCC[N@H+]2Cc2ccc3c(c2)CNC3)c1 ZINC001204848240 1133491217 /nfs/dbraw/zinc/49/12/17/1133491217.db2.gz MACXEXYWXIZKBY-HXUWFJFHSA-N 1 3 292.426 3.935 20 0 CHADHO C[C@H]1CC[C@@H](CN)[N@@H+]1Cc1cc(-c2ccsc2)cs1 ZINC001205082955 1133525239 /nfs/dbraw/zinc/52/52/39/1133525239.db2.gz LSQVDZAIJLTMOA-FZMZJTMJSA-N 1 3 292.473 3.788 20 0 CHADHO C[C@H]1CC[C@@H](CN)[N@H+]1Cc1cc(-c2ccsc2)cs1 ZINC001205082955 1133525242 /nfs/dbraw/zinc/52/52/42/1133525242.db2.gz LSQVDZAIJLTMOA-FZMZJTMJSA-N 1 3 292.473 3.788 20 0 CHADHO [NH3+][C@@H]1CCCN(Cc2ccc(-c3ccccc3)s2)CC1 ZINC001205101275 1133530310 /nfs/dbraw/zinc/53/03/10/1133530310.db2.gz CSPLLFWVSAXESM-OAHLLOKOSA-N 1 3 286.444 3.728 20 0 CHADHO [NH3+][C@H]1CCCN(Cc2cccc(-c3ccccc3)c2)CC1 ZINC001205110608 1133531459 /nfs/dbraw/zinc/53/14/59/1133531459.db2.gz XATGPCURTJWTDY-IBGZPJMESA-N 1 3 280.415 3.667 20 0 CHADHO Cc1csc2sc(CN3CCC[C@@H]([NH3+])CC3)c(C)c12 ZINC001205117159 1133531762 /nfs/dbraw/zinc/53/17/62/1133531762.db2.gz MDBLBERPWVSAEQ-GFCCVEGCSA-N 1 3 294.489 3.893 20 0 CHADHO Cc1cccc(-c2ccc(CN3CCC[C@H]([NH3+])CC3)cc2)c1 ZINC001205116573 1133532556 /nfs/dbraw/zinc/53/25/56/1133532556.db2.gz DABXENCTFBAFDF-FQEVSTJZSA-N 1 3 294.442 3.975 20 0 CHADHO CC(C)Cc1ccc(CN2CCC[C@@](C)([NH3+])CC2)cc1 ZINC001205280745 1133554351 /nfs/dbraw/zinc/55/43/51/1133554351.db2.gz HSMKJQXJZKVBIJ-GOSISDBHSA-N 1 3 274.452 3.588 20 0 CHADHO CC(C)c1cccc(CN2CCC[C@@](C)([NH3+])CC2)c1 ZINC001205288389 1133554557 /nfs/dbraw/zinc/55/45/57/1133554557.db2.gz KBXJPSMHCQROOK-QGZVFWFLSA-N 1 3 260.425 3.513 20 0 CHADHO CCCCc1ccc(CN2CC[C@H](C)[C@H](C[NH3+])C2)s1 ZINC001205306335 1133558333 /nfs/dbraw/zinc/55/83/33/1133558333.db2.gz VNYGXDFBGMFUCB-UONOGXRCSA-N 1 3 280.481 3.507 20 0 CHADHO Cc1ccc(-c2ccc(C[N@H+]3CCNCC[C@@H]3C)cc2)cc1 ZINC001205332364 1133563338 /nfs/dbraw/zinc/56/33/38/1133563338.db2.gz PSAZFIAAMVSUAX-KRWDZBQOSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1ccc(-c2ccc(C[N@@H+]3CCNCC[C@@H]3C)cc2)cc1 ZINC001205332364 1133563341 /nfs/dbraw/zinc/56/33/41/1133563341.db2.gz PSAZFIAAMVSUAX-KRWDZBQOSA-N 1 3 294.442 3.846 20 0 CHADHO C[C@H]1CC[C@H](CN)[N@H+](Cc2ccc(F)c3ccccc23)C1 ZINC001205816513 1133617704 /nfs/dbraw/zinc/61/77/04/1133617704.db2.gz NFUAEXDQSPEQOH-DZGCQCFKSA-N 1 3 286.394 3.538 20 0 CHADHO C[C@H]1CC[C@H](CN)[N@@H+](Cc2ccc(F)c3ccccc23)C1 ZINC001205816513 1133617709 /nfs/dbraw/zinc/61/77/09/1133617709.db2.gz NFUAEXDQSPEQOH-DZGCQCFKSA-N 1 3 286.394 3.538 20 0 CHADHO CCC(C)(C)c1ccc(CN2CCC[C@@H](C[NH3+])[C@@H]2C)cc1 ZINC001205915628 1133630272 /nfs/dbraw/zinc/63/02/72/1133630272.db2.gz QBHYTVOJOALMKM-RDJZCZTQSA-N 1 3 288.479 3.933 20 0 CHADHO C[C@@H]1CC[N@H+](Cc2cccc3c4ccccc4oc32)C[C@H]1N ZINC001206043517 1133647165 /nfs/dbraw/zinc/64/71/65/1133647165.db2.gz JCCITYYVZFXMEH-CXAGYDPISA-N 1 3 294.398 3.755 20 0 CHADHO C[C@@H]1CC[N@@H+](Cc2cccc3c4ccccc4oc32)C[C@H]1N ZINC001206043517 1133647167 /nfs/dbraw/zinc/64/71/67/1133647167.db2.gz JCCITYYVZFXMEH-CXAGYDPISA-N 1 3 294.398 3.755 20 0 CHADHO [NH3+]Cc1ccc(CN2CCC[C@H]2c2ccc(F)cc2)cc1 ZINC001206049955 1133649597 /nfs/dbraw/zinc/64/95/97/1133649597.db2.gz VZGBKDKIXXFJOQ-SFHVURJKSA-N 1 3 284.378 3.622 20 0 CHADHO Cc1cc(CN(C(C)C)[C@@H]2CCC[NH2+]CC2)cc(C)c1F ZINC001206588875 1133723601 /nfs/dbraw/zinc/72/36/01/1133723601.db2.gz CSGJFKBSXDVCKZ-QGZVFWFLSA-N 1 3 292.442 3.795 20 0 CHADHO C[C@H]1CC[C@@H](C[NH3+])CN1Cc1ccc(F)c2ccccc12 ZINC001206767881 1133746255 /nfs/dbraw/zinc/74/62/55/1133746255.db2.gz FVSBECOTBMGAFL-KBPBESRZSA-N 1 3 286.394 3.538 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@H]1CCC[C@H](C2CC2)C1 ZINC001207858153 1133855208 /nfs/dbraw/zinc/85/52/08/1133855208.db2.gz FOSZGPATCCVLOF-XIRDDKMYSA-N 1 3 266.473 3.665 20 0 CHADHO Cc1cccc(C[N@@H+](C)CC2(CN(C)C)CCCC2)c1 ZINC001208182415 1133901007 /nfs/dbraw/zinc/90/10/07/1133901007.db2.gz QVYSBFNJELMUIL-UHFFFAOYSA-N 1 3 274.452 3.549 20 0 CHADHO Cc1cccc(C[N@H+](C)CC2(CN(C)C)CCCC2)c1 ZINC001208182415 1133901012 /nfs/dbraw/zinc/90/10/12/1133901012.db2.gz QVYSBFNJELMUIL-UHFFFAOYSA-N 1 3 274.452 3.549 20 0 CHADHO Cc1c(Cl)cccc1CN1CCC[C@]12CCC[NH2+]CC2 ZINC001222321361 1135225203 /nfs/dbraw/zinc/22/52/03/1135225203.db2.gz UFRWHSQOBWUMTR-KRWDZBQOSA-N 1 3 292.854 3.757 20 0 CHADHO C[N@H+](CC1CCCCC1)C1CCN(c2ccncc2)CC1 ZINC000367110242 529864818 /nfs/dbraw/zinc/86/48/18/529864818.db2.gz MACPDLLLGPRPAV-UHFFFAOYSA-N 1 3 287.451 3.563 20 0 CHADHO C[N@@H+](CC1CCCCC1)C1CCN(c2ccncc2)CC1 ZINC000367110242 529864820 /nfs/dbraw/zinc/86/48/20/529864820.db2.gz MACPDLLLGPRPAV-UHFFFAOYSA-N 1 3 287.451 3.563 20 0 CHADHO CN1CC=C(C[NH2+][C@@H](CC2CCC2)c2ccccc2)CC1 ZINC000344313628 530047409 /nfs/dbraw/zinc/04/74/09/530047409.db2.gz ZAWJNJUPKRHLNV-IBGZPJMESA-N 1 3 284.447 3.769 20 0 CHADHO CCC[NH+]1CCC(N[C@@H](C)c2ccc(C)s2)CC1 ZINC000020189982 171056561 /nfs/dbraw/zinc/05/65/61/171056561.db2.gz HIRDNWOGRVRUBJ-ZDUSSCGKSA-N 1 3 266.454 3.582 20 0 CHADHO Cc1ccccc1CNCCC[N@@H+](C)Cc1ccccc1 ZINC000021012336 171288129 /nfs/dbraw/zinc/28/81/29/171288129.db2.gz BVRUWFIAQVFZQT-UHFFFAOYSA-N 1 3 282.431 3.607 20 0 CHADHO Cc1ccccc1CNCCC[N@H+](C)Cc1ccccc1 ZINC000021012336 171288131 /nfs/dbraw/zinc/28/81/31/171288131.db2.gz BVRUWFIAQVFZQT-UHFFFAOYSA-N 1 3 282.431 3.607 20 0 CHADHO CC(C)(C)C[C@@H]([NH2+]C1CCNCC1)c1ccccc1 ZINC000038041346 174042097 /nfs/dbraw/zinc/04/20/97/174042097.db2.gz HUTHHYRRHKLLSM-MRXNPFEDSA-N 1 3 260.425 3.506 20 0 CHADHO Cc1ccccc1[C@H](C)[NH2+]C[C@@H](C)CN1CCCCC1 ZINC000038041721 174043168 /nfs/dbraw/zinc/04/31/68/174043168.db2.gz CULGSRINXPTZGF-WBVHZDCISA-N 1 3 274.452 3.768 20 0 CHADHO C[C@H](C[NH2+][C@H](C)c1cccs1)CN1CCCCC1 ZINC000038041735 174043418 /nfs/dbraw/zinc/04/34/18/174043418.db2.gz FCYDXHWALHDBEZ-ZIAGYGMSSA-N 1 3 266.454 3.521 20 0 CHADHO Cc1cc(NCC(C)(C)C[NH+](C)C)c2ccccc2n1 ZINC000035206381 260015718 /nfs/dbraw/zinc/01/57/18/260015718.db2.gz LGMZEZUHXYIUCS-UHFFFAOYSA-N 1 3 271.408 3.543 20 0 CHADHO CCC[NH+]1CCC(N[C@H](CC)c2cccc(C)c2)CC1 ZINC000312538372 260142847 /nfs/dbraw/zinc/14/28/47/260142847.db2.gz FFZAFHOZLXYJFT-GOSISDBHSA-N 1 3 274.452 3.910 20 0 CHADHO [NH3+]CC[C@@H]1CCCCN1Cc1csc2ccccc12 ZINC000070148847 260152829 /nfs/dbraw/zinc/15/28/29/260152829.db2.gz IIPZNBOEMJHCGK-AWEZNQCLSA-N 1 3 274.433 3.605 20 0 CHADHO C[NH2+]CCC1CCN([C@H](C)c2ccc(Cl)cc2)CC1 ZINC000070188782 260154036 /nfs/dbraw/zinc/15/40/36/260154036.db2.gz LYQPPXPPAXYSHY-CYBMUJFWSA-N 1 3 280.843 3.723 20 0 CHADHO C[NH2+]CCC1CCN([C@@H](C)c2cccc(Cl)c2)CC1 ZINC000070188785 260154086 /nfs/dbraw/zinc/15/40/86/260154086.db2.gz YDZRFXQKTIMCJF-ZDUSSCGKSA-N 1 3 280.843 3.723 20 0 CHADHO CC1(C)CC([NH2+]CC2CCCCCC2)CC(C)(C)N1 ZINC000089557122 260187786 /nfs/dbraw/zinc/18/77/86/260187786.db2.gz MZVUOFBRIABMSO-UHFFFAOYSA-N 1 3 266.473 3.856 20 0 CHADHO C[C@H](C[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1)CN(C)C ZINC000310780135 260228507 /nfs/dbraw/zinc/22/85/07/260228507.db2.gz RKKPHQQMPNSYTL-GHMZBOCLSA-N 1 3 289.250 3.842 20 0 CHADHO C1C[C@H]2C[C@H]([NH2+][C@H]3CCCC34CCCCC4)CCN2C1 ZINC000313037045 260240469 /nfs/dbraw/zinc/24/04/69/260240469.db2.gz NEKVRRIQQNLPFY-IKGGRYGDSA-N 1 3 276.468 3.706 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCN2CCC[C@@H]2C1)C1CCCCC1 ZINC000130247617 260394056 /nfs/dbraw/zinc/39/40/56/260394056.db2.gz AQMYUEGIVPUNSN-ZACQAIPSSA-N 1 3 264.457 3.562 20 0 CHADHO CC(C)(C)[C@H](NC[C@@H]1CCC[NH2+]C1)c1ccc(F)cc1 ZINC000130951634 260399706 /nfs/dbraw/zinc/39/97/06/260399706.db2.gz UQQAYABQKXOSPA-CZUORRHYSA-N 1 3 278.415 3.502 20 0 CHADHO Cc1cccc2c1[C@@H](C)C[C@@H]2NC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000152867136 261070820 /nfs/dbraw/zinc/07/08/20/261070820.db2.gz QZTORFPEBDFYCF-MPGHIAIKSA-N 1 3 284.447 3.617 20 0 CHADHO Cc1cccc2c1[C@@H](C)C[C@@H]2NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000152867136 261070821 /nfs/dbraw/zinc/07/08/21/261070821.db2.gz QZTORFPEBDFYCF-MPGHIAIKSA-N 1 3 284.447 3.617 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@H]2NC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000152867219 261070827 /nfs/dbraw/zinc/07/08/27/261070827.db2.gz QZTORFPEBDFYCF-RVKKMQEKSA-N 1 3 284.447 3.617 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@H]2NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000152867219 261070828 /nfs/dbraw/zinc/07/08/28/261070828.db2.gz QZTORFPEBDFYCF-RVKKMQEKSA-N 1 3 284.447 3.617 20 0 CHADHO c1ccc(CCCN2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000157288069 261143639 /nfs/dbraw/zinc/14/36/39/261143639.db2.gz RNWKFJYIZKLLBP-LJQANCHMSA-N 1 3 286.463 3.570 20 0 CHADHO C[C@@H](C[NH2+]C1CCN(C(C)(C)C)CC1)Cc1ccccc1 ZINC000182054688 261921067 /nfs/dbraw/zinc/92/10/67/261921067.db2.gz BTPZBFIMNGANKC-MRXNPFEDSA-N 1 3 288.479 3.718 20 0 CHADHO CCC1CCC([NH2+]CCCN2CCCC[C@H]2C)CC1 ZINC000020555356 262250840 /nfs/dbraw/zinc/25/08/40/262250840.db2.gz AQJBSSDVQNZFSN-KLAILNCOSA-N 1 3 266.473 3.809 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@@H](C)c1ccc2c(c1)CCC2 ZINC000221913692 262322846 /nfs/dbraw/zinc/32/28/46/262322846.db2.gz FLTMJAXRTFEVCJ-HNNXBMFYSA-N 1 3 274.452 3.556 20 0 CHADHO CC(C)[C@H](C)[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000390782848 262346001 /nfs/dbraw/zinc/34/60/01/262346001.db2.gz UGKACKAREGMKCS-PKOBYXMFSA-N 1 3 288.479 3.923 20 0 CHADHO CCCOc1ccc([C@@H](C)[NH2+]CCCN2CCCC2)cc1 ZINC000021013771 262373673 /nfs/dbraw/zinc/37/36/73/262373673.db2.gz KYJLYEAUZVKWSA-MRXNPFEDSA-N 1 3 290.451 3.612 20 0 CHADHO CNC[C@@H]1CC[N@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC000414662989 263024185 /nfs/dbraw/zinc/02/41/85/263024185.db2.gz AHDYKCFXCFBBTR-HFCFLWKCSA-N 1 3 286.463 3.502 20 0 CHADHO CNC[C@@H]1CC[N@@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC000414662989 263024186 /nfs/dbraw/zinc/02/41/86/263024186.db2.gz AHDYKCFXCFBBTR-HFCFLWKCSA-N 1 3 286.463 3.502 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H](N2CCC[C@@]3(CC[NH2+]C3)C2)C1 ZINC000414784215 263046596 /nfs/dbraw/zinc/04/65/96/263046596.db2.gz KQLBQYAVQSIJPF-UFYCRDLUSA-N 1 3 298.474 3.572 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@@H](N2CCC[C@@]3(CC[NH2+]C3)C2)C1 ZINC000414784207 263046673 /nfs/dbraw/zinc/04/66/73/263046673.db2.gz KQLBQYAVQSIJPF-AABGKKOBSA-N 1 3 298.474 3.572 20 0 CHADHO C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@@H]2CCC[C@@H]2CN)C1 ZINC000414794861 263049545 /nfs/dbraw/zinc/04/95/45/263049545.db2.gz FYTZWUWLTKZVOO-SXXASDTRSA-N 1 3 286.463 3.676 20 0 CHADHO C[C@H]([NH3+])c1ccc(CNCc2ccc(Cl)s2)cc1 ZINC000414801383 263051216 /nfs/dbraw/zinc/05/12/16/263051216.db2.gz ACVZYJNYSDQRNE-JTQLQIEISA-N 1 3 280.824 3.711 20 0 CHADHO CCc1cc(OC)ccc1CNCc1ccc([C@H](C)[NH3+])cc1 ZINC000414808219 263052410 /nfs/dbraw/zinc/05/24/10/263052410.db2.gz DVCNRJMNBQBWJN-AWEZNQCLSA-N 1 3 298.430 3.567 20 0 CHADHO C[C@@H](CC(C)(C)c1ccccc1)NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414820644 263054836 /nfs/dbraw/zinc/05/48/36/263054836.db2.gz AOVMXANOJHPKLJ-QTXGHNMQSA-N 1 3 286.463 3.615 20 0 CHADHO C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+]C[C@H]2CCCNC2)C1 ZINC000414827886 263055884 /nfs/dbraw/zinc/05/58/84/263055884.db2.gz KWIBBKUEVHMRDG-DKKFBQAASA-N 1 3 286.463 3.548 20 0 CHADHO CC(C)C[C@H](C[NH2+][C@H](C)[C@@H]1CCCNC1)c1ccccc1 ZINC000414828034 263056020 /nfs/dbraw/zinc/05/60/20/263056020.db2.gz YTWMZKMZBIQMQA-BHIYHBOVSA-N 1 3 288.479 3.794 20 0 CHADHO NC1(C[NH2+]Cc2ccc(-c3cccc(F)c3)s2)CCC1 ZINC000414891615 263102291 /nfs/dbraw/zinc/10/22/91/263102291.db2.gz VRMJESJIZRBPQH-UHFFFAOYSA-N 1 3 290.407 3.525 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@H]2[NH2+]C[C@]2(C)CCCNC2)cc1 ZINC000414903625 263111445 /nfs/dbraw/zinc/11/14/45/263111445.db2.gz ISBSVDNDTUICAS-IPMKNSEASA-N 1 3 286.463 3.610 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H](C)C[C@H](c3ccccc3)C2)CCN1 ZINC000414927866 263133422 /nfs/dbraw/zinc/13/34/22/263133422.db2.gz AGZBNKSNSDKNFP-BVRUVYRISA-N 1 3 286.463 3.689 20 0 CHADHO C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@@H]2CCNC[C@@H]2C)C1 ZINC000414944942 263154426 /nfs/dbraw/zinc/15/44/26/263154426.db2.gz QSUIPHKOPPICPC-NXJYUQPGSA-N 1 3 286.463 3.546 20 0 CHADHO C[C@H]1C[C@@H]([NH2+]CC2CCC(c3ccccc3)CC2)CCN1 ZINC000414947894 263155854 /nfs/dbraw/zinc/15/58/54/263155854.db2.gz LKBRHIMYGVBTMV-GSHBMFQSSA-N 1 3 286.463 3.691 20 0 CHADHO [NH3+]C[C@@H]1CC[C@H](NCc2ccc(-c3ccccc3)cc2F)C1 ZINC000415029150 263256104 /nfs/dbraw/zinc/25/61/04/263256104.db2.gz DJCNOHGSFJOPCJ-KDOFPFPSSA-N 1 3 298.405 3.710 20 0 CHADHO Cc1ccc(CN[C@@H](CCC[NH3+])c2ccccc2)s1 ZINC000415056694 263258698 /nfs/dbraw/zinc/25/86/98/263258698.db2.gz QIWLQJKPKXUNAP-INIZCTEOSA-N 1 3 274.433 3.626 20 0 CHADHO [NH3+]CCC[C@@H](NCc1cc(Cl)cs1)c1ccccc1 ZINC000415056702 263258806 /nfs/dbraw/zinc/25/88/06/263258806.db2.gz QJSVTAWFBZTGNK-OAHLLOKOSA-N 1 3 294.851 3.971 20 0 CHADHO Clc1ccccc1[C@@H]1CCC[C@H]1[NH2+]CCCNC1CC1 ZINC000415065973 263259405 /nfs/dbraw/zinc/25/94/05/263259405.db2.gz IFDIBLDBPXDDLG-DOTOQJQBSA-N 1 3 292.854 3.708 20 0 CHADHO CC(C)c1ccc([C@H](NC2CC[NH2+]CC2)C(C)C)cc1 ZINC000415074267 263265103 /nfs/dbraw/zinc/26/51/03/263265103.db2.gz CEMNCBLZLXTMRM-GOSISDBHSA-N 1 3 274.452 3.849 20 0 CHADHO CC(C)c1ccc([C@H]([NH2+]C2CCNCC2)C(C)C)cc1 ZINC000415074267 263265105 /nfs/dbraw/zinc/26/51/05/263265105.db2.gz CEMNCBLZLXTMRM-GOSISDBHSA-N 1 3 274.452 3.849 20 0 CHADHO CC(C)c1ccc2c(c1)[C@H](N[C@@H]1CC[N@H+](C)[C@@H](C)C1)CC2 ZINC000187801670 263269092 /nfs/dbraw/zinc/26/90/92/263269092.db2.gz CEULMMXWUAALBF-POZUXBRTSA-N 1 3 286.463 3.870 20 0 CHADHO CC(C)c1ccc2c(c1)[C@H](N[C@@H]1CC[N@@H+](C)[C@@H](C)C1)CC2 ZINC000187801670 263269093 /nfs/dbraw/zinc/26/90/93/263269093.db2.gz CEULMMXWUAALBF-POZUXBRTSA-N 1 3 286.463 3.870 20 0 CHADHO Cc1cccc([C@H](NC[C@@H]2CCC[NH2+]C2)C(C)(C)C)c1 ZINC000415086910 263271656 /nfs/dbraw/zinc/27/16/56/263271656.db2.gz VHRVVASSLIQBKB-WBVHZDCISA-N 1 3 274.452 3.671 20 0 CHADHO Cc1cccc([C@H]([NH2+]C[C@@H]2CCCNC2)C(C)(C)C)c1 ZINC000415086910 263271658 /nfs/dbraw/zinc/27/16/58/263271658.db2.gz VHRVVASSLIQBKB-WBVHZDCISA-N 1 3 274.452 3.671 20 0 CHADHO Cc1ccccc1CN[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415094473 263272551 /nfs/dbraw/zinc/27/25/51/263272551.db2.gz XQDRYMQOCZPIJB-MOPGFXCFSA-N 1 3 280.415 3.578 20 0 CHADHO CC[NH+](CC)Cc1ccccc1CN[C@H]1CC[C@H]1SC ZINC000425359360 264141106 /nfs/dbraw/zinc/14/11/06/264141106.db2.gz PSTROJXOLSFHQS-DLBZAZTESA-N 1 3 292.492 3.512 20 0 CHADHO CC(C)[N@H+](C)Cc1cccc(CNCc2cccs2)c1 ZINC000065976573 265007489 /nfs/dbraw/zinc/00/74/89/265007489.db2.gz NRQJCWZBTJPVLV-UHFFFAOYSA-N 1 3 288.460 3.878 20 0 CHADHO CC(C)[N@@H+](C)Cc1cccc(CNCc2cccs2)c1 ZINC000065976573 265007492 /nfs/dbraw/zinc/00/74/92/265007492.db2.gz NRQJCWZBTJPVLV-UHFFFAOYSA-N 1 3 288.460 3.878 20 0 CHADHO CC[C@H](NCC[C@@H]1CCCC[N@@H+]1C)c1ccc(C)cc1 ZINC000356818650 266179482 /nfs/dbraw/zinc/17/94/82/266179482.db2.gz WLKQQXMKSDSMRC-ROUUACIJSA-N 1 3 274.452 3.910 20 0 CHADHO CC[C@H](NCC[C@@H]1CCCC[N@H+]1C)c1ccc(C)cc1 ZINC000356818650 266179484 /nfs/dbraw/zinc/17/94/84/266179484.db2.gz WLKQQXMKSDSMRC-ROUUACIJSA-N 1 3 274.452 3.910 20 0 CHADHO CCC[C@H](CN[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000368401746 267170082 /nfs/dbraw/zinc/17/00/82/267170082.db2.gz GCSYTGGPFPHRNV-GUDVDZBRSA-N 1 3 286.463 3.787 20 0 CHADHO CCC[C@H](CN[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000368401746 267170084 /nfs/dbraw/zinc/17/00/84/267170084.db2.gz GCSYTGGPFPHRNV-GUDVDZBRSA-N 1 3 286.463 3.787 20 0 CHADHO CC[C@H](C)[C@H](C)[NH2+][C@@H](C)c1cccc(OCCN(C)C)c1 ZINC000540183121 327801493 /nfs/dbraw/zinc/80/14/93/327801493.db2.gz QJWNFAHDDVHZLG-JYJNAYRXSA-N 1 3 292.467 3.712 20 0 CHADHO CC(C)CCC[NH2+][C@@H](C)c1ccc(OCCN(C)C)cc1 ZINC000531687242 328022828 /nfs/dbraw/zinc/02/28/28/328022828.db2.gz BMZMEZIDICKYSL-INIZCTEOSA-N 1 3 292.467 3.714 20 0 CHADHO C[NH+](C)CC[C@H](N[C@@H]1CCc2ccccc21)C(C)(C)C ZINC000531714906 328028278 /nfs/dbraw/zinc/02/82/78/328028278.db2.gz RLXUEMGNKJXHKX-SJORKVTESA-N 1 3 274.452 3.630 20 0 CHADHO CN1CCC[C@@H]1CC[N@H+](C)Cc1ccc2ccccc2c1 ZINC000534022434 328033063 /nfs/dbraw/zinc/03/30/63/328033063.db2.gz MDMUMAQRPYABSV-LJQANCHMSA-N 1 3 282.431 3.756 20 0 CHADHO CN1CCC[C@@H]1CC[N@@H+](C)Cc1ccc2ccccc2c1 ZINC000534022434 328033064 /nfs/dbraw/zinc/03/30/64/328033064.db2.gz MDMUMAQRPYABSV-LJQANCHMSA-N 1 3 282.431 3.756 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1NCc1cc2ccccc2s1 ZINC000268796422 328186246 /nfs/dbraw/zinc/18/62/46/328186246.db2.gz IKZLYWXIZNZKEZ-IOASZLSFSA-N 1 3 288.460 3.720 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1NCc1cc2ccccc2s1 ZINC000268796422 328186248 /nfs/dbraw/zinc/18/62/48/328186248.db2.gz IKZLYWXIZNZKEZ-IOASZLSFSA-N 1 3 288.460 3.720 20 0 CHADHO C[C@H](c1cccc(C(F)(F)F)c1)N(CCC[NH3+])C1CC1 ZINC000414751207 328219344 /nfs/dbraw/zinc/21/93/44/328219344.db2.gz SHHUFLABQMISKJ-LLVKDONJSA-N 1 3 286.341 3.580 20 0 CHADHO C[C@@H](N)[C@H](C)[NH2+]Cc1ccc(-c2ccccc2Cl)s1 ZINC000415011896 328298588 /nfs/dbraw/zinc/29/85/88/328298588.db2.gz RJNICVIIJMXFKK-MNOVXSKESA-N 1 3 294.851 3.894 20 0 CHADHO C[C@@H]([NH2+]Cc1ccc(Sc2ccccc2)cc1)[C@H](C)N ZINC000415011852 328298866 /nfs/dbraw/zinc/29/88/66/328298866.db2.gz IPBHRSGQBKFVJN-UONOGXRCSA-N 1 3 286.444 3.663 20 0 CHADHO Cc1ccsc1CN[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415084334 328302747 /nfs/dbraw/zinc/30/27/47/328302747.db2.gz OTUSGAHRCXOPPJ-HOTGVXAUSA-N 1 3 286.444 3.639 20 0 CHADHO C[N@@H+]1CCC[C@H]1CCN1CCC[C@@](C)(c2ccccc2)C1 ZINC000534758347 328360497 /nfs/dbraw/zinc/36/04/97/328360497.db2.gz YURUMEHRKCVCIL-RBUKOAKNSA-N 1 3 286.463 3.524 20 0 CHADHO C[N@H+]1CCC[C@H]1CCN1CCC[C@@](C)(c2ccccc2)C1 ZINC000534758347 328360499 /nfs/dbraw/zinc/36/04/99/328360499.db2.gz YURUMEHRKCVCIL-RBUKOAKNSA-N 1 3 286.463 3.524 20 0 CHADHO C[C@@H](CC[NH+](C)C)N[C@@H](C)c1cccc2ccccc21 ZINC000049552000 328371503 /nfs/dbraw/zinc/37/15/03/328371503.db2.gz NPAAAPTVQYYQAA-GJZGRUSLSA-N 1 3 270.420 3.831 20 0 CHADHO c1sc2ccccc2c1C[NH2+]CCCN1CCCCC1 ZINC000049943332 328379402 /nfs/dbraw/zinc/37/94/02/328379402.db2.gz VCGOZROCEOATNJ-UHFFFAOYSA-N 1 3 288.460 3.867 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)CC(C)(C)c1ccccc1)CN(C)C ZINC000312520554 326884324 /nfs/dbraw/zinc/88/43/24/326884324.db2.gz OKXAEAWSVBNTRK-HOTGVXAUSA-N 1 3 276.468 3.530 20 0 CHADHO COc1ccccc1[C@H](CC(C)C)N[C@H]1CCC[C@H]([NH3+])C1 ZINC000565843272 327035628 /nfs/dbraw/zinc/03/56/28/327035628.db2.gz LWSLUZGUCUWSEO-ZOBUZTSGSA-N 1 3 290.451 3.642 20 0 CHADHO C[N@@H+]1CCC[C@@H](CNCc2ccc(C3CCCC3)cc2)C1 ZINC000584206187 327064105 /nfs/dbraw/zinc/06/41/05/327064105.db2.gz JPGPXGGOQUEBEC-KRWDZBQOSA-N 1 3 286.463 3.776 20 0 CHADHO C[N@H+]1CCC[C@@H](CNCc2ccc(C3CCCC3)cc2)C1 ZINC000584206187 327064106 /nfs/dbraw/zinc/06/41/06/327064106.db2.gz JPGPXGGOQUEBEC-KRWDZBQOSA-N 1 3 286.463 3.776 20 0 CHADHO Cc1ccc(CN2CCC(C[NH+]3CCCC3)CC2)cc1C ZINC000506876236 332781630 /nfs/dbraw/zinc/78/16/30/332781630.db2.gz QVEXTAKJGRZTGX-UHFFFAOYSA-N 1 3 286.463 3.611 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@@H]2Cc2ccccc2)C1 ZINC000564470818 327197017 /nfs/dbraw/zinc/19/70/17/327197017.db2.gz PWDGWJCFCVVAQU-AKHDSKFASA-N 1 3 286.463 3.647 20 0 CHADHO CN1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2cccc3ccccc32)C1 ZINC000559504526 327251455 /nfs/dbraw/zinc/25/14/55/327251455.db2.gz FOECVVVSBUZJJK-ICSRJNTNSA-N 1 3 294.442 3.756 20 0 CHADHO CN1CC[C@H]2[C@@H](CCC[N@H+]2Cc2cccc3ccccc32)C1 ZINC000559504526 327251456 /nfs/dbraw/zinc/25/14/56/327251456.db2.gz FOECVVVSBUZJJK-ICSRJNTNSA-N 1 3 294.442 3.756 20 0 CHADHO CCCN(CC[C@H]1CCCC[N@@H+]1C)Cc1ccccc1 ZINC000560742647 327340547 /nfs/dbraw/zinc/34/05/47/327340547.db2.gz AICSGGYPJKZREK-GOSISDBHSA-N 1 3 274.452 3.773 20 0 CHADHO CCCN(CC[C@H]1CCCC[N@H+]1C)Cc1ccccc1 ZINC000560742647 327340548 /nfs/dbraw/zinc/34/05/48/327340548.db2.gz AICSGGYPJKZREK-GOSISDBHSA-N 1 3 274.452 3.773 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+]CC2(c3cccs3)CCCCC2)C1 ZINC000566481222 327392000 /nfs/dbraw/zinc/39/20/00/327392000.db2.gz GBPCQKWWCXRDBI-CABCVRRESA-N 1 3 292.492 3.810 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](NCC2(c3cccs3)CCCCC2)C1 ZINC000566481222 327392001 /nfs/dbraw/zinc/39/20/01/327392001.db2.gz GBPCQKWWCXRDBI-CABCVRRESA-N 1 3 292.492 3.810 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@H](c3ccccc3)C2)C1 ZINC000562962775 327534935 /nfs/dbraw/zinc/53/49/35/327534935.db2.gz AHAGMBZMGGGVPE-MLHJIOFPSA-N 1 3 272.436 3.572 20 0 CHADHO CC[C@@H]1CCC[C@@H]1[NH2+]CCCN(C(C)C)C(C)C ZINC000532235217 328709589 /nfs/dbraw/zinc/70/95/89/328709589.db2.gz RMCUHAVAOIVVDK-CVEARBPZSA-N 1 3 254.462 3.664 20 0 CHADHO C[NH+](C)CCCC(C)(C)NCc1ccc(Cl)cc1F ZINC000395745252 328758869 /nfs/dbraw/zinc/75/88/69/328758869.db2.gz XJYZSWSSBCSQMU-UHFFFAOYSA-N 1 3 286.822 3.689 20 0 CHADHO Cc1cc(CN2CCC(CC[NH+](C)C)CC2)ccc1Cl ZINC000507813553 332825486 /nfs/dbraw/zinc/82/54/86/332825486.db2.gz JWBQKQVEWIWUNA-UHFFFAOYSA-N 1 3 294.870 3.812 20 0 CHADHO CN(CC(C)(C)c1ccccc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000377622659 329021379 /nfs/dbraw/zinc/02/13/79/329021379.db2.gz IJAZBIGQDMCAJN-JWTNVVGKSA-N 1 3 286.463 3.521 20 0 CHADHO CN(CC(C)(C)c1ccccc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000377622659 329021381 /nfs/dbraw/zinc/02/13/81/329021381.db2.gz IJAZBIGQDMCAJN-JWTNVVGKSA-N 1 3 286.463 3.521 20 0 CHADHO Cc1nc(C)c([C@H](C)[NH2+]CC2(CN(C)C)CCCC2)s1 ZINC000183953290 329255247 /nfs/dbraw/zinc/25/52/47/329255247.db2.gz OCUDSLOFHVOSBI-LBPRGKRZSA-N 1 3 295.496 3.533 20 0 CHADHO Clc1ccc(C2(NC[C@@H]3CCC[NH2+]C3)CCCC2)cc1 ZINC000469983319 329326159 /nfs/dbraw/zinc/32/61/59/329326159.db2.gz QOSVKVZQWHSIFA-CQSZACIVSA-N 1 3 292.854 3.699 20 0 CHADHO Clc1ccc(C2([NH2+]C[C@@H]3CCCNC3)CCCC2)cc1 ZINC000469983319 329326160 /nfs/dbraw/zinc/32/61/60/329326160.db2.gz QOSVKVZQWHSIFA-CQSZACIVSA-N 1 3 292.854 3.699 20 0 CHADHO Cc1c[nH+]ccc1NC[C@H](c1ccco1)N1CCCCC1 ZINC000191976949 329427159 /nfs/dbraw/zinc/42/71/59/329427159.db2.gz ZSBMZSJNAKEXPK-MRXNPFEDSA-N 1 3 285.391 3.622 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCc1ccc(F)c(-c2cccs2)c1 ZINC000564084356 329668595 /nfs/dbraw/zinc/66/85/95/329668595.db2.gz JXAZRTWVXKETIK-NEPJUHHUSA-N 1 3 292.423 3.770 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N[C@@H](C)c1ccncc1Cl ZINC000421805876 330081433 /nfs/dbraw/zinc/08/14/33/330081433.db2.gz YBDHBCLMFMUJQA-KGLIPLIRSA-N 1 3 297.874 3.896 20 0 CHADHO CCC[NH+]1CCC(CN[C@@H](C)c2ccncc2Cl)CC1 ZINC000421824392 330083044 /nfs/dbraw/zinc/08/30/44/330083044.db2.gz ILMNLAIDFQYDJX-ZDUSSCGKSA-N 1 3 295.858 3.508 20 0 CHADHO C[C@@H](NCCCCCOC1CCCCC1)[C@@H]1CCCC[NH2+]1 ZINC000422700582 330150848 /nfs/dbraw/zinc/15/08/48/330150848.db2.gz AHBVKHSPIZQRGH-AEFFLSMTSA-N 1 3 296.499 3.626 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@H](C)[C@H]2CCC[NH2+]C2)cc1 ZINC000422693202 330150917 /nfs/dbraw/zinc/15/09/17/330150917.db2.gz LGYDFIFTVUUBRL-DAYGRLMNSA-N 1 3 274.452 3.849 20 0 CHADHO C[C@H](CCC[NH3+])N[C@H](C)c1c(Cl)ccc(F)c1Cl ZINC000422706352 330151105 /nfs/dbraw/zinc/15/11/05/330151105.db2.gz DWXBXPYRGHMABY-RKDXNWHRSA-N 1 3 293.213 3.911 20 0 CHADHO CC(C)(CN[C@@H]1C[C@H]([NH3+])c2ccccc21)c1ccc(F)cc1 ZINC000422711235 330151448 /nfs/dbraw/zinc/15/14/48/330151448.db2.gz MKUZLRBVZLKLIS-ZWKOTPCHSA-N 1 3 298.405 3.838 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H]1CCC[C@@H](C(C)C)C1 ZINC000422712562 330151517 /nfs/dbraw/zinc/15/15/17/330151517.db2.gz IOCDNTOOJSOMOT-IMJJTQAJSA-N 1 3 289.467 3.714 20 0 CHADHO C[C@@H]1CCNCC[C@H]1[NH2+]CC(C)(C)c1ccc(Cl)cc1 ZINC000422730225 330152329 /nfs/dbraw/zinc/15/23/29/330152329.db2.gz JHLCUNHINPXINZ-CZUORRHYSA-N 1 3 294.870 3.595 20 0 CHADHO C[C@@H]1CCNCC[C@@H]1[NH2+]CC(C)(C)c1ccc(Cl)cc1 ZINC000422730224 330152473 /nfs/dbraw/zinc/15/24/73/330152473.db2.gz JHLCUNHINPXINZ-CJNGLKHVSA-N 1 3 294.870 3.595 20 0 CHADHO C[C@H](CN[C@H]1C[C@H]([NH3+])c2ccccc21)c1ccc(F)cc1 ZINC000422739822 330152805 /nfs/dbraw/zinc/15/28/05/330152805.db2.gz LXMGZKJQMNSKOO-UUWFMWQGSA-N 1 3 284.378 3.664 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]CC1(c2ccc(F)cc2)CCCCC1 ZINC000422760999 330153601 /nfs/dbraw/zinc/15/36/01/330153601.db2.gz MDKTYAWMWHPZRK-GJZGRUSLSA-N 1 3 292.442 3.743 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCC1(c2ccc(F)cc2)CCCCC1 ZINC000422760999 330153603 /nfs/dbraw/zinc/15/36/03/330153603.db2.gz MDKTYAWMWHPZRK-GJZGRUSLSA-N 1 3 292.442 3.743 20 0 CHADHO C[C@@H](N[C@@H](C)c1ccc2c(c1)CCCC2)[C@@H]1CCC[NH2+]C1 ZINC000422759016 330153667 /nfs/dbraw/zinc/15/36/67/330153667.db2.gz FHXVPLIVNKCQDC-QMTMVMCOSA-N 1 3 286.463 3.604 20 0 CHADHO [NH3+][C@H]1CCC[C@@H]1NCC1(c2cccc(Cl)c2)CCCC1 ZINC000422764426 330153919 /nfs/dbraw/zinc/15/39/19/330153919.db2.gz PMEHMPFTLIFATF-HOTGVXAUSA-N 1 3 292.854 3.621 20 0 CHADHO CC(C)C[C@@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1 ZINC000422770602 330154342 /nfs/dbraw/zinc/15/43/42/330154342.db2.gz UWCMAQOGSSPCNC-UJJTZGENSA-N 1 3 272.436 3.646 20 0 CHADHO Cc1cccc([C@H](C)CN[C@H]2C[C@H]([NH3+])c3ccccc32)c1 ZINC000422778820 330154540 /nfs/dbraw/zinc/15/45/40/330154540.db2.gz HUVHBDIIIAZSPY-CCKFTAQKSA-N 1 3 280.415 3.833 20 0 CHADHO Fc1ccc([C@@H](N[C@H]2CCC[NH2+]CC2)C2CCCC2)cc1 ZINC000422775392 330154596 /nfs/dbraw/zinc/15/45/96/330154596.db2.gz BMFPKOCKNXDYBM-ROUUACIJSA-N 1 3 290.426 3.789 20 0 CHADHO CCCC[C@@H](CC)C[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000422743681 330155272 /nfs/dbraw/zinc/15/52/72/330155272.db2.gz IYHKMYKRWKVWQI-UKRRQHHQSA-N 1 3 277.456 3.716 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC[C@H]1CCC[C@H](C)C1 ZINC000422744496 330155357 /nfs/dbraw/zinc/15/53/57/330155357.db2.gz KCKOCKHLYNVJBM-OFQRWUPVSA-N 1 3 289.467 3.716 20 0 CHADHO CC(C)C[C@@H]([NH2+]C1CCNCC1)c1ccc(Cl)cc1 ZINC000422791668 330155367 /nfs/dbraw/zinc/15/53/67/330155367.db2.gz WKKTXLDDNHMNEZ-MRXNPFEDSA-N 1 3 280.843 3.769 20 0 CHADHO COc1cccc(-c2ccc(CN[C@H](C)C[C@@H](C)[NH3+])cc2)c1 ZINC000422796647 330155555 /nfs/dbraw/zinc/15/55/55/330155555.db2.gz YVFJFRHVALDPIL-HUUCEWRRSA-N 1 3 298.430 3.578 20 0 CHADHO C1C[C@@H]2CC[C@@H]([NH2+][C@H]3CCC[C@H]3[C@H]3CCCCN3)C[C@@H]2C1 ZINC000422792628 330155612 /nfs/dbraw/zinc/15/56/12/330155612.db2.gz RCOIGXUTGQJEQE-QWFUGVESSA-N 1 3 290.495 3.856 20 0 CHADHO c1ccc(C2(CN[C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)CCC2)cc1 ZINC000422802458 330155990 /nfs/dbraw/zinc/15/59/90/330155990.db2.gz BNLBVJGYWCZBIS-CEXWTWQISA-N 1 3 298.474 3.619 20 0 CHADHO Cc1cccc(CN[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC000422810151 330156188 /nfs/dbraw/zinc/15/61/88/330156188.db2.gz SVUIWHPJCHEZHY-RBUKOAKNSA-N 1 3 280.415 3.578 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2CN[C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000422809878 330156209 /nfs/dbraw/zinc/15/62/09/330156209.db2.gz SOIUKBFDVNMFAB-GSEOLPGOSA-N 1 3 298.474 3.617 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]CCCc1ccc(Cl)cc1Cl ZINC000422817882 330156270 /nfs/dbraw/zinc/15/62/70/330156270.db2.gz FDFCHVYCAALBPF-QWRGUYRKSA-N 1 3 289.250 3.641 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCCCc1ccc(Cl)cc1Cl ZINC000422817882 330156271 /nfs/dbraw/zinc/15/62/71/330156271.db2.gz FDFCHVYCAALBPF-QWRGUYRKSA-N 1 3 289.250 3.641 20 0 CHADHO CC[C@H](N[C@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(Cl)cc1 ZINC000422825558 330156706 /nfs/dbraw/zinc/15/67/06/330156706.db2.gz PZKKKLUQFVNUFP-XPKDYRNWSA-N 1 3 280.843 3.769 20 0 CHADHO C[C@H](N[C@@H](c1cccc(F)c1)C(C)(C)C)[C@@H]1CC[NH2+]C1 ZINC000422837557 330157295 /nfs/dbraw/zinc/15/72/95/330157295.db2.gz MBQFXXYZUNEZJS-BJJXKVORSA-N 1 3 278.415 3.501 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](c1ccccc1F)C1CCCC1 ZINC000422869868 330158185 /nfs/dbraw/zinc/15/81/85/330158185.db2.gz AWBLMSUZBIGYNP-GDZNZVCISA-N 1 3 278.415 3.772 20 0 CHADHO C[C@H](N[C@@H](c1cccc(F)c1)C1CCCC1)[C@H]1CC[NH2+]C1 ZINC000422873906 330158510 /nfs/dbraw/zinc/15/85/10/330158510.db2.gz MKKQUZZWCMIADP-QANKJYHBSA-N 1 3 290.426 3.645 20 0 CHADHO NC[C@H]1CCC[C@H]1[NH2+]CCc1cccc(-c2ccccc2)c1 ZINC000422887942 330159291 /nfs/dbraw/zinc/15/92/91/330159291.db2.gz LSRAMLLUBDQCPU-WOJBJXKFSA-N 1 3 294.442 3.613 20 0 CHADHO CC(C)(C)C[C@@H]([NH2+]C1CCNCC1)c1ccc(F)cc1 ZINC000422896875 330159479 /nfs/dbraw/zinc/15/94/79/330159479.db2.gz IVSCMVXJPWGBEH-MRXNPFEDSA-N 1 3 278.415 3.645 20 0 CHADHO Cc1cccc(C2(CNC3C[C@H]4CC[C@@H](C3)[NH2+]4)CCCC2)c1 ZINC000422913644 330160347 /nfs/dbraw/zinc/16/03/47/330160347.db2.gz YXGSYHJYRBNCHM-DFNIBXOVSA-N 1 3 298.474 3.679 20 0 CHADHO N[C@H]1C[C@H]([NH2+]CCc2cc3ccccc3o2)c2ccccc21 ZINC000422923902 330160712 /nfs/dbraw/zinc/16/07/12/330160712.db2.gz SYFMXFMTCSQGRU-ROUUACIJSA-N 1 3 292.382 3.710 20 0 CHADHO C[C@@H]1C[C@@H]1[C@H]([NH2+][C@H]1CCC[C@@H]1N)c1ccc(Cl)cc1 ZINC000422926814 330160992 /nfs/dbraw/zinc/16/09/92/330160992.db2.gz XOCZDNWHGHARLZ-RLPSOPLKSA-N 1 3 278.827 3.507 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@H]1NCCc1csc2ccccc12 ZINC000422931943 330161140 /nfs/dbraw/zinc/16/11/40/330161140.db2.gz DFEXPWTUFFBRGH-HZPDHXFCSA-N 1 3 288.460 3.693 20 0 CHADHO CCCc1ccc([C@@H](NC2CC[NH2+]CC2)C(C)C)cc1 ZINC000422938502 330161651 /nfs/dbraw/zinc/16/16/51/330161651.db2.gz PTHCIDIHYSSDIT-SFHVURJKSA-N 1 3 274.452 3.678 20 0 CHADHO CCCc1ccc([C@@H]([NH2+]C2CCNCC2)C(C)C)cc1 ZINC000422938502 330161653 /nfs/dbraw/zinc/16/16/53/330161653.db2.gz PTHCIDIHYSSDIT-SFHVURJKSA-N 1 3 274.452 3.678 20 0 CHADHO C[C@@H](N)C[C@@H](C)[NH2+]CC(C)(C)CCCc1ccccc1 ZINC000422983922 330162792 /nfs/dbraw/zinc/16/27/92/330162792.db2.gz VWRQBLRKOLHBLK-HZPDHXFCSA-N 1 3 276.468 3.751 20 0 CHADHO C[C@H](CCC[NH3+])N[C@H](C)c1nc(-c2ccccc2)cs1 ZINC000422961778 330164240 /nfs/dbraw/zinc/16/42/40/330164240.db2.gz ZYCOLRGGUIETAO-CHWSQXEVSA-N 1 3 289.448 3.588 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CC1CCC(C)(C)CC1 ZINC000423018581 330165303 /nfs/dbraw/zinc/16/53/03/330165303.db2.gz ZIKNQMINEYUUBE-CYBMUJFWSA-N 1 3 289.467 3.716 20 0 CHADHO C[C@H](CCC[NH3+])N[C@@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000423029396 330166280 /nfs/dbraw/zinc/16/62/80/330166280.db2.gz UZWWNFAJAKDGME-MFKMUULPSA-N 1 3 292.320 3.536 20 0 CHADHO C[C@@H](CCC[NH3+])N[C@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000423029395 330166372 /nfs/dbraw/zinc/16/63/72/330166372.db2.gz UZWWNFAJAKDGME-GXFFZTMASA-N 1 3 292.320 3.536 20 0 CHADHO CCC1(C[NH2+][C@H](C)c2ccc(CN)nc2C)CCCCC1 ZINC000423038651 330166657 /nfs/dbraw/zinc/16/66/57/330166657.db2.gz OVYRAXLABXAWIY-CQSZACIVSA-N 1 3 289.467 3.860 20 0 CHADHO Cc1oc2ccccc2c1CCN[C@H]1CCCCC[C@@H]1[NH3+] ZINC000423052943 330167436 /nfs/dbraw/zinc/16/74/36/330167436.db2.gz RMGRLLFKPBLXQR-IRXDYDNUSA-N 1 3 286.419 3.533 20 0 CHADHO Cc1cc(C[NH2+][C@H]2CCC[C@H]2N)ccc1-c1ccccc1 ZINC000423066773 330168210 /nfs/dbraw/zinc/16/82/10/330168210.db2.gz XVMPBMUZSULZSI-MOPGFXCFSA-N 1 3 280.415 3.631 20 0 CHADHO C[C@H](CCCC(F)(F)F)N[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423078787 330168559 /nfs/dbraw/zinc/16/85/59/330168559.db2.gz WTHHACLOXOAUAF-SWHYSGLUSA-N 1 3 286.341 3.842 20 0 CHADHO c1ccc([C@H]2CCC[C@@H](NC3C[C@H]4CC[C@@H](C3)[NH2+]4)C2)cc1 ZINC000423078100 330168627 /nfs/dbraw/zinc/16/86/27/330168627.db2.gz NTRVGNUXINWLHM-QWJAOUKZSA-N 1 3 284.447 3.585 20 0 CHADHO Cc1ccccc1[C@@H](CC(F)(F)F)N[C@@H](C)CCC[NH3+] ZINC000423089072 330169092 /nfs/dbraw/zinc/16/90/92/330169092.db2.gz ROBIPKRABCADKC-GXTWGEPZSA-N 1 3 288.357 3.706 20 0 CHADHO [NH3+][C@H]1CCCCC[C@@H]1N[C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423099761 330170379 /nfs/dbraw/zinc/17/03/79/330170379.db2.gz UGOJGIJWPHJIHL-HJWJTTGWSA-N 1 3 292.854 3.836 20 0 CHADHO CC(C)[C@H](CN[C@H]1CCC[C@@H]1[NH3+])c1ccc(Cl)cc1 ZINC000423103286 330170411 /nfs/dbraw/zinc/17/04/11/330170411.db2.gz GGOKARODKYYONQ-JYJNAYRXSA-N 1 3 280.843 3.549 20 0 CHADHO CC[C@H]1CC[C@H](N[C@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC000423121640 330171067 /nfs/dbraw/zinc/17/10/67/330171067.db2.gz AXQCVHODRQQNKQ-PYTWLRIVSA-N 1 3 258.409 3.690 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@H]1N[C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423146040 330172531 /nfs/dbraw/zinc/17/25/31/330172531.db2.gz NPZDMSXMGZDSBR-BQGCOEIASA-N 1 3 292.854 3.836 20 0 CHADHO [NH3+][C@@H]1C[C@H](NCC[C@H]2CCc3ccccc32)c2ccccc21 ZINC000423146259 330172572 /nfs/dbraw/zinc/17/25/72/330172572.db2.gz OWPWDSBTCTUNKV-YSGRDPCXSA-N 1 3 292.426 3.841 20 0 CHADHO c1ccc2c(c1)CC[C@@H]2CCN[C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000423149819 330172898 /nfs/dbraw/zinc/17/28/98/330172898.db2.gz XXGOBARHSGCOEV-MDNKFWRPSA-N 1 3 298.474 3.617 20 0 CHADHO CCC[C@H]([NH2+][C@@H](C)c1ccc(CN)nc1C)C(C)(C)C ZINC000423154453 330173245 /nfs/dbraw/zinc/17/32/45/330173245.db2.gz HSYIFTUKHYHFGT-BBRMVZONSA-N 1 3 277.456 3.714 20 0 CHADHO C[C@@H]1CCNCC[C@@H]1[NH2+]C[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000423159375 330173643 /nfs/dbraw/zinc/17/36/43/330173643.db2.gz OYIDKJAXJVIXFE-LULLPPNCSA-N 1 3 286.463 3.548 20 0 CHADHO C[C@H](N[C@@H]1CC[C@H](c2cccc(Cl)c2)C1)[C@@H]1CC[NH2+]C1 ZINC000423160713 330173705 /nfs/dbraw/zinc/17/37/05/330173705.db2.gz HQUYIPCZCHTOHJ-MKVSYHDVSA-N 1 3 292.854 3.564 20 0 CHADHO CC[C@@H](CSc1ccc(Cl)cc1)NC1CC[NH2+]CC1 ZINC000423179532 330175090 /nfs/dbraw/zinc/17/50/90/330175090.db2.gz HIPFVAUWGSMSHF-ZDUSSCGKSA-N 1 3 298.883 3.552 20 0 CHADHO CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]C1CCNCC1 ZINC000423179532 330175092 /nfs/dbraw/zinc/17/50/92/330175092.db2.gz HIPFVAUWGSMSHF-ZDUSSCGKSA-N 1 3 298.883 3.552 20 0 CHADHO NCCC[NH2+][C@@H]1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000423195486 330176205 /nfs/dbraw/zinc/17/62/05/330176205.db2.gz SQQJHGKPVNJSOD-HZPDHXFCSA-N 1 3 280.843 3.695 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H]1CCC[C@@H]1C(C)(C)C ZINC000423194619 330176207 /nfs/dbraw/zinc/17/62/07/330176207.db2.gz WYLYRVOYKCLFFM-JQFCIGGWSA-N 1 3 289.467 3.714 20 0 CHADHO CC(C)CC[C@@H]1CC[C@H]([NH2+][C@@H](C)[C@H]2CCCNC2)C1 ZINC000423205175 330176978 /nfs/dbraw/zinc/17/69/78/330176978.db2.gz AZILXZQZPOHECX-YVSFHVDLSA-N 1 3 266.473 3.569 20 0 CHADHO CCC[C@H](N[C@@H](C)[C@H]1CCC[NH2+]C1)c1ccc(OC)cc1 ZINC000423221951 330179834 /nfs/dbraw/zinc/17/98/34/330179834.db2.gz YUVPNGZTJOOLRJ-ZVZYQTTQSA-N 1 3 290.451 3.514 20 0 CHADHO CCC[C@H]([NH2+][C@@H](C)[C@H]1CCCNC1)c1ccc(OC)cc1 ZINC000423221951 330179835 /nfs/dbraw/zinc/17/98/35/330179835.db2.gz YUVPNGZTJOOLRJ-ZVZYQTTQSA-N 1 3 290.451 3.514 20 0 CHADHO CC(C)[C@H](NCC[C@H](C)[NH3+])c1cccc(C(F)(F)F)c1 ZINC000423223942 330179998 /nfs/dbraw/zinc/17/99/98/330179998.db2.gz IATYHYROUYUALO-FZMZJTMJSA-N 1 3 288.357 3.729 20 0 CHADHO Fc1ccc([C@@H](NCC[C@H]2CC[NH2+]C2)c2ccccc2)cc1 ZINC000423243015 330181890 /nfs/dbraw/zinc/18/18/90/330181890.db2.gz GBDLMWUVMAFVJI-BEFAXECRSA-N 1 3 298.405 3.504 20 0 CHADHO CC[C@@H](N[C@H](C[NH3+])C1CCCCC1)c1cccs1 ZINC000423267856 330184486 /nfs/dbraw/zinc/18/44/86/330184486.db2.gz UBXHKLQQBWASQG-ZIAGYGMSSA-N 1 3 266.454 3.696 20 0 CHADHO Cc1nc(C(C)C)sc1[C@H](C)N[C@@H]1CCCC[C@H]1C[NH3+] ZINC000423270937 330184497 /nfs/dbraw/zinc/18/44/97/330184497.db2.gz HAEHNDHCZCNDAV-FPMFFAJLSA-N 1 3 295.496 3.743 20 0 CHADHO C[C@H](N[C@H]1CCCC[C@H]1C[NH3+])c1csc(Cl)c1 ZINC000423278978 330185469 /nfs/dbraw/zinc/18/54/69/330185469.db2.gz QPRYHENTJQROJB-NHCYSSNCSA-N 1 3 272.845 3.570 20 0 CHADHO C[C@@H]([NH2+]CC(C)(C)N)c1ccc(-c2cccs2)cc1 ZINC000423283871 330185795 /nfs/dbraw/zinc/18/57/95/330185795.db2.gz FSQMBEZTOYXPJM-GFCCVEGCSA-N 1 3 274.433 3.803 20 0 CHADHO CC(C)(N)C[NH2+][C@@H](c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000423288154 330186297 /nfs/dbraw/zinc/18/62/97/330186297.db2.gz QTIPDXMVOYYIEW-CYBMUJFWSA-N 1 3 287.234 3.771 20 0 CHADHO CCC[C@H]([NH2+]CC(N)(CC)CC)c1ccsc1 ZINC000423288728 330186453 /nfs/dbraw/zinc/18/64/53/330186453.db2.gz URFQMFSYCAMQLI-ZDUSSCGKSA-N 1 3 254.443 3.696 20 0 CHADHO CCOc1ccc([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000423289844 330186641 /nfs/dbraw/zinc/18/66/41/330186641.db2.gz BRBUWGSHTFDUBZ-HUUCEWRRSA-N 1 3 298.430 3.956 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H]2CCCc3sccc32)cc1 ZINC000423290261 330186814 /nfs/dbraw/zinc/18/68/14/330186814.db2.gz CODVEGOKIYATDP-MLGOLLRUSA-N 1 3 286.444 3.935 20 0 CHADHO Cc1ccsc1[C@H](C)NCc1ccc([C@H](C)[NH3+])cc1 ZINC000423290563 330186912 /nfs/dbraw/zinc/18/69/12/330186912.db2.gz DNOUNEJKAJTHIC-STQMWFEESA-N 1 3 274.433 3.927 20 0 CHADHO CC[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccc(OC)cc1 ZINC000423290557 330186930 /nfs/dbraw/zinc/18/69/30/330186930.db2.gz DMLXFYODQLGGFN-KUHUBIRLSA-N 1 3 298.430 3.956 20 0 CHADHO Cc1ccsc1[C@@H](C)NCc1ccc([C@@H](C)[NH3+])cc1 ZINC000423290560 330186937 /nfs/dbraw/zinc/18/69/37/330186937.db2.gz DNOUNEJKAJTHIC-CHWSQXEVSA-N 1 3 274.433 3.927 20 0 CHADHO CCC(N)(CC)C[NH2+][C@@H]1CC[C@H](C)c2ccsc21 ZINC000423291765 330187329 /nfs/dbraw/zinc/18/73/29/330187329.db2.gz JTDBVEAPBXBGIS-WCQYABFASA-N 1 3 266.454 3.794 20 0 CHADHO CC[C@@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccccc1 ZINC000423291694 330187479 /nfs/dbraw/zinc/18/74/79/330187479.db2.gz JLFXYRIAWFGLIW-RDTXWAMCSA-N 1 3 268.404 3.947 20 0 CHADHO COc1ccc([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000423296255 330188188 /nfs/dbraw/zinc/18/81/88/330188188.db2.gz YSQRWCRMEZAHCX-ZIAGYGMSSA-N 1 3 284.403 3.566 20 0 CHADHO CCC[C@@H](NC[C@H](C)C[NH3+])c1cccc(C(F)(F)F)c1 ZINC000423296096 330188403 /nfs/dbraw/zinc/18/84/03/330188403.db2.gz GCZZXACNSLVYMZ-BXUZGUMPSA-N 1 3 288.357 3.731 20 0 CHADHO C[C@@H](NC[C@@H](C)C[NH3+])c1cccc(OCc2ccccc2)c1 ZINC000423304626 330189277 /nfs/dbraw/zinc/18/92/77/330189277.db2.gz ZGSBGIQXMZWCFK-JKSUJKDBSA-N 1 3 298.430 3.511 20 0 CHADHO C[C@H]([NH2+]C[C@@H](N)C1CC1)c1ccc(-c2cccs2)cc1 ZINC000423323177 330190555 /nfs/dbraw/zinc/19/05/55/330190555.db2.gz ONKXWJVQQZDCRY-BLLLJJGKSA-N 1 3 286.444 3.803 20 0 CHADHO N[C@@H](C[NH2+][C@@H](c1ccc(Cl)cc1)C1CCC1)C1CC1 ZINC000423333191 330191417 /nfs/dbraw/zinc/19/14/17/330191417.db2.gz VNLLJGSAIWVCAM-JKSUJKDBSA-N 1 3 278.827 3.508 20 0 CHADHO NC1(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CCC1 ZINC000423335923 330191829 /nfs/dbraw/zinc/19/18/29/330191829.db2.gz UJVPWGNRVADOPC-CQSZACIVSA-N 1 3 298.352 3.628 20 0 CHADHO CC(C)Sc1ccc([C@@H](C)NCC2=CC[NH2+]CC2)cc1 ZINC000423342985 330192340 /nfs/dbraw/zinc/19/23/40/330192340.db2.gz LHBDAFIQQGJEHC-CQSZACIVSA-N 1 3 290.476 3.757 20 0 CHADHO Cc1cc([C@H](C)NCc2ccc3c(c2)C[NH2+]C3)c(C)s1 ZINC000423357122 330193386 /nfs/dbraw/zinc/19/33/86/330193386.db2.gz LMJICWBSYSUYLY-LBPRGKRZSA-N 1 3 286.444 3.819 20 0 CHADHO C[C@H]([NH2+][C@H]1CCNC[C@@H]1C)c1ccccc1C(C)(C)C ZINC000423363903 330194277 /nfs/dbraw/zinc/19/42/77/330194277.db2.gz CCSKBFBZPCRKGE-ZQIUZPCESA-N 1 3 274.452 3.633 20 0 CHADHO CC[C@@H](C)C[C@@H](CC)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423364378 330194281 /nfs/dbraw/zinc/19/42/81/330194281.db2.gz VUJMABWJNJGGDT-CXAGYDPISA-N 1 3 260.425 3.594 20 0 CHADHO C[C@@H]1CC[C@H](N[C@@H]2CCC[C@@H]([NH3+])C2)c2sccc21 ZINC000423365868 330194626 /nfs/dbraw/zinc/19/46/26/330194626.db2.gz KUYLTOAWDVBEJG-BYNQJWBRSA-N 1 3 264.438 3.546 20 0 CHADHO CC(C)[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)c1ccc(F)c(F)c1 ZINC000423370969 330194912 /nfs/dbraw/zinc/19/49/12/330194912.db2.gz GEVCXDGLTVQRHS-WWGRRREGSA-N 1 3 282.378 3.521 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@@H]1N[C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423399497 330196010 /nfs/dbraw/zinc/19/60/10/330196010.db2.gz POECMFKQHGWHTE-OAUYIBNBSA-N 1 3 292.854 3.769 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423399497 330196011 /nfs/dbraw/zinc/19/60/11/330196011.db2.gz POECMFKQHGWHTE-OAUYIBNBSA-N 1 3 292.854 3.769 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@H](c2ccc(F)cc2)C2CCCC2)CCN1 ZINC000423401767 330196394 /nfs/dbraw/zinc/19/63/94/330196394.db2.gz XIPOHZGCHYUAKK-BVGQSLNGSA-N 1 3 290.426 3.787 20 0 CHADHO CC[C@H]([NH2+]Cc1ccc2c(c1)CNC2)C1CCCCC1 ZINC000423406607 330196913 /nfs/dbraw/zinc/19/69/13/330196913.db2.gz ZBSLWWLSVHVXOO-SFHVURJKSA-N 1 3 272.436 3.738 20 0 CHADHO CCC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423406932 330196977 /nfs/dbraw/zinc/19/69/77/330196977.db2.gz ZLIXTOIITBWXKR-FQEVSTJZSA-N 1 3 294.442 3.791 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](N[C@@H]2CCSc3c(Cl)cccc32)C1 ZINC000423406826 330196988 /nfs/dbraw/zinc/19/69/88/330196988.db2.gz ZERSRTKJZLTXMN-UHIISALHSA-N 1 3 296.867 3.736 20 0 CHADHO c1csc([C@H](NCC[C@H]2CCC[NH2+]2)C2CCCC2)c1 ZINC000423375102 330198651 /nfs/dbraw/zinc/19/86/51/330198651.db2.gz XKSLIBURAKVMQQ-GDBMZVCRSA-N 1 3 278.465 3.711 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CCN[C@H](C)C1)C1(c2ccccc2)CCCC1 ZINC000423383427 330199391 /nfs/dbraw/zinc/19/93/91/330199391.db2.gz PDRJRUWTOBXJEC-JFIYKMOQSA-N 1 3 286.463 3.617 20 0 CHADHO CC(C)Cc1cccc([C@H](C)[NH2+][C@@H]2CCNC[C@@H]2C)c1 ZINC000423387138 330200079 /nfs/dbraw/zinc/20/00/79/330200079.db2.gz HPWDTKBOMUHBMJ-RLFYNMQTSA-N 1 3 274.452 3.534 20 0 CHADHO COc1ccc([C@H](C)N[C@@H]2CCC[C@H]([NH3+])C2)c2ccccc12 ZINC000423394400 330200533 /nfs/dbraw/zinc/20/05/33/330200533.db2.gz RKGLEHXYAPKXIE-SOUVJXGZSA-N 1 3 298.430 3.769 20 0 CHADHO C[C@@H](N)[C@H](C)[NH2+][C@@H](C)c1ccc(-c2ccccc2)s1 ZINC000423446996 330202487 /nfs/dbraw/zinc/20/24/87/330202487.db2.gz OLWHTZMXFFACDP-AGIUHOORSA-N 1 3 274.433 3.801 20 0 CHADHO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H](C)[C@H](C)N ZINC000423452440 330203118 /nfs/dbraw/zinc/20/31/18/330203118.db2.gz WIFDXRAGGYLPSH-SRVKXCTJSA-N 1 3 289.448 3.505 20 0 CHADHO CC[C@@H](N)C[NH2+][C@H](C)c1ccc(-c2ccccc2)s1 ZINC000423456989 330203516 /nfs/dbraw/zinc/20/35/16/330203516.db2.gz FCHYRJGZBTVZBH-TZMCWYRMSA-N 1 3 274.433 3.803 20 0 CHADHO CC[C@@H](N)C[NH2+][C@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423465616 330204404 /nfs/dbraw/zinc/20/44/04/330204404.db2.gz MURSPONCDUXHSO-HUUCEWRRSA-N 1 3 266.816 3.508 20 0 CHADHO CC[C@H](N)C[NH2+][C@H](c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000423471006 330205110 /nfs/dbraw/zinc/20/51/10/330205110.db2.gz PMULTLFKRHVVBG-FZMZJTMJSA-N 1 3 287.234 3.771 20 0 CHADHO CC[C@H](C)[C@H](C)[NH2+]C[C@@H]1CNCC[C@@H]1c1ccc(F)cc1 ZINC000423476797 330205559 /nfs/dbraw/zinc/20/55/59/330205559.db2.gz RNJVPBKKWDWSLW-ILXVDBEPSA-N 1 3 292.442 3.543 20 0 CHADHO CC[C@@H](NCCC[C@@H]1CCC[NH2+]1)c1ccc(F)cc1F ZINC000423476196 330205641 /nfs/dbraw/zinc/20/56/41/330205641.db2.gz IOUKIFJHROYYSE-XJKSGUPXSA-N 1 3 282.378 3.538 20 0 CHADHO C[C@H](N[C@@H]1CC[C@H](C[NH3+])C1)c1cccc(Cl)c1Cl ZINC000423494674 330207565 /nfs/dbraw/zinc/20/75/65/330207565.db2.gz SOLVOAWQULDEMN-GARJFASQSA-N 1 3 287.234 3.771 20 0 CHADHO Cc1ccc([C@H](C)N[C@@H](CCC[NH3+])c2ccccc2)o1 ZINC000423511532 330209338 /nfs/dbraw/zinc/20/93/38/330209338.db2.gz UAOIQOJDHCZJCT-HOCLYGCPSA-N 1 3 272.392 3.719 20 0 CHADHO COc1ccc([C@@H](C)NCCC[NH2+]C2CC2)c2ccccc12 ZINC000423517832 330209638 /nfs/dbraw/zinc/20/96/38/330209638.db2.gz CAGVPYCUQIRTOE-CQSZACIVSA-N 1 3 298.430 3.641 20 0 CHADHO COc1ccc([C@@H](C)[NH2+]CCCNC2CC2)c2ccccc12 ZINC000423517832 330209639 /nfs/dbraw/zinc/20/96/39/330209639.db2.gz CAGVPYCUQIRTOE-CQSZACIVSA-N 1 3 298.430 3.641 20 0 CHADHO Clc1cccc([C@@H]2CC[C@@H]([NH2+]CCCNC3CC3)C2)c1 ZINC000423543036 330211179 /nfs/dbraw/zinc/21/11/79/330211179.db2.gz BNZFRAFJUHPBNK-RHSMWYFYSA-N 1 3 292.854 3.708 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]CCCNC1CC1 ZINC000423554172 330211890 /nfs/dbraw/zinc/21/18/90/330211890.db2.gz LFZHMHHQBGGEKW-SFHVURJKSA-N 1 3 297.446 3.585 20 0 CHADHO Cc1c(C)c(C)c(CN[C@@H]2CC[N@H+](C)[C@@H](C)C2)c(C)c1C ZINC000536841602 330236072 /nfs/dbraw/zinc/23/60/72/330236072.db2.gz VZPLHOWOZBJPNB-KPZWWZAWSA-N 1 3 288.479 3.801 20 0 CHADHO Cc1c(C)c(C)c(CN[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c(C)c1C ZINC000536841602 330236074 /nfs/dbraw/zinc/23/60/74/330236074.db2.gz VZPLHOWOZBJPNB-KPZWWZAWSA-N 1 3 288.479 3.801 20 0 CHADHO Cc1cc(CNCc2ccccc2C[N@@H+](C)C(C)C)ccn1 ZINC000527641569 330268573 /nfs/dbraw/zinc/26/85/73/330268573.db2.gz VXLFXHQXQUGITQ-UHFFFAOYSA-N 1 3 297.446 3.520 20 0 CHADHO Cc1cc(CNCc2ccccc2C[N@H+](C)C(C)C)ccn1 ZINC000527641569 330268574 /nfs/dbraw/zinc/26/85/74/330268574.db2.gz VXLFXHQXQUGITQ-UHFFFAOYSA-N 1 3 297.446 3.520 20 0 CHADHO CN1CC=C(C[NH2+][C@@H]2CCC[C@@H](c3ccccc3)CC2)CC1 ZINC000527682514 330271081 /nfs/dbraw/zinc/27/10/81/330271081.db2.gz HJZAHRHFUSROGQ-WOJBJXKFSA-N 1 3 298.474 3.954 20 0 CHADHO CC[C@H](NC[C@H]1CCC[N@H+](C)C1)c1cccc(Cl)c1 ZINC000044534440 330329788 /nfs/dbraw/zinc/32/97/88/330329788.db2.gz IJKIHVIUJMJNFI-CJNGLKHVSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@H](NC[C@H]1CCC[N@@H+](C)C1)c1cccc(Cl)c1 ZINC000044534440 330329789 /nfs/dbraw/zinc/32/97/89/330329789.db2.gz IJKIHVIUJMJNFI-CJNGLKHVSA-N 1 3 280.843 3.723 20 0 CHADHO CC(C)c1ccc([C@@H](C)NC[C@H]2CCC[N@H+](C)C2)cc1 ZINC000044535655 330330068 /nfs/dbraw/zinc/33/00/68/330330068.db2.gz JAXUZRCCVSXJBF-HZPDHXFCSA-N 1 3 274.452 3.802 20 0 CHADHO CC(C)c1ccc([C@@H](C)NC[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000044535655 330330069 /nfs/dbraw/zinc/33/00/69/330330069.db2.gz JAXUZRCCVSXJBF-HZPDHXFCSA-N 1 3 274.452 3.802 20 0 CHADHO C1C[C@@H]2C[C@H]([NH2+][C@@H]3CC[C@@H]4CCCC[C@@H]4C3)CCN2C1 ZINC000106868960 330341479 /nfs/dbraw/zinc/34/14/79/330341479.db2.gz IMEUTJXEPMANOL-YYWYGQEZSA-N 1 3 276.468 3.562 20 0 CHADHO CC[C@@H]([NH2+][C@@H]1CCCC[C@H]1N)c1ccc(OC(F)F)cc1 ZINC000424373205 330348347 /nfs/dbraw/zinc/34/83/47/330348347.db2.gz JCWUVMNDZKBIOI-RBSFLKMASA-N 1 3 298.377 3.599 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCCC[C@H]1N)c1ccc(Cl)s1 ZINC000424370691 330348370 /nfs/dbraw/zinc/34/83/70/330348370.db2.gz DXTXVJVXGKYDGE-OUAUKWLOSA-N 1 3 272.845 3.712 20 0 CHADHO C[C@H](N[C@@H]1CCCC[C@@H]1C[NH3+])c1ccc(Cl)cc1 ZINC000089139920 330380742 /nfs/dbraw/zinc/38/07/42/330380742.db2.gz ZEIQSOPQFAQGOC-NJZAAPMLSA-N 1 3 266.816 3.508 20 0 CHADHO C[C@H]1CC(C)(C)C[C@H]1[NH2+]Cc1cccc(CN(C)C)c1 ZINC000434778799 330645055 /nfs/dbraw/zinc/64/50/55/330645055.db2.gz XXIDGQPTEVACBI-WMLDXEAASA-N 1 3 274.452 3.663 20 0 CHADHO CN(C)[C@H]1CCC[N@H+](CC/C=C/c2ccccc2)CC1 ZINC000450853327 331002993 /nfs/dbraw/zinc/00/29/93/331002993.db2.gz HKXRDUDUPGMSON-QKIXSCASSA-N 1 3 272.436 3.506 20 0 CHADHO CN(C)[C@H]1CCC[N@@H+](CC/C=C/c2ccccc2)CC1 ZINC000450853327 331002994 /nfs/dbraw/zinc/00/29/94/331002994.db2.gz HKXRDUDUPGMSON-QKIXSCASSA-N 1 3 272.436 3.506 20 0 CHADHO C[NH+](C)[C@H]1CCCN(CC/C=C/c2ccccc2)CC1 ZINC000450853327 331002995 /nfs/dbraw/zinc/00/29/95/331002995.db2.gz HKXRDUDUPGMSON-QKIXSCASSA-N 1 3 272.436 3.506 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)CCCC(F)(F)F)CN1CCCCC1 ZINC000163376750 331029348 /nfs/dbraw/zinc/02/93/48/331029348.db2.gz ZQPYSYNTEXVQHB-KGLIPLIRSA-N 1 3 294.405 3.819 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)CCCC(F)(F)F)CN1CCCCC1 ZINC000163376981 331029356 /nfs/dbraw/zinc/02/93/56/331029356.db2.gz ZQPYSYNTEXVQHB-KBPBESRZSA-N 1 3 294.405 3.819 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@H]1CC[C@H](C)c2ccsc21 ZINC000453083315 331087474 /nfs/dbraw/zinc/08/74/74/331087474.db2.gz IDHOQTXFPCPBOV-SCRDCRAPSA-N 1 3 266.454 3.616 20 0 CHADHO CCC[C@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)C1CCC1 ZINC000453107626 331089880 /nfs/dbraw/zinc/08/98/80/331089880.db2.gz LQPBUZGAQHNSKV-WBVHZDCISA-N 1 3 266.473 3.665 20 0 CHADHO C1CC1[C@H]([NH2+]C1CCN(C2CCCCC2)CC1)C1CCC1 ZINC000453147621 331094328 /nfs/dbraw/zinc/09/43/28/331094328.db2.gz XYMNSWMJVLAEGF-LJQANCHMSA-N 1 3 290.495 3.952 20 0 CHADHO CC/C=C\CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000453317465 331115710 /nfs/dbraw/zinc/11/57/10/331115710.db2.gz KSWKDQZITLHNKO-JVAJOMTNSA-N 1 3 284.447 3.738 20 0 CHADHO CC/C=C\CN[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000453317465 331115711 /nfs/dbraw/zinc/11/57/11/331115711.db2.gz KSWKDQZITLHNKO-JVAJOMTNSA-N 1 3 284.447 3.738 20 0 CHADHO CSc1ccccc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)N2C ZINC000453371859 331124073 /nfs/dbraw/zinc/12/40/73/331124073.db2.gz VXSSDZXUVUGKOE-AVOUXACISA-N 1 3 290.476 3.684 20 0 CHADHO C[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cc2c(s1)CCC2 ZINC000453373181 331124494 /nfs/dbraw/zinc/12/44/94/331124494.db2.gz WWAVOFNWTCBBNE-JZIBPQBNSA-N 1 3 290.476 3.513 20 0 CHADHO C[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc2c(s1)CCC2 ZINC000453373181 331124495 /nfs/dbraw/zinc/12/44/95/331124495.db2.gz WWAVOFNWTCBBNE-JZIBPQBNSA-N 1 3 290.476 3.513 20 0 CHADHO CC[C@@H](NCCCC[N@H+](C)C1CC1)c1cc(F)ccc1F ZINC000453410022 331129795 /nfs/dbraw/zinc/12/97/95/331129795.db2.gz UPDWYEGCXUSYSF-QGZVFWFLSA-N 1 3 296.405 3.880 20 0 CHADHO CC[C@@H](NCCCC[N@@H+](C)C1CC1)c1cc(F)ccc1F ZINC000453410022 331129796 /nfs/dbraw/zinc/12/97/96/331129796.db2.gz UPDWYEGCXUSYSF-QGZVFWFLSA-N 1 3 296.405 3.880 20 0 CHADHO CC[C@H](NCCCC[N@H+](C)C1CC1)c1ccc(F)cc1F ZINC000453419383 331130563 /nfs/dbraw/zinc/13/05/63/331130563.db2.gz ZAVZMXLISXUYKZ-KRWDZBQOSA-N 1 3 296.405 3.880 20 0 CHADHO CC[C@H](NCCCC[N@@H+](C)C1CC1)c1ccc(F)cc1F ZINC000453419383 331130564 /nfs/dbraw/zinc/13/05/64/331130564.db2.gz ZAVZMXLISXUYKZ-KRWDZBQOSA-N 1 3 296.405 3.880 20 0 CHADHO CC[C@@]1(C(C)C)C[C@@H]1NC1CC[NH+](C(C)(C)C)CC1 ZINC000453435709 331131522 /nfs/dbraw/zinc/13/15/22/331131522.db2.gz KZZYBCPYKHIRDF-RDJZCZTQSA-N 1 3 266.473 3.664 20 0 CHADHO C[C@@H](c1ccc2c(c1)CCC2)[N@@H+]1CCC[C@H](N(C)C)CC1 ZINC000459418182 331280619 /nfs/dbraw/zinc/28/06/19/331280619.db2.gz FQONOWJDVXALEU-KXBFYZLASA-N 1 3 286.463 3.652 20 0 CHADHO C[C@@H](c1ccc2c(c1)CCC2)[N@H+]1CCC[C@H](N(C)C)CC1 ZINC000459418182 331280620 /nfs/dbraw/zinc/28/06/20/331280620.db2.gz FQONOWJDVXALEU-KXBFYZLASA-N 1 3 286.463 3.652 20 0 CHADHO C[C@H](NCC[C@H]1CCC[N@H+](C)C1)c1cc2ccccc2o1 ZINC000459732682 331296641 /nfs/dbraw/zinc/29/66/41/331296641.db2.gz MNMMNLOFENQHJF-LSDHHAIUSA-N 1 3 286.419 3.815 20 0 CHADHO C[C@H](NCC[C@H]1CCC[N@@H+](C)C1)c1cc2ccccc2o1 ZINC000459732682 331296642 /nfs/dbraw/zinc/29/66/42/331296642.db2.gz MNMMNLOFENQHJF-LSDHHAIUSA-N 1 3 286.419 3.815 20 0 CHADHO CC[C@@H](NCCC1CC[NH+](C)CC1)c1ccccc1F ZINC000166050409 331306480 /nfs/dbraw/zinc/30/64/80/331306480.db2.gz QBXLORZIVMMEMS-QGZVFWFLSA-N 1 3 278.415 3.598 20 0 CHADHO C(CN[C@H]1CC[N@@H+]2CCC[C@@H]2C1)CC1CCCCC1 ZINC000166140334 331306615 /nfs/dbraw/zinc/30/66/15/331306615.db2.gz BQUFEXVNWJQDSF-DLBZAZTESA-N 1 3 264.457 3.563 20 0 CHADHO C(CN[C@H]1CC[N@H+]2CCC[C@@H]2C1)CC1CCCCC1 ZINC000166140334 331306616 /nfs/dbraw/zinc/30/66/16/331306616.db2.gz BQUFEXVNWJQDSF-DLBZAZTESA-N 1 3 264.457 3.563 20 0 CHADHO C(C[NH2+][C@H]1CCN2CCC[C@@H]2C1)CC1CCCCC1 ZINC000166140334 331306617 /nfs/dbraw/zinc/30/66/17/331306617.db2.gz BQUFEXVNWJQDSF-DLBZAZTESA-N 1 3 264.457 3.563 20 0 CHADHO CC[NH2+]CC1CCN(Cc2ccc(C(C)(C)C)s2)CC1 ZINC000166186136 331306901 /nfs/dbraw/zinc/30/69/01/331306901.db2.gz ZRKMBHNCWARKCU-UHFFFAOYSA-N 1 3 294.508 3.867 20 0 CHADHO CN1CCC[C@@H]1CC[N@H+](C)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463437922 331347801 /nfs/dbraw/zinc/34/78/01/331347801.db2.gz VABNKIJHXFHWFB-MCIONIFRSA-N 1 3 292.389 3.524 20 0 CHADHO CN1CCC[C@@H]1CC[N@@H+](C)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463437922 331347802 /nfs/dbraw/zinc/34/78/02/331347802.db2.gz VABNKIJHXFHWFB-MCIONIFRSA-N 1 3 292.389 3.524 20 0 CHADHO C[C@H](CCc1ccsc1)[NH2+]CC(C)(C)CN1CCCC1 ZINC000477928817 331694547 /nfs/dbraw/zinc/69/45/47/331694547.db2.gz FJIONQXNQBLDNI-OAHLLOKOSA-N 1 3 294.508 3.781 20 0 CHADHO CC(C)[C@H](C)C[NH2+][C@H](C)c1cccc(OCCN(C)C)c1 ZINC000484180769 331894274 /nfs/dbraw/zinc/89/42/74/331894274.db2.gz UOZNTCGFJCNGHL-HZPDHXFCSA-N 1 3 292.467 3.570 20 0 CHADHO C[C@H](CC[NH2+][C@H]1CC[C@H]1C(C)(C)C)N1CCCCC1 ZINC000566382214 334645762 /nfs/dbraw/zinc/64/57/62/334645762.db2.gz IRZKOXBLXLTGIH-OAGGEKHMSA-N 1 3 266.473 3.665 20 0 CHADHO C[NH+]1CCC(C)(CNCc2ccc(-c3ccccc3)o2)CC1 ZINC000503915063 332699050 /nfs/dbraw/zinc/69/90/50/332699050.db2.gz VEXRXIJJHJNQED-UHFFFAOYSA-N 1 3 298.430 3.768 20 0 CHADHO CCc1cc(NC2CCN(Cc3ccccc3)CC2)cc[nH+]1 ZINC000307779852 333016460 /nfs/dbraw/zinc/01/64/60/333016460.db2.gz YGMONEUGNCCQPL-UHFFFAOYSA-N 1 3 295.430 3.721 20 0 CHADHO C1=CC[C@H](CN2CCC[C@@H](C[NH+]3CCCCCC3)C2)CC1 ZINC000513411451 333018037 /nfs/dbraw/zinc/01/80/37/333018037.db2.gz MWUHPMQRYQESRL-OALUTQOASA-N 1 3 290.495 3.931 20 0 CHADHO C1=CC[C@H](C[N@H+]2CCC[C@@H](CN3CCCCCC3)C2)CC1 ZINC000513411451 333018039 /nfs/dbraw/zinc/01/80/39/333018039.db2.gz MWUHPMQRYQESRL-OALUTQOASA-N 1 3 290.495 3.931 20 0 CHADHO C1=CC[C@H](C[N@@H+]2CCC[C@@H](CN3CCCCCC3)C2)CC1 ZINC000513411451 333018040 /nfs/dbraw/zinc/01/80/40/333018040.db2.gz MWUHPMQRYQESRL-OALUTQOASA-N 1 3 290.495 3.931 20 0 CHADHO CC[C@@H](C)[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000310027204 333052972 /nfs/dbraw/zinc/05/29/72/333052972.db2.gz VWQGKXUOUCKLAC-SJLPKXTDSA-N 1 3 274.452 3.677 20 0 CHADHO C[C@H](CCC(C)(C)C)[NH2+]C[C@H](C)CN1CCCC1 ZINC000310892982 333062397 /nfs/dbraw/zinc/06/23/97/333062397.db2.gz YVDQPWCDNQXAPC-LSDHHAIUSA-N 1 3 254.462 3.523 20 0 CHADHO C[C@H](CN[C@H](c1cccs1)C1CCCC1)C[NH+](C)C ZINC000311825349 333072983 /nfs/dbraw/zinc/07/29/83/333072983.db2.gz ODHJAEPKCHOCOT-CJNGLKHVSA-N 1 3 280.481 3.767 20 0 CHADHO CCC[NH+]1CCC(CN[C@@H](C)c2sccc2OC)CC1 ZINC000186153053 333155615 /nfs/dbraw/zinc/15/56/15/333155615.db2.gz MKCMESJEAQITJQ-ZDUSSCGKSA-N 1 3 296.480 3.529 20 0 CHADHO C[C@H]1CCCCN1CCC[NH2+][C@H](c1ccccc1)C1CC1 ZINC000226900117 333271704 /nfs/dbraw/zinc/27/17/04/333271704.db2.gz CTKHJMYHDKYEGI-QFBILLFUSA-N 1 3 286.463 3.992 20 0 CHADHO C[C@H](CCN[C@@H]1C[C@@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000227540563 333285508 /nfs/dbraw/zinc/28/55/08/333285508.db2.gz HSFJZLSDYLZSLM-NIKGAXFTSA-N 1 3 280.415 3.915 20 0 CHADHO CC[C@H]1CCC[C@H]([NH2+]C2CC(C)(C)NC(C)(C)C2)C1 ZINC000071107002 333843461 /nfs/dbraw/zinc/84/34/61/333843461.db2.gz ZUHFDUWMYDYERL-KBPBESRZSA-N 1 3 266.473 3.854 20 0 CHADHO CC[C@@H]1CCC[C@H](CN2CCC([NH2+]C(C)C)CC2)C1 ZINC000543393962 333870799 /nfs/dbraw/zinc/87/07/99/333870799.db2.gz DHRSIUZNLIPAAH-CVEARBPZSA-N 1 3 266.473 3.665 20 0 CHADHO Cc1ccc([C@H]2CCN(CCC[NH+]3CCCCC3)C2)cc1 ZINC000548073036 334138473 /nfs/dbraw/zinc/13/84/73/334138473.db2.gz RDGPRRBBLXFACL-IBGZPJMESA-N 1 3 286.463 3.660 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN([C@H](CC)c2ccccc2)C1 ZINC000245417489 334190990 /nfs/dbraw/zinc/19/09/90/334190990.db2.gz GBMQPWYONNCEER-FUHWJXTLSA-N 1 3 274.452 3.801 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN([C@H](CC)c2ccccc2)C1 ZINC000245417489 334190992 /nfs/dbraw/zinc/19/09/92/334190992.db2.gz GBMQPWYONNCEER-FUHWJXTLSA-N 1 3 274.452 3.801 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+]([C@H](CC)c2ccccc2)C1 ZINC000245417489 334190993 /nfs/dbraw/zinc/19/09/93/334190993.db2.gz GBMQPWYONNCEER-FUHWJXTLSA-N 1 3 274.452 3.801 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+]([C@H](CC)c2ccccc2)C1 ZINC000245417489 334190994 /nfs/dbraw/zinc/19/09/94/334190994.db2.gz GBMQPWYONNCEER-FUHWJXTLSA-N 1 3 274.452 3.801 20 0 CHADHO C[C@@H](NCCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccco1 ZINC000246923588 334271851 /nfs/dbraw/zinc/27/18/51/334271851.db2.gz GVJLQFNZAACCHF-OWCLPIDISA-N 1 3 278.440 3.688 20 0 CHADHO C[C@@H](NCCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccco1 ZINC000246923588 334271852 /nfs/dbraw/zinc/27/18/52/334271852.db2.gz GVJLQFNZAACCHF-OWCLPIDISA-N 1 3 278.440 3.688 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H](C)c2ccc(C)c(C)c2)C1 ZINC000246948141 334272305 /nfs/dbraw/zinc/27/23/05/334272305.db2.gz HZRUASLERNNPBB-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H](C)c2ccc(C)c(C)c2)C1 ZINC000246948141 334272307 /nfs/dbraw/zinc/27/23/07/334272307.db2.gz HZRUASLERNNPBB-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](C)c2ccc(C)c(C)c2)C1 ZINC000246948141 334272309 /nfs/dbraw/zinc/27/23/09/334272309.db2.gz HZRUASLERNNPBB-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO CC(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCN3CCC[C@@H]3C2)CC1 ZINC000245917968 334224080 /nfs/dbraw/zinc/22/40/80/334224080.db2.gz FWDOFLLNBOUGFO-VSZNYVQBSA-N 1 3 278.484 3.808 20 0 CHADHO C1CCC(N2CCC([NH2+][C@@H]3CC4CCC3CC4)CC2)C1 ZINC000550829983 334229680 /nfs/dbraw/zinc/22/96/80/334229680.db2.gz RYIJZETVAHFZKZ-JTTJXQCZSA-N 1 3 276.468 3.562 20 0 CHADHO C[NH+](C)[C@@H]1CCC[C@@H](N[C@H](c2ccccc2)C2CC2)C1 ZINC000246168064 334237972 /nfs/dbraw/zinc/23/79/72/334237972.db2.gz VBVOAJBPUYKOGA-KZNAEPCWSA-N 1 3 272.436 3.600 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@H](c2ccccc2)C2CC2)C1 ZINC000246168064 334237973 /nfs/dbraw/zinc/23/79/73/334237973.db2.gz VBVOAJBPUYKOGA-KZNAEPCWSA-N 1 3 272.436 3.600 20 0 CHADHO C[C@H](CCC(C)(C)C)[NH2+][C@H]1CCC[C@H](N(C)C)C1 ZINC000551787754 334261072 /nfs/dbraw/zinc/26/10/72/334261072.db2.gz LWBIVFXJVXMQRO-ILXRZTDVSA-N 1 3 254.462 3.664 20 0 CHADHO C[C@@H](CCN1CC[C@@H](C[NH+]2CCCC2)C1)c1ccccc1 ZINC000248872469 334320183 /nfs/dbraw/zinc/32/01/83/334320183.db2.gz IEOLZAIFFRFSIG-ROUUACIJSA-N 1 3 286.463 3.598 20 0 CHADHO C[C@@H](CC[N@@H+]1CC[C@@H](CN2CCCC2)C1)c1ccccc1 ZINC000248872469 334320184 /nfs/dbraw/zinc/32/01/84/334320184.db2.gz IEOLZAIFFRFSIG-ROUUACIJSA-N 1 3 286.463 3.598 20 0 CHADHO C[C@@H](CC[N@H+]1CC[C@@H](CN2CCCC2)C1)c1ccccc1 ZINC000248872469 334320185 /nfs/dbraw/zinc/32/01/85/334320185.db2.gz IEOLZAIFFRFSIG-ROUUACIJSA-N 1 3 286.463 3.598 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@@H]2CCC[C@H]2C[NH3+])cc1 ZINC000250564369 334346295 /nfs/dbraw/zinc/34/62/95/334346295.db2.gz AVFGGBCDLHOIEP-RRQGHBQHSA-N 1 3 260.425 3.588 20 0 CHADHO C[C@H](CCN[C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1)c1ccccc1 ZINC000251253817 334358978 /nfs/dbraw/zinc/35/89/78/334358978.db2.gz UXHZJVVKWSRGPE-OWYHZJEWSA-N 1 3 286.463 3.691 20 0 CHADHO C[C@@H]1CC[C@@H]([NH2+]C2CC(C)(C)NC(C)(C)C2)C[C@H]1C ZINC000251784579 334369545 /nfs/dbraw/zinc/36/95/45/334369545.db2.gz LHAADSDLVLKVSU-MGPQQGTHSA-N 1 3 266.473 3.710 20 0 CHADHO C1C[C@H]2C[C@H]([NH2+][C@@H]3CC[C@H]4CCCC[C@@H]4C3)CCN2C1 ZINC000252673290 334384937 /nfs/dbraw/zinc/38/49/37/334384937.db2.gz IMEUTJXEPMANOL-ZKXLYKBJSA-N 1 3 276.468 3.562 20 0 CHADHO CC(C)(CN[C@@H]1CCC[C@H]([NH3+])C1)c1c(F)cccc1Cl ZINC000577509567 335362606 /nfs/dbraw/zinc/36/26/06/335362606.db2.gz DWFUQINGENTZJR-NWDGAFQWSA-N 1 3 298.833 3.616 20 0 CHADHO C[NH+]1CCC([C@H]2CCN(Cc3sccc3Cl)C2)CC1 ZINC000581098976 336008186 /nfs/dbraw/zinc/00/81/86/336008186.db2.gz HARYAISNUAKQMQ-ZDUSSCGKSA-N 1 3 298.883 3.565 20 0 CHADHO CCC(C)(C)[C@H](C)[NH2+]CC1CCN(c2ccncc2)CC1 ZINC000581173399 336019202 /nfs/dbraw/zinc/01/92/02/336019202.db2.gz DMULXIRTJGDQPM-HNNXBMFYSA-N 1 3 289.467 3.712 20 0 CHADHO CC(C)(CN[C@@H]1C[C@H]([NH3+])c2ccccc21)C1CCC1 ZINC000384834593 336132292 /nfs/dbraw/zinc/13/22/92/336132292.db2.gz GHVFHPBZTLSUFW-JKSUJKDBSA-N 1 3 258.409 3.547 20 0 CHADHO C[C@H](c1cccc2ccccc21)N1CC[C@H]2[NH2+]CC[C@H]2C1 ZINC000386687383 336177175 /nfs/dbraw/zinc/17/71/75/336177175.db2.gz KNQOGGBYOBBQSR-SIXWZSSISA-N 1 3 280.415 3.585 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H](C)c2cccs2)C1 ZINC000125785780 519678245 /nfs/dbraw/zinc/67/82/45/519678245.db2.gz GOSYTVGMNNQIAY-UONOGXRCSA-N 1 3 266.454 3.519 20 0 CHADHO CC(C)Oc1cccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC000130111245 519783751 /nfs/dbraw/zinc/78/37/51/519783751.db2.gz KNMSIVAUNCBAMG-YQQAZPJKSA-N 1 3 290.451 3.607 20 0 CHADHO CC(C)Oc1cccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC000130111245 519783752 /nfs/dbraw/zinc/78/37/52/519783752.db2.gz KNMSIVAUNCBAMG-YQQAZPJKSA-N 1 3 290.451 3.607 20 0 CHADHO CC(C)[C@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC000036967529 519820629 /nfs/dbraw/zinc/82/06/29/519820629.db2.gz JUKGSLQGCCQLDH-FBVQUNGASA-N 1 3 272.436 3.599 20 0 CHADHO CC(C)[C@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC000036967529 519820630 /nfs/dbraw/zinc/82/06/30/519820630.db2.gz JUKGSLQGCCQLDH-FBVQUNGASA-N 1 3 272.436 3.599 20 0 CHADHO CCCOc1ccc([C@H](C)NC2CC[NH+](CC)CC2)cc1 ZINC000038097947 520426889 /nfs/dbraw/zinc/42/68/89/520426889.db2.gz ZAWHOKHWBLWRAU-HNNXBMFYSA-N 1 3 290.451 3.610 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N[C@@H](C)c1ccc(Cl)cn1 ZINC000274906800 520637358 /nfs/dbraw/zinc/63/73/58/520637358.db2.gz MJAZQYYRKFAOIW-KBPBESRZSA-N 1 3 297.874 3.896 20 0 CHADHO CC[C@@H](c1ccccc1)[N@@H+]1CCC[C@@H](N(C)C)CC1 ZINC000277099015 523099742 /nfs/dbraw/zinc/09/97/42/523099742.db2.gz GIZWALAZHMFSLN-SJORKVTESA-N 1 3 260.425 3.554 20 0 CHADHO CC[C@@H](c1ccccc1)[N@H+]1CCC[C@@H](N(C)C)CC1 ZINC000277099015 523099751 /nfs/dbraw/zinc/09/97/51/523099751.db2.gz GIZWALAZHMFSLN-SJORKVTESA-N 1 3 260.425 3.554 20 0 CHADHO CC[C@@H](c1ccccc1)N1CCC[C@@H]([NH+](C)C)CC1 ZINC000277099015 523099764 /nfs/dbraw/zinc/09/97/64/523099764.db2.gz GIZWALAZHMFSLN-SJORKVTESA-N 1 3 260.425 3.554 20 0 CHADHO Cc1sccc1CN[C@H](CC[NH+](C)C)C(C)(C)C ZINC000339265892 526920672 /nfs/dbraw/zinc/92/06/72/526920672.db2.gz VHIYZKDPBORBCH-CQSZACIVSA-N 1 3 268.470 3.513 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NC2CCC(C(F)(F)F)CC2)c2ccccc21 ZINC000157357436 527375968 /nfs/dbraw/zinc/37/59/68/527375968.db2.gz WWXYPTORGMWHKU-FWFPMQDGSA-N 1 3 298.352 3.842 20 0 CHADHO CC1CC[NH+](CCCCN[C@H]2CCCc3occc32)CC1 ZINC000192678180 528236764 /nfs/dbraw/zinc/23/67/64/528236764.db2.gz DEOOSNGKLROAAT-KRWDZBQOSA-N 1 3 290.451 3.759 20 0 CHADHO C[C@@H](N[C@@H]1CCC[NH2+]CC1)c1ccc(C(C)(C)C)cc1 ZINC000133627466 1125481076 /nfs/dbraw/zinc/48/10/76/1125481076.db2.gz QHQKWHUOPINZNR-RHSMWYFYSA-N 1 3 274.452 3.777 20 0 CHADHO CCN(CC)CCC[N@H+](CC1CCCCC1)C1CC1 ZINC001167094265 1117983379 /nfs/dbraw/zinc/98/33/79/1117983379.db2.gz JVGJGPDMPACCEL-UHFFFAOYSA-N 1 3 266.473 3.763 20 0 CHADHO CCN(CC)CCC[N@@H+](CC1CCCCC1)C1CC1 ZINC001167094265 1117983381 /nfs/dbraw/zinc/98/33/81/1117983381.db2.gz JVGJGPDMPACCEL-UHFFFAOYSA-N 1 3 266.473 3.763 20 0 CHADHO CC(C)(C)[C@@H](N[C@@H]1CCC[NH2+]CC1)c1ccc(F)cc1 ZINC000133708019 1125485632 /nfs/dbraw/zinc/48/56/32/1125485632.db2.gz WLLMIFQYWJMMSC-CVEARBPZSA-N 1 3 278.415 3.645 20 0 CHADHO C[C@@H](CSC(C)(C)C)[NH2+]CCCN1CCC(C)CC1 ZINC000764641205 1118103980 /nfs/dbraw/zinc/10/39/80/1118103980.db2.gz PLDYAWPEPZZQTO-HNNXBMFYSA-N 1 3 286.529 3.618 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]CCCN2CCCC[C@@H]2C)C[C@H]1C ZINC000251760318 1125501692 /nfs/dbraw/zinc/50/16/92/1125501692.db2.gz KEOASSPXFQHIME-NCOADZHNSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)[C@@H](N[C@H]1CC[NH2+]C(C)(C)C1)c1ccccc1 ZINC000709268028 1120482616 /nfs/dbraw/zinc/48/26/16/1120482616.db2.gz WYOWDALNDREKRW-JKSUJKDBSA-N 1 3 260.425 3.504 20 0 CHADHO CCC[NH+]1CCC(N[C@@H](c2cccs2)C2CC2)CC1 ZINC000049956858 1122895173 /nfs/dbraw/zinc/89/51/73/1122895173.db2.gz SPAJDOORYDFTOI-MRXNPFEDSA-N 1 3 278.465 3.663 20 0 CHADHO CCC[C@H](N[C@H]1CC[N@H+](C)[C@H](C)C1)c1ccsc1 ZINC000443086647 1123355231 /nfs/dbraw/zinc/35/52/31/1123355231.db2.gz NJUWAAKHODYPFQ-SNPRPXQTSA-N 1 3 266.454 3.662 20 0 CHADHO CCC[C@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccsc1 ZINC000443086647 1123355236 /nfs/dbraw/zinc/35/52/36/1123355236.db2.gz NJUWAAKHODYPFQ-SNPRPXQTSA-N 1 3 266.454 3.662 20 0 CHADHO CC[C@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)C1CCCC1 ZINC000449131481 1124652584 /nfs/dbraw/zinc/65/25/84/1124652584.db2.gz MWQNCTFPHVVARM-RDJZCZTQSA-N 1 3 266.473 3.665 20 0 CHADHO CCC(CC)N1CCC([NH2+]C2CCC(C)CC2)CC1 ZINC001168204496 1125411615 /nfs/dbraw/zinc/41/16/15/1125411615.db2.gz TYRMAULSSGKOGO-UHFFFAOYSA-N 1 3 266.473 3.808 20 0 CHADHO N[C@@H]1CCC[N@H+](C2CCC3(CCCCC3)CC2)CC1 ZINC001246543054 1131586237 /nfs/dbraw/zinc/58/62/37/1131586237.db2.gz RTYUSZBMARFMCM-OAHLLOKOSA-N 1 3 264.457 3.693 20 0 CHADHO CC[NH+]1CCC(CCN[C@H](C)c2cccnc2Cl)CC1 ZINC000121700598 1125778902 /nfs/dbraw/zinc/77/89/02/1125778902.db2.gz OYWIJRARGIECDN-CYBMUJFWSA-N 1 3 295.858 3.508 20 0 CHADHO CC[NH+]1CCC(NC(C)(C)c2cccc(Cl)c2)CC1 ZINC001169233860 1129711331 /nfs/dbraw/zinc/71/13/31/1129711331.db2.gz XDDFOQQMSWCTDK-UHFFFAOYSA-N 1 3 280.843 3.649 20 0 CHADHO CSC(C)(C)C[C@@H](C)[NH+]1C(C)(C)CC(N)CC1(C)C ZINC001258321374 1129196345 /nfs/dbraw/zinc/19/63/45/1129196345.db2.gz KCCCPMLUPPIFIB-GFCCVEGCSA-N 1 3 286.529 3.887 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@H]2CC[N@@H+](C)C[C@H]2C)c1C ZINC000482330892 1126751567 /nfs/dbraw/zinc/75/15/67/1126751567.db2.gz JCTTXEGTVKHEGL-ACJLOTCBSA-N 1 3 299.462 3.523 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@H]2CC[N@H+](C)C[C@H]2C)c1C ZINC000482330892 1126751569 /nfs/dbraw/zinc/75/15/69/1126751569.db2.gz JCTTXEGTVKHEGL-ACJLOTCBSA-N 1 3 299.462 3.523 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN(CCCC2CCCC2)C1 ZINC000483238378 1126774045 /nfs/dbraw/zinc/77/40/45/1126774045.db2.gz CPGPZXWZYYZTCL-KRWDZBQOSA-N 1 3 266.473 3.621 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN(CCCC2CCCC2)C1 ZINC000483238378 1126774047 /nfs/dbraw/zinc/77/40/47/1126774047.db2.gz CPGPZXWZYYZTCL-KRWDZBQOSA-N 1 3 266.473 3.621 20 0 CHADHO C[C@H]1CCC[N@H+](Cc2ccc(CNCc3cc[nH]c3)cc2)C1 ZINC000175697782 1126784996 /nfs/dbraw/zinc/78/49/96/1126784996.db2.gz ZWXZFAKEKRIKED-INIZCTEOSA-N 1 3 297.446 3.536 20 0 CHADHO C[C@H]1CCC[N@@H+](Cc2ccc(CNCc3cc[nH]c3)cc2)C1 ZINC000175697782 1126784997 /nfs/dbraw/zinc/78/49/97/1126784997.db2.gz ZWXZFAKEKRIKED-INIZCTEOSA-N 1 3 297.446 3.536 20 0 CHADHO Cc1cc([C@H](C)[NH2+][C@H]2CCC[C@@H](N(C)C)C2)cc(C)c1F ZINC000484473164 1126820428 /nfs/dbraw/zinc/82/04/28/1126820428.db2.gz LVXRCOBJDATHQG-BHYGNILZSA-N 1 3 292.442 3.966 20 0 CHADHO c1ccc(CC2CCN([C@@H]3CC[N@@H+]4CCC[C@@H]4C3)CC2)cc1 ZINC000183366003 1126885525 /nfs/dbraw/zinc/88/55/25/1126885525.db2.gz ZSYGXNJONAHAOH-WOJBJXKFSA-N 1 3 298.474 3.568 20 0 CHADHO c1ccc(CC2CCN([C@@H]3CC[N@H+]4CCC[C@@H]4C3)CC2)cc1 ZINC000183366003 1126885527 /nfs/dbraw/zinc/88/55/27/1126885527.db2.gz ZSYGXNJONAHAOH-WOJBJXKFSA-N 1 3 298.474 3.568 20 0 CHADHO Cc1ccc2cc(C[NH2+][C@@H]3CCC[C@@H](N(C)C)C3)ccc2n1 ZINC000189373346 1126931163 /nfs/dbraw/zinc/93/11/63/1126931163.db2.gz BSDJLENSWBAMGC-QZTJIDSGSA-N 1 3 297.446 3.506 20 0 CHADHO CC(C)c1cccc(C[N@@H+](C)[C@@H]2CCCC[C@@H]2N)c1 ZINC001236214068 1130891369 /nfs/dbraw/zinc/89/13/69/1130891369.db2.gz DUKJBQMQIXDRBZ-DLBZAZTESA-N 1 3 260.425 3.512 20 0 CHADHO C[NH+](C)Cc1cccc(CN[C@H]2CCc3c2cccc3F)c1 ZINC000268766800 1127022339 /nfs/dbraw/zinc/02/23/39/1127022339.db2.gz QNKYPPCZFSYMRT-IBGZPJMESA-N 1 3 298.405 3.664 20 0 CHADHO CCCN1CCC([NH2+]Cc2ccc(CSC)cc2)CC1 ZINC000285603206 1127239298 /nfs/dbraw/zinc/23/92/98/1127239298.db2.gz IQZRPEOSGBOWDN-UHFFFAOYSA-N 1 3 292.492 3.514 20 0 CHADHO Cc1oc2ccccc2c1CN1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000355215380 1127325915 /nfs/dbraw/zinc/32/59/15/1127325915.db2.gz ZDTYUMDFQTWFLG-YJBOKZPZSA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1CN1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000355215380 1127325916 /nfs/dbraw/zinc/32/59/16/1127325916.db2.gz ZDTYUMDFQTWFLG-YJBOKZPZSA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1C[N@@H+]1CC[C@H]2[C@@H](CCCN2C)C1 ZINC000355215380 1127325920 /nfs/dbraw/zinc/32/59/20/1127325920.db2.gz ZDTYUMDFQTWFLG-YJBOKZPZSA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1C[N@H+]1CC[C@H]2[C@@H](CCCN2C)C1 ZINC000355215380 1127325924 /nfs/dbraw/zinc/32/59/24/1127325924.db2.gz ZDTYUMDFQTWFLG-YJBOKZPZSA-N 1 3 298.430 3.657 20 0 CHADHO CC[C@H](CN[C@@H](CC)c1ccc(OC)cc1)[NH+]1CCCC1 ZINC000360089449 1127489106 /nfs/dbraw/zinc/48/91/06/1127489106.db2.gz UANNJFSODIPWHW-AEFFLSMTSA-N 1 3 290.451 3.610 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H]2CC[C@H](C)c3ccccc32)C1 ZINC000360235276 1127493605 /nfs/dbraw/zinc/49/36/05/1127493605.db2.gz TXDYPMKRGJCQSE-FRQCXROJSA-N 1 3 286.463 3.947 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H]2CC[C@H](C)c3ccccc32)C1 ZINC000360235276 1127493606 /nfs/dbraw/zinc/49/36/06/1127493606.db2.gz TXDYPMKRGJCQSE-FRQCXROJSA-N 1 3 286.463 3.947 20 0 CHADHO CCCCCN1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000605186832 1127731131 /nfs/dbraw/zinc/73/11/31/1127731131.db2.gz ZQQHPVHJCOPWSM-KRWDZBQOSA-N 1 3 266.473 3.621 20 0 CHADHO C[N@@H+]1CCC[C@H]1CCN[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000535468481 1127916672 /nfs/dbraw/zinc/91/66/72/1127916672.db2.gz IXVXBINEZWCZDO-ZWKOTPCHSA-N 1 3 290.426 3.741 20 0 CHADHO C[N@H+]1CCC[C@H]1CCN[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000535468481 1127916673 /nfs/dbraw/zinc/91/66/73/1127916673.db2.gz IXVXBINEZWCZDO-ZWKOTPCHSA-N 1 3 290.426 3.741 20 0 CHADHO CN1CCC[C@H]1CC[NH2+][C@@H](c1ccc(F)cc1)C1CCC1 ZINC000535468481 1127916674 /nfs/dbraw/zinc/91/66/74/1127916674.db2.gz IXVXBINEZWCZDO-ZWKOTPCHSA-N 1 3 290.426 3.741 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2CC[C@H](C)C[C@@H]2CC)C1 ZINC000539857712 1127947879 /nfs/dbraw/zinc/94/78/79/1127947879.db2.gz BNBSQLUDRLYHKG-VVLHAWIVSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@@H]1C[C@@H](NCc2ccc(C3CCCC3)cc2)CC[N@@H+]1C ZINC000462780434 1127954865 /nfs/dbraw/zinc/95/48/65/1127954865.db2.gz WJYPSCOHQAUVGD-BEFAXECRSA-N 1 3 286.463 3.917 20 0 CHADHO C[C@@H]1C[C@@H](NCc2ccc(C3CCCC3)cc2)CC[N@H+]1C ZINC000462780434 1127954868 /nfs/dbraw/zinc/95/48/68/1127954868.db2.gz WJYPSCOHQAUVGD-BEFAXECRSA-N 1 3 286.463 3.917 20 0 CHADHO Clc1cccc2c1CCC[C@H]2[NH2+]CCCN1CCCC1 ZINC000541749778 1128037371 /nfs/dbraw/zinc/03/73/71/1128037371.db2.gz SKHREAXIHOQSOS-QGZVFWFLSA-N 1 3 292.854 3.793 20 0 CHADHO CCC(CC)(CC)C[N@@H+]1CC[C@@H]2[C@H](CCCN2C)C1 ZINC000542018889 1128047318 /nfs/dbraw/zinc/04/73/18/1128047318.db2.gz GCGFHGMHGZTTIG-HZPDHXFCSA-N 1 3 266.473 3.619 20 0 CHADHO CCC(CC)(CC)C[N@H+]1CC[C@@H]2[C@H](CCCN2C)C1 ZINC000542018889 1128047321 /nfs/dbraw/zinc/04/73/21/1128047321.db2.gz GCGFHGMHGZTTIG-HZPDHXFCSA-N 1 3 266.473 3.619 20 0 CHADHO CCc1cccc(CN2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000469730909 1128051809 /nfs/dbraw/zinc/05/18/09/1128051809.db2.gz GZHMBKKLLZJADJ-UYAOXDASSA-N 1 3 298.474 3.698 20 0 CHADHO CCc1cccc(CN2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000469730909 1128051813 /nfs/dbraw/zinc/05/18/13/1128051813.db2.gz GZHMBKKLLZJADJ-UYAOXDASSA-N 1 3 298.474 3.698 20 0 CHADHO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1CCCN1CCCCC1 ZINC000469996162 1128061266 /nfs/dbraw/zinc/06/12/66/1128061266.db2.gz JRXVJEORPORFEY-ZDUSSCGKSA-N 1 3 292.389 3.525 20 0 CHADHO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1CCCN1CCCCC1 ZINC000469996162 1128061270 /nfs/dbraw/zinc/06/12/70/1128061270.db2.gz JRXVJEORPORFEY-ZDUSSCGKSA-N 1 3 292.389 3.525 20 0 CHADHO CC(C)N(C)CCC[NH2+]C[C@H](C)c1cccc(Cl)c1 ZINC000470196774 1128066420 /nfs/dbraw/zinc/06/64/20/1128066420.db2.gz WKCTXOCENOZAJR-AWEZNQCLSA-N 1 3 282.859 3.763 20 0 CHADHO C/C(=C/c1ccc(Cl)cc1)CNC[C@H](C)C[NH+](C)C ZINC000491597882 1128073225 /nfs/dbraw/zinc/07/32/25/1128073225.db2.gz ZZMFTZDJWZBPEY-XXYUJHKVSA-N 1 3 280.843 3.531 20 0 CHADHO C/C(=C/c1ccc(Cl)cc1)C[NH2+]C[C@H](C)CN(C)C ZINC000491597882 1128073229 /nfs/dbraw/zinc/07/32/29/1128073229.db2.gz ZZMFTZDJWZBPEY-XXYUJHKVSA-N 1 3 280.843 3.531 20 0 CHADHO C[N@H+](CC1CC1)C[C@@H]1CCN([C@H]2CCCc3ccccc32)C1 ZINC000470976118 1128084000 /nfs/dbraw/zinc/08/40/00/1128084000.db2.gz KGMIQHSVJMXIDI-PXNSSMCTSA-N 1 3 298.474 3.728 20 0 CHADHO C[N@@H+](CC1CC1)C[C@@H]1CCN([C@H]2CCCc3ccccc32)C1 ZINC000470976118 1128084003 /nfs/dbraw/zinc/08/40/03/1128084003.db2.gz KGMIQHSVJMXIDI-PXNSSMCTSA-N 1 3 298.474 3.728 20 0 CHADHO CCCC[C@H](CC)CC[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000557097221 1128091557 /nfs/dbraw/zinc/09/15/57/1128091557.db2.gz JERUDVZUEWCMNY-IRXDYDNUSA-N 1 3 268.489 3.913 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](C)c2csc3ccccc23)C1 ZINC000924707955 1128111067 /nfs/dbraw/zinc/11/10/67/1128111067.db2.gz WJJYADZWNDWKRL-KGLIPLIRSA-N 1 3 288.460 3.894 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](C)c2csc3ccccc23)C1 ZINC000924707955 1128111069 /nfs/dbraw/zinc/11/10/69/1128111069.db2.gz WJJYADZWNDWKRL-KGLIPLIRSA-N 1 3 288.460 3.894 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](C)c2csc3ccccc23)C1 ZINC000924707955 1128111071 /nfs/dbraw/zinc/11/10/71/1128111071.db2.gz WJJYADZWNDWKRL-KGLIPLIRSA-N 1 3 288.460 3.894 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)c1cc2ccccc2[nH]1 ZINC000925217456 1128125776 /nfs/dbraw/zinc/12/57/76/1128125776.db2.gz PCNWRVAHGADYDW-IMJJTQAJSA-N 1 3 285.435 3.691 20 0 CHADHO C[C@H](Cc1cccc(F)c1)N1C(C)(C)CC([NH3+])CC1(C)C ZINC001168454801 1128132996 /nfs/dbraw/zinc/13/29/96/1128132996.db2.gz AWVMDDJIFWIMKF-CYBMUJFWSA-N 1 3 292.442 3.737 20 0 CHADHO CC(C)C[C@@H](NCCC(C)(C)[NH3+])c1cccs1 ZINC000925743053 1128140183 /nfs/dbraw/zinc/14/01/83/1128140183.db2.gz ZZERBGUQDSCDPI-GFCCVEGCSA-N 1 3 254.443 3.552 20 0 CHADHO C[C@@H]([NH2+]C1CC2(C1)CCCC2)[C@@H]1CCCN(C2CCC2)C1 ZINC000926119911 1128156278 /nfs/dbraw/zinc/15/62/78/1128156278.db2.gz SHPSEFMUZOCBNK-HZPDHXFCSA-N 1 3 290.495 3.952 20 0 CHADHO CC(C)CCN1CCC([NH2+]CCC2CC(F)(F)C2)CC1 ZINC000926558260 1128180457 /nfs/dbraw/zinc/18/04/57/1128180457.db2.gz PQSSCJDKDINTFU-UHFFFAOYSA-N 1 3 288.426 3.522 20 0 CHADHO CCC[C@H](C)[NH2+]C1CCN(C[C@@H]2CC=CCC2)CC1 ZINC001257314685 1128231952 /nfs/dbraw/zinc/23/19/52/1128231952.db2.gz OJSQUJXYPYGUBS-JKSUJKDBSA-N 1 3 264.457 3.585 20 0 CHADHO CC(C)c1ccc([C@@H](C)NC[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000037649522 1128434456 /nfs/dbraw/zinc/43/44/56/1128434456.db2.gz PSYXUHPSSFFXPK-CVEARBPZSA-N 1 3 286.463 3.945 20 0 CHADHO CC(C)c1ccc([C@@H](C)NC[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000037649522 1128434458 /nfs/dbraw/zinc/43/44/58/1128434458.db2.gz PSYXUHPSSFFXPK-CVEARBPZSA-N 1 3 286.463 3.945 20 0 CHADHO C[C@H](C[NH2+]C1CCN(C(C)(C)C)CC1)c1ccccc1 ZINC000037786587 1128435942 /nfs/dbraw/zinc/43/59/42/1128435942.db2.gz MDNLQHVUSXFXEW-OAHLLOKOSA-N 1 3 274.452 3.643 20 0 CHADHO CCc1ccc([C@H](C)NC[C@@H](C)C[NH+]2CCCC2)cc1 ZINC000062078076 1128436326 /nfs/dbraw/zinc/43/63/26/1128436326.db2.gz SSWLAKJNUFMZHL-CVEARBPZSA-N 1 3 274.452 3.632 20 0 CHADHO CC[C@@H](NC[C@@H]1CCC[N@@H+](C(C)C)C1)c1cccs1 ZINC000125826059 1128454962 /nfs/dbraw/zinc/45/49/62/1128454962.db2.gz RSOBBWQJEPCQFG-LSDHHAIUSA-N 1 3 280.481 3.909 20 0 CHADHO CC[C@@H](NC[C@@H]1CCC[N@H+](C(C)C)C1)c1cccs1 ZINC000125826059 1128454963 /nfs/dbraw/zinc/45/49/63/1128454963.db2.gz RSOBBWQJEPCQFG-LSDHHAIUSA-N 1 3 280.481 3.909 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)c1cccs1 ZINC000125826059 1128454965 /nfs/dbraw/zinc/45/49/65/1128454965.db2.gz RSOBBWQJEPCQFG-LSDHHAIUSA-N 1 3 280.481 3.909 20 0 CHADHO Cc1cccc([C@H](C)[NH2+]C[C@@H]2CCCN(C(C)C)C2)c1 ZINC000125983052 1128459121 /nfs/dbraw/zinc/45/91/21/1128459121.db2.gz MASLQLBBWFPUHC-IRXDYDNUSA-N 1 3 274.452 3.766 20 0 CHADHO C(C1CCCCCC1)N1CCC([NH+]2CCCC2)CC1 ZINC000127767005 1128482444 /nfs/dbraw/zinc/48/24/44/1128482444.db2.gz KTSKQNLCOCJRCI-UHFFFAOYSA-N 1 3 264.457 3.517 20 0 CHADHO C(C1CCCCCC1)[NH+]1CCC(N2CCCC2)CC1 ZINC000127767005 1128482447 /nfs/dbraw/zinc/48/24/47/1128482447.db2.gz KTSKQNLCOCJRCI-UHFFFAOYSA-N 1 3 264.457 3.517 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)C1 ZINC000040623170 1128525646 /nfs/dbraw/zinc/52/56/46/1128525646.db2.gz SLSWYLUJORKMEP-XMTFNYHQSA-N 1 3 278.484 3.665 20 0 CHADHO [NH3+]C[C@@H](N[C@@H]1CCCc2c3ccccc3[nH]c21)C1CCCC1 ZINC000567724431 1128570191 /nfs/dbraw/zinc/57/01/91/1128570191.db2.gz PMUZOHNEDLGBTK-QZTJIDSGSA-N 1 3 297.446 3.652 20 0 CHADHO CC(C)c1ccc(C[N@@H+]2CCC[C@@H]3CN(C)CC[C@H]32)cc1 ZINC000570320069 1128621441 /nfs/dbraw/zinc/62/14/41/1128621441.db2.gz YCUDVRHGEFXMQP-RTBURBONSA-N 1 3 286.463 3.726 20 0 CHADHO CC(C)c1ccc(C[N@H+]2CCC[C@@H]3CN(C)CC[C@H]32)cc1 ZINC000570320069 1128621442 /nfs/dbraw/zinc/62/14/42/1128621442.db2.gz YCUDVRHGEFXMQP-RTBURBONSA-N 1 3 286.463 3.726 20 0 CHADHO CC(C)c1ccc(CN2CCC[C@@H]3C[N@H+](C)CC[C@H]32)cc1 ZINC000570320069 1128621443 /nfs/dbraw/zinc/62/14/43/1128621443.db2.gz YCUDVRHGEFXMQP-RTBURBONSA-N 1 3 286.463 3.726 20 0 CHADHO CC(C)c1ccc(CN2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)cc1 ZINC000570320069 1128621444 /nfs/dbraw/zinc/62/14/44/1128621444.db2.gz YCUDVRHGEFXMQP-RTBURBONSA-N 1 3 286.463 3.726 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H]2C[C@@H](C)c3ccccc32)C1 ZINC000574114194 1128661487 /nfs/dbraw/zinc/66/14/87/1128661487.db2.gz CGNWEACSLFOWJP-RKVPGOIHSA-N 1 3 272.436 3.556 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H]2C[C@@H](C)c3ccccc32)C1 ZINC000574114194 1128661490 /nfs/dbraw/zinc/66/14/90/1128661490.db2.gz CGNWEACSLFOWJP-RKVPGOIHSA-N 1 3 272.436 3.556 20 0 CHADHO CC[N@H+](Cc1cccs1)C1CCN(CC(C)C)CC1 ZINC001258018273 1128673166 /nfs/dbraw/zinc/67/31/66/1128673166.db2.gz ZYCDTCHGFRMUSS-UHFFFAOYSA-N 1 3 280.481 3.690 20 0 CHADHO CC[N@@H+](Cc1cccs1)C1CCN(CC(C)C)CC1 ZINC001258018273 1128673168 /nfs/dbraw/zinc/67/31/68/1128673168.db2.gz ZYCDTCHGFRMUSS-UHFFFAOYSA-N 1 3 280.481 3.690 20 0 CHADHO Cc1ccc([C@H](N[C@@H]2CC[N@@H+](C)C(C)(C)C2)C2CC2)cc1 ZINC000623352080 1117839545 /nfs/dbraw/zinc/83/95/45/1117839545.db2.gz ONQLTJKRLCQZEU-MSOLQXFVSA-N 1 3 286.463 3.909 20 0 CHADHO Cc1ccc([C@H](N[C@@H]2CC[N@H+](C)C(C)(C)C2)C2CC2)cc1 ZINC000623352080 1117839549 /nfs/dbraw/zinc/83/95/49/1117839549.db2.gz ONQLTJKRLCQZEU-MSOLQXFVSA-N 1 3 286.463 3.909 20 0 CHADHO Cc1cc(C)cc([C@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)c1 ZINC000624120946 1117985655 /nfs/dbraw/zinc/98/56/55/1117985655.db2.gz KOOBHLYFMIJLOT-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccccc1C1CC([NH2+]C[C@@H]2CCCCN(C)C2)C1 ZINC000624122105 1117985821 /nfs/dbraw/zinc/98/58/21/1117985821.db2.gz JWVRSUWZDDOULM-AOCRQIFASA-N 1 3 286.463 3.563 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccc(F)c(Cl)c1 ZINC000624120712 1117985947 /nfs/dbraw/zinc/98/59/47/1117985947.db2.gz FPMDBIBTOOTLDO-OLZOCXBDSA-N 1 3 298.833 3.862 20 0 CHADHO Cc1ccc(C)c([C@H](C)NC[C@H]2CCCC[N@H+](C)C2)c1 ZINC000624119458 1117986217 /nfs/dbraw/zinc/98/62/17/1117986217.db2.gz BMESHBQENRNSDY-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc(C)c([C@H](C)NC[C@H]2CCCC[N@@H+](C)C2)c1 ZINC000624119458 1117986221 /nfs/dbraw/zinc/98/62/21/1117986221.db2.gz BMESHBQENRNSDY-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc(C)c([C@H](C)[NH2+]C[C@H]2CCCCN(C)C2)c1 ZINC000624119458 1117986225 /nfs/dbraw/zinc/98/62/25/1117986225.db2.gz BMESHBQENRNSDY-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO C[C@@H](CCC(C)(C)C)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000624123960 1117986455 /nfs/dbraw/zinc/98/64/55/1117986455.db2.gz UTJJDTVWQWYLBJ-GJZGRUSLSA-N 1 3 254.462 3.523 20 0 CHADHO C[C@@H]1CC[C@@H](C[NH3+])CN1Cc1ccc(C2CCC2)cc1 ZINC001206811216 1118008611 /nfs/dbraw/zinc/00/86/11/1118008611.db2.gz RUNLZVVCGYYFSE-ZBFHGGJFSA-N 1 3 272.436 3.513 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]C[C@@H](C)Cc2ccccc2)C1 ZINC000182060549 1118012606 /nfs/dbraw/zinc/01/26/06/1118012606.db2.gz DVDMLAHUYYUNHQ-HKUYNNGSSA-N 1 3 288.479 3.575 20 0 CHADHO C[C@@H](CC[NH2+][C@@H](C)c1ccccc1)N1CCCCC1 ZINC000184503390 1118055074 /nfs/dbraw/zinc/05/50/74/1118055074.db2.gz WGPISIHYKZVJKC-HOTGVXAUSA-N 1 3 260.425 3.602 20 0 CHADHO Cc1ccc2nccc(NC3CC[NH+](C(C)C)CC3)c2c1 ZINC000185466594 1118062362 /nfs/dbraw/zinc/06/23/62/1118062362.db2.gz YDENPTWINWDUBX-UHFFFAOYSA-N 1 3 283.419 3.828 20 0 CHADHO CC[C@@H](c1ccc(F)cc1)N(C)C[C@H]1CCC[N@H+](C)C1 ZINC000247030012 1118065297 /nfs/dbraw/zinc/06/52/97/1118065297.db2.gz RBDBHVOXEIJBHP-YOEHRIQHSA-N 1 3 278.415 3.550 20 0 CHADHO CC[C@@H](c1ccc(F)cc1)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000247030012 1118065302 /nfs/dbraw/zinc/06/53/02/1118065302.db2.gz RBDBHVOXEIJBHP-YOEHRIQHSA-N 1 3 278.415 3.550 20 0 CHADHO C[C@@H](NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000076446139 1118072523 /nfs/dbraw/zinc/07/25/23/1118072523.db2.gz QDMKBJFKYUIRML-MJGOQNOKSA-N 1 3 294.442 3.859 20 0 CHADHO C[C@@H](NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000076446139 1118072528 /nfs/dbraw/zinc/07/25/28/1118072528.db2.gz QDMKBJFKYUIRML-MJGOQNOKSA-N 1 3 294.442 3.859 20 0 CHADHO Cc1cc2c(c(C)c1)[C@@H](NC1CC[NH+](CC3CC3)CC1)CC2 ZINC000655695172 1118187039 /nfs/dbraw/zinc/18/70/39/1118187039.db2.gz SOBVGBHEEBNIOL-IBGZPJMESA-N 1 3 298.474 3.755 20 0 CHADHO c1ccc2c(c1)C[C@@H]2C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000121589187 1118215773 /nfs/dbraw/zinc/21/57/73/1118215773.db2.gz SPJBQVQBAJLNCE-QGZVFWFLSA-N 1 3 298.474 3.713 20 0 CHADHO C(CN1CCC2(CCC2)CC1)C[NH+]1CCC2(CCC2)CC1 ZINC000671729914 1118315980 /nfs/dbraw/zinc/31/59/80/1118315980.db2.gz ZBDLPBOYVPQJBG-UHFFFAOYSA-N 1 3 290.495 3.909 20 0 CHADHO C[C@H]([NH2+]CC1CC(C)(C)C1)[C@H]1CCCN(C2CCC2)C1 ZINC000528439851 1118389531 /nfs/dbraw/zinc/38/95/31/1118389531.db2.gz IWYCXAUMWLMRHY-HOCLYGCPSA-N 1 3 278.484 3.665 20 0 CHADHO Clc1sccc1CN1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000656781973 1118654440 /nfs/dbraw/zinc/65/44/40/1118654440.db2.gz BKMXFRAGDHFNDG-ZDUSSCGKSA-N 1 3 298.883 3.613 20 0 CHADHO C[C@H]1C[C@H](C[NH3+])CN1Cc1cccc(C2CCCC2)c1 ZINC000656786768 1118658951 /nfs/dbraw/zinc/65/89/51/1118658951.db2.gz QHHCQELRTRFOSH-GOEBONIOSA-N 1 3 272.436 3.513 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2C[C@@H](C)CC[C@@H]2CC)C1 ZINC000430732713 1118764807 /nfs/dbraw/zinc/76/48/07/1118764807.db2.gz PYEXRVFNFFGMPE-VVLHAWIVSA-N 1 3 266.473 3.523 20 0 CHADHO CCC[C@@H]1C[C@H]1[NH2+][C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]12 ZINC000430749211 1118767018 /nfs/dbraw/zinc/76/70/18/1118767018.db2.gz INBHRYFWIRPGGD-LASHMREHSA-N 1 3 298.474 3.675 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000510756981 1118807186 /nfs/dbraw/zinc/80/71/86/1118807186.db2.gz UIIZUUKPIQAFBW-BRWVUGGUSA-N 1 3 284.463 3.759 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H]2CCC[C@H]2CCCF)C1 ZINC000510756010 1118807521 /nfs/dbraw/zinc/80/75/21/1118807521.db2.gz YHEINOBJKPMJBH-IKGGRYGDSA-N 1 3 284.463 3.615 20 0 CHADHO CC(C)(C)C[C@@H](N[C@@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000133714550 1118866606 /nfs/dbraw/zinc/86/66/06/1118866606.db2.gz JLLMRKUTMFKQBI-IAGOWNOFSA-N 1 3 274.452 3.896 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]C2CC(C)(C)CC(C)(C)C2)C1 ZINC000129704790 1118883495 /nfs/dbraw/zinc/88/34/95/1118883495.db2.gz OIWNDRPFSXCLDB-OAHLLOKOSA-N 1 3 280.500 3.911 20 0 CHADHO CC(C)(C[NH2+][C@H]1CCC[C@H]1CCCF)CN1CCCC1 ZINC000511031373 1118962575 /nfs/dbraw/zinc/96/25/75/1118962575.db2.gz QLPWTPHEXWBCTF-HOTGVXAUSA-N 1 3 284.463 3.616 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H]2C[C@@H](C)c3ccccc32)C1 ZINC000582383125 1119064377 /nfs/dbraw/zinc/06/43/77/1119064377.db2.gz MHZPQVAWNXHILB-GPMSIDNRSA-N 1 3 286.463 3.945 20 0 CHADHO CN(C)c1cc[nH+]cc1Nc1ccnc(C(C)(C)C)c1 ZINC001213162503 1119137718 /nfs/dbraw/zinc/13/77/18/1119137718.db2.gz DPCXBSKFHLXLEP-UHFFFAOYSA-N 1 3 270.380 3.584 20 0 CHADHO Cc1ccc([C@@H](C)C[N@@H+]2CCCC23CCN(C)CC3)cc1 ZINC000628244268 1128835490 /nfs/dbraw/zinc/83/54/90/1128835490.db2.gz ZOVLYDMZKGCITR-KRWDZBQOSA-N 1 3 286.463 3.659 20 0 CHADHO Cc1ccc([C@@H](C)C[N@H+]2CCCC23CCN(C)CC3)cc1 ZINC000628244268 1128835494 /nfs/dbraw/zinc/83/54/94/1128835494.db2.gz ZOVLYDMZKGCITR-KRWDZBQOSA-N 1 3 286.463 3.659 20 0 CHADHO Clc1ccc2c(c1)[C@H](NC1CC[NH+](C3CC3)CC1)CC2 ZINC000343112356 1119314884 /nfs/dbraw/zinc/31/48/84/1119314884.db2.gz XWMHPVNOVXCODL-QGZVFWFLSA-N 1 3 290.838 3.544 20 0 CHADHO CC[C@@H](N[C@@H]1CC[NH2+]CC(C)(C)C1)c1cccs1 ZINC000635008983 1119368772 /nfs/dbraw/zinc/36/87/72/1119368772.db2.gz FTLIYPKDGXRCJR-CHWSQXEVSA-N 1 3 266.454 3.567 20 0 CHADHO CCC[C@@H](NC[C@@H]1CC[N@H+](CCC)C1)c1ccccc1 ZINC000151094440 1119392770 /nfs/dbraw/zinc/39/27/70/1119392770.db2.gz NWRGRGQINNVIRD-FUHWJXTLSA-N 1 3 274.452 3.849 20 0 CHADHO CCC[C@@H](NC[C@@H]1CC[N@@H+](CCC)C1)c1ccccc1 ZINC000151094440 1119392773 /nfs/dbraw/zinc/39/27/73/1119392773.db2.gz NWRGRGQINNVIRD-FUHWJXTLSA-N 1 3 274.452 3.849 20 0 CHADHO CCC[C@@H]([NH2+]C[C@@H]1CCN(CCC)C1)c1ccccc1 ZINC000151094440 1119392777 /nfs/dbraw/zinc/39/27/77/1119392777.db2.gz NWRGRGQINNVIRD-FUHWJXTLSA-N 1 3 274.452 3.849 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@H](C)c1cc(C)sc1C ZINC000650758716 1119415670 /nfs/dbraw/zinc/41/56/70/1119415670.db2.gz WJVOBUMUMQZTNM-CYBMUJFWSA-N 1 3 288.460 3.935 20 0 CHADHO C[C@@H]1CC[N@@H+](C2CCC(c3ccccc3)CC2)C[C@H]1CN ZINC000253185775 1119451037 /nfs/dbraw/zinc/45/10/37/1119451037.db2.gz IFNJVPTVVDOOSW-ZTRSQXPZSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@@H]1CC[N@H+](C2CCC(c3ccccc3)CC2)C[C@H]1CN ZINC000253185775 1119451040 /nfs/dbraw/zinc/45/10/40/1119451040.db2.gz IFNJVPTVVDOOSW-ZTRSQXPZSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCc1cc(-c2ccccc2)cs1 ZINC000584409733 1119528696 /nfs/dbraw/zinc/52/86/96/1119528696.db2.gz DEHWUZZFRZJRSM-QWHCGFSZSA-N 1 3 274.433 3.631 20 0 CHADHO C([NH2+]C1CCN(C2CCCCC2)CC1)C1(C2CC2)CCC1 ZINC000090724358 1119549135 /nfs/dbraw/zinc/54/91/35/1119549135.db2.gz DBCJRQAUZHMLFX-UHFFFAOYSA-N 1 3 290.495 3.953 20 0 CHADHO C[C@@H]1CC[C@H](CN)C[N@@H+]1C1CCC2(CCCC2)CC1 ZINC000129784977 1119558627 /nfs/dbraw/zinc/55/86/27/1119558627.db2.gz PNEMRCWUWVFGAP-HUUCEWRRSA-N 1 3 264.457 3.549 20 0 CHADHO C[C@@H]1CC[C@H](CN)C[N@H+]1C1CCC2(CCCC2)CC1 ZINC000129784977 1119558628 /nfs/dbraw/zinc/55/86/28/1119558628.db2.gz PNEMRCWUWVFGAP-HUUCEWRRSA-N 1 3 264.457 3.549 20 0 CHADHO CCCc1ccc(C[NH2+]C2CCN(CC3CC3)CC2)cc1 ZINC000613266435 1119894426 /nfs/dbraw/zinc/89/44/26/1119894426.db2.gz CBPQRAOILURVRX-UHFFFAOYSA-N 1 3 286.463 3.603 20 0 CHADHO CCC(F)(F)C(C)(C)C[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000629531510 1128913877 /nfs/dbraw/zinc/91/38/77/1128913877.db2.gz NMAVIALTSPUILB-NSHDSACASA-N 1 3 299.409 3.571 20 0 CHADHO CC1(C)[C@@H](c2ccccc2)[C@@H]1N[C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000629515988 1128914273 /nfs/dbraw/zinc/91/42/73/1128914273.db2.gz YSARZAAVXOXKTO-QQXKLLMISA-N 1 3 298.474 3.689 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2cccs2)C1 ZINC000417336393 1120429497 /nfs/dbraw/zinc/42/94/97/1120429497.db2.gz HWQFPYVZLFMLLV-YHUYYLMFSA-N 1 3 292.492 3.562 20 0 CHADHO Clc1ccc2c(c1)CC[C@@H]2NC1CC[NH+](C2CC2)CC1 ZINC000119717197 1120480267 /nfs/dbraw/zinc/48/02/67/1120480267.db2.gz XNQNPFZLGWOELF-KRWDZBQOSA-N 1 3 290.838 3.544 20 0 CHADHO Cc1cc([C@H](C)[NH2+]CCCN2CCCCC2)c(C)s1 ZINC000019996643 1120559812 /nfs/dbraw/zinc/55/98/12/1120559812.db2.gz MQSJYUVCJSPAGG-AWEZNQCLSA-N 1 3 280.481 3.892 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[N@H+](C)CCCN1CCCC1 ZINC000499945003 1120560094 /nfs/dbraw/zinc/56/00/94/1120560094.db2.gz KEHDJRGUERNZQR-CQSZACIVSA-N 1 3 280.843 3.819 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)CCCN1CCCC1 ZINC000499945003 1120560099 /nfs/dbraw/zinc/56/00/99/1120560099.db2.gz KEHDJRGUERNZQR-CQSZACIVSA-N 1 3 280.843 3.819 20 0 CHADHO C[C@@H]1C[C@H](NCc2ccc(F)c3ccccc23)CC[N@@H+]1C ZINC000631079574 1120633273 /nfs/dbraw/zinc/63/32/73/1120633273.db2.gz IJFZTIUDRHUQQT-UKRRQHHQSA-N 1 3 286.394 3.551 20 0 CHADHO C[C@@H]1C[C@H](NCc2ccc(F)c3ccccc23)CC[N@H+]1C ZINC000631079574 1120633274 /nfs/dbraw/zinc/63/32/74/1120633274.db2.gz IJFZTIUDRHUQQT-UKRRQHHQSA-N 1 3 286.394 3.551 20 0 CHADHO C[C@H](CCN1C[C@@H]2CCCC[C@@H]21)[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660933785 1120704625 /nfs/dbraw/zinc/70/46/25/1120704625.db2.gz YIJZXIPBZJHRDV-FPSMNIFISA-N 1 3 276.468 3.514 20 0 CHADHO C[C@H](CCN1C[C@@H]2CCCC[C@@H]21)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660933785 1120704628 /nfs/dbraw/zinc/70/46/28/1120704628.db2.gz YIJZXIPBZJHRDV-FPSMNIFISA-N 1 3 276.468 3.514 20 0 CHADHO C[C@H](CC[N@@H+]1C[C@@H]2CCCC[C@@H]21)N1C[C@@H]2CCCC[C@@H]21 ZINC000660933785 1120704632 /nfs/dbraw/zinc/70/46/32/1120704632.db2.gz YIJZXIPBZJHRDV-FPSMNIFISA-N 1 3 276.468 3.514 20 0 CHADHO C[C@H](CC[N@H+]1C[C@@H]2CCCC[C@@H]21)N1C[C@@H]2CCCC[C@@H]21 ZINC000660933785 1120704635 /nfs/dbraw/zinc/70/46/35/1120704635.db2.gz YIJZXIPBZJHRDV-FPSMNIFISA-N 1 3 276.468 3.514 20 0 CHADHO Cc1cc(C)c(CN2CCC[C@]3(CCC[NH2+]C3)C2)c(C)c1 ZINC000228081393 1120761867 /nfs/dbraw/zinc/76/18/67/1120761867.db2.gz NQCFDCDLFOCIMX-IBGZPJMESA-N 1 3 286.463 3.577 20 0 CHADHO CC(C)C[C@H](N[C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(F)cc1 ZINC000652154380 1120792450 /nfs/dbraw/zinc/79/24/50/1120792450.db2.gz DDHAOJHSKNJQGL-OLMNPRSZSA-N 1 3 292.442 3.985 20 0 CHADHO CC(C)C[C@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(F)cc1 ZINC000652154380 1120792453 /nfs/dbraw/zinc/79/24/53/1120792453.db2.gz DDHAOJHSKNJQGL-OLMNPRSZSA-N 1 3 292.442 3.985 20 0 CHADHO CC(C)C1CCC([NH2+]C[C@@H]2CCN(C(C)C)C2)CC1 ZINC000054556273 1120868480 /nfs/dbraw/zinc/86/84/80/1120868480.db2.gz MAPIALJFMLIOIN-GTPINHCMSA-N 1 3 266.473 3.521 20 0 CHADHO CC(C)CN1CCC([NH2+]C[C@@H](C)c2ccccc2)CC1 ZINC000221810144 1120907640 /nfs/dbraw/zinc/90/76/40/1120907640.db2.gz ALMIDUCYOXSBTJ-MRXNPFEDSA-N 1 3 274.452 3.500 20 0 CHADHO C([NH2+][C@@H](C1CC1)C1CCCC1)[C@H]1CCCN(CC2CC2)C1 ZINC000663464999 1120979964 /nfs/dbraw/zinc/97/99/64/1120979964.db2.gz HWILUSWABPLYKU-VQIMIIECSA-N 1 3 290.495 3.667 20 0 CHADHO CC(C)[C@@H]1C[C@@H](N[C@@H]2CCC[NH2+]CC2)c2ccccc21 ZINC000643523060 1121005733 /nfs/dbraw/zinc/00/57/33/1121005733.db2.gz VYROMWUHMBVLGO-FHLIZLRMSA-N 1 3 272.436 3.603 20 0 CHADHO C1CCC([NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000006303255 1121019119 /nfs/dbraw/zinc/01/91/19/1121019119.db2.gz AAZDYYDSFVISJJ-UHFFFAOYSA-N 1 3 264.457 3.706 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N(C)Cc1cccc(F)c1F ZINC001167840757 1121052407 /nfs/dbraw/zinc/05/24/07/1121052407.db2.gz ILWXJVUPWWRNSR-AWEZNQCLSA-N 1 3 298.421 3.907 20 0 CHADHO CCCN1CCC([NH2+]Cc2cccc(C3CC3)c2)CC1 ZINC000094518149 1121209694 /nfs/dbraw/zinc/20/96/94/1121209694.db2.gz QMVNPESFLSHIAS-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO CC(C)(C)N1CCC([NH2+]Cc2ccc3cnccc3c2)CC1 ZINC000319069202 1121227506 /nfs/dbraw/zinc/22/75/06/1121227506.db2.gz NFXSYKZJASKHNO-UHFFFAOYSA-N 1 3 297.446 3.587 20 0 CHADHO CCC[NH+]1CCC(N[C@@H](c2ccccc2C)C2CC2)CC1 ZINC000675873264 1121377301 /nfs/dbraw/zinc/37/73/01/1121377301.db2.gz IIHCUIHHPJFSGG-LJQANCHMSA-N 1 3 286.463 3.910 20 0 CHADHO CC[C@@H](C[N@@H+]1CCC[C@H](N(C)C)CC1)c1ccccc1 ZINC000432816119 1121378861 /nfs/dbraw/zinc/37/88/61/1121378861.db2.gz NDSJZXAKLCRLQQ-WMZOPIPTSA-N 1 3 274.452 3.596 20 0 CHADHO CC[C@@H](C[N@H+]1CCC[C@H](N(C)C)CC1)c1ccccc1 ZINC000432816119 1121378868 /nfs/dbraw/zinc/37/88/68/1121378868.db2.gz NDSJZXAKLCRLQQ-WMZOPIPTSA-N 1 3 274.452 3.596 20 0 CHADHO C[C@@H](c1nc2ccccc2s1)N(C)CCCCCC[NH3+] ZINC000710684294 1121474411 /nfs/dbraw/zinc/47/44/11/1121474411.db2.gz ZUYPQHIGPYIGNJ-ZDUSSCGKSA-N 1 3 291.464 3.808 20 0 CHADHO CC1(C[NH2+][C@@H]2CCC[C@H]3CN(Cc4ccccc4)C[C@@H]32)CC1 ZINC000512632101 1121500074 /nfs/dbraw/zinc/50/00/74/1121500074.db2.gz WZFPPCMYKDZNHK-GBESFXJTSA-N 1 3 298.474 3.677 20 0 CHADHO C([NH2+]C1CCN(C2CCCCC2)CC1)[C@]12C[C@H]1CCC2 ZINC000922962554 1121500784 /nfs/dbraw/zinc/50/07/84/1121500784.db2.gz KWIDIXQRFMVTSQ-QAPCUYQASA-N 1 3 276.468 3.563 20 0 CHADHO Cc1cc(C)c(/C=C\C[NH2+]C[C@@H]2CCN(C3CC3)C2)c(C)c1 ZINC001177226680 1121719625 /nfs/dbraw/zinc/71/96/25/1121719625.db2.gz VKEUIPLXUFVTPL-XDXAGZTOSA-N 1 3 298.474 3.699 20 0 CHADHO CC(C)[NH+]1CCC(CN(C)Cc2cc(F)cc(F)c2)CC1 ZINC001204234709 1121838061 /nfs/dbraw/zinc/83/80/61/1121838061.db2.gz WNRADQVPEWJRDP-UHFFFAOYSA-N 1 3 296.405 3.517 20 0 CHADHO CCN(CCC[NH+](C)C)Cc1cccc2ccccc21 ZINC000501086769 1121951526 /nfs/dbraw/zinc/95/15/26/1121951526.db2.gz DSIMDVQKMJTAMP-UHFFFAOYSA-N 1 3 270.420 3.613 20 0 CHADHO CCN(Cc1cccc(C(F)F)c1)[C@H]1CCC[NH2+]CC1 ZINC000420303719 1121996988 /nfs/dbraw/zinc/99/69/88/1121996988.db2.gz DAZALAYLUMXSCF-HNNXBMFYSA-N 1 3 282.378 3.588 20 0 CHADHO Cc1cc([C@@H](C)[NH2+][C@H](CCN(C)C)C(C)(C)C)oc1C ZINC000502724718 1122143939 /nfs/dbraw/zinc/14/39/39/1122143939.db2.gz FWEIBLAWPPSVOO-CZUORRHYSA-N 1 3 280.456 3.913 20 0 CHADHO c1ccc([C@@H]2C[C@@H]2C[NH2+]C2CCN(C3CCCC3)CC2)cc1 ZINC000502983289 1122161762 /nfs/dbraw/zinc/16/17/62/1122161762.db2.gz AVTKGJNEYDMLCU-XLIONFOSSA-N 1 3 298.474 3.787 20 0 CHADHO C[C@@H]1CC[C@H](C)[C@H]([NH2+]C[C@H]2CCCN(CC3CC3)C2)C1 ZINC001183093438 1122206187 /nfs/dbraw/zinc/20/61/87/1122206187.db2.gz BQEAZAXEKJYOIP-CYGHRXIMSA-N 1 3 278.484 3.523 20 0 CHADHO C[C@]1([NH3+])CCCN(Cc2cccc3[nH]cc(Cl)c32)CC1 ZINC001205265155 1122220606 /nfs/dbraw/zinc/22/06/06/1122220606.db2.gz NYYBSERXTXXRRW-INIZCTEOSA-N 1 3 291.826 3.525 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H]2C[C@@H](C)c3c2cccc3C)C1 ZINC000504895199 1122309547 /nfs/dbraw/zinc/30/95/47/1122309547.db2.gz RMHDKDKTGVHYFW-NUJGCVRESA-N 1 3 286.463 3.865 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H]2C[C@@H](C)c3c2cccc3C)C1 ZINC000504895199 1122309552 /nfs/dbraw/zinc/30/95/52/1122309552.db2.gz RMHDKDKTGVHYFW-NUJGCVRESA-N 1 3 286.463 3.865 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](C)c2cccc(CC(C)C)c2)C1 ZINC000514104977 1122376110 /nfs/dbraw/zinc/37/61/10/1122376110.db2.gz NWEFUJBQPDIATK-SJLPKXTDSA-N 1 3 288.479 3.878 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](C)c2cccc(CC(C)C)c2)C1 ZINC000514104977 1122376117 /nfs/dbraw/zinc/37/61/17/1122376117.db2.gz NWEFUJBQPDIATK-SJLPKXTDSA-N 1 3 288.479 3.878 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](C)c2cccc(CC(C)C)c2)C1 ZINC000514104977 1122376119 /nfs/dbraw/zinc/37/61/19/1122376119.db2.gz NWEFUJBQPDIATK-SJLPKXTDSA-N 1 3 288.479 3.878 20 0 CHADHO C[C@H](C[N@@H+]1CC[C@H](CN2CCCCC2)C1)CC(C)(C)C ZINC001191070317 1122568025 /nfs/dbraw/zinc/56/80/25/1122568025.db2.gz KNKPQHFHGSOPHW-DLBZAZTESA-N 1 3 280.500 3.867 20 0 CHADHO C[C@H](C[N@H+]1CC[C@H](CN2CCCCC2)C1)CC(C)(C)C ZINC001191070317 1122568028 /nfs/dbraw/zinc/56/80/28/1122568028.db2.gz KNKPQHFHGSOPHW-DLBZAZTESA-N 1 3 280.500 3.867 20 0 CHADHO C[C@H]([NH2+][C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccc[nH]1 ZINC000775524309 1122640895 /nfs/dbraw/zinc/64/08/95/1122640895.db2.gz FLZRKXRPWHXYKG-XYJFISCASA-N 1 3 297.446 3.576 20 0 CHADHO NCCC[NH2+]C(CCc1ccccc1)CCc1ccccc1 ZINC000437779151 1122654438 /nfs/dbraw/zinc/65/44/38/1122654438.db2.gz TXSMDILGCFPDTR-UHFFFAOYSA-N 1 3 296.458 3.559 20 0 CHADHO CCC[C@@H](CCc1ccccc1)[NH2+]C[C@H](C)CN(C)C ZINC000425947149 1122675899 /nfs/dbraw/zinc/67/58/99/1122675899.db2.gz RMCQLXZFXYMJAV-WMZOPIPTSA-N 1 3 276.468 3.575 20 0 CHADHO Cc1ccc2cc([C@@H](C)NCC3=CC[N@H+](C)CC3)oc2c1 ZINC000426061617 1122710584 /nfs/dbraw/zinc/71/05/84/1122710584.db2.gz KTFQWMLZSFJONH-CQSZACIVSA-N 1 3 284.403 3.654 20 0 CHADHO Cc1ccc2cc([C@@H](C)NCC3=CC[N@@H+](C)CC3)oc2c1 ZINC000426061617 1122710590 /nfs/dbraw/zinc/71/05/90/1122710590.db2.gz KTFQWMLZSFJONH-CQSZACIVSA-N 1 3 284.403 3.654 20 0 CHADHO CC[C@H](C)C[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167966604 1122837822 /nfs/dbraw/zinc/83/78/22/1122837822.db2.gz XFGUAJSRWFLBBU-RLHTVVPMSA-N 1 3 278.484 3.806 20 0 CHADHO CC[C@@H](C)C[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167966601 1122838782 /nfs/dbraw/zinc/83/87/82/1122838782.db2.gz XFGUAJSRWFLBBU-ODLRDIKDSA-N 1 3 278.484 3.806 20 0 CHADHO CC[C@@H](C)C[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167966600 1122838972 /nfs/dbraw/zinc/83/89/72/1122838972.db2.gz XFGUAJSRWFLBBU-IZVVFDKHSA-N 1 3 278.484 3.806 20 0 CHADHO CC1(C)CCCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167975270 1122878169 /nfs/dbraw/zinc/87/81/69/1122878169.db2.gz NIJXIARYMWDTGG-FBVQUNGASA-N 1 3 290.495 3.950 20 0 CHADHO C[C@H]1CCCC[N@@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C1 ZINC001167983306 1122905666 /nfs/dbraw/zinc/90/56/66/1122905666.db2.gz FKXSRQOIDREDDL-QTXGHNMQSA-N 1 3 276.468 3.514 20 0 CHADHO C[C@H]1CCCC[N@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C1 ZINC001167983306 1122905668 /nfs/dbraw/zinc/90/56/68/1122905668.db2.gz FKXSRQOIDREDDL-QTXGHNMQSA-N 1 3 276.468 3.514 20 0 CHADHO CC[C@@H](C)[C@@H](C)N1CCC(CC)([NH+]2CCCC2)CC1 ZINC001196728075 1122930646 /nfs/dbraw/zinc/93/06/46/1122930646.db2.gz UBUGRNAUCASTQS-HZPDHXFCSA-N 1 3 266.473 3.761 20 0 CHADHO Cc1cccc([C@H]([NH2+]CC[C@H]2CCCN2C)C(C)C)c1 ZINC001196781364 1122933888 /nfs/dbraw/zinc/93/38/88/1122933888.db2.gz ACNYZZOUBNKQSP-QZTJIDSGSA-N 1 3 274.452 3.766 20 0 CHADHO Cc1cccc([C@H](NCC[C@H]2CCC[N@@H+]2C)C(C)C)c1 ZINC001196781364 1122933890 /nfs/dbraw/zinc/93/38/90/1122933890.db2.gz ACNYZZOUBNKQSP-QZTJIDSGSA-N 1 3 274.452 3.766 20 0 CHADHO Cc1cccc([C@H](NCC[C@H]2CCC[N@H+]2C)C(C)C)c1 ZINC001196781364 1122933893 /nfs/dbraw/zinc/93/38/93/1122933893.db2.gz ACNYZZOUBNKQSP-QZTJIDSGSA-N 1 3 274.452 3.766 20 0 CHADHO Cc1cccc(C[N@H+]2CCCC[C@@H]2C[C@@H]2CCCN2C)c1 ZINC001203894986 1122981893 /nfs/dbraw/zinc/98/18/93/1122981893.db2.gz PQCRGYIDHIAEGL-RBUKOAKNSA-N 1 3 286.463 3.834 20 0 CHADHO Cc1cccc(C[N@@H+]2CCCC[C@@H]2C[C@@H]2CCCN2C)c1 ZINC001203894986 1122981894 /nfs/dbraw/zinc/98/18/94/1122981894.db2.gz PQCRGYIDHIAEGL-RBUKOAKNSA-N 1 3 286.463 3.834 20 0 CHADHO Cc1cccc(CN2CCCC[C@@H]2C[C@@H]2CCC[N@H+]2C)c1 ZINC001203894986 1122981895 /nfs/dbraw/zinc/98/18/95/1122981895.db2.gz PQCRGYIDHIAEGL-RBUKOAKNSA-N 1 3 286.463 3.834 20 0 CHADHO Cc1cccc(CN2CCCC[C@@H]2C[C@@H]2CCC[N@@H+]2C)c1 ZINC001203894986 1122981896 /nfs/dbraw/zinc/98/18/96/1122981896.db2.gz PQCRGYIDHIAEGL-RBUKOAKNSA-N 1 3 286.463 3.834 20 0 CHADHO C/C(=C/c1ccc(Cl)cc1)CNCC(C)(C)C[NH+](C)C ZINC001198959103 1123017497 /nfs/dbraw/zinc/01/74/97/1123017497.db2.gz IQEKBQGFBDPQTI-UVTDQMKNSA-N 1 3 294.870 3.921 20 0 CHADHO C[C@H](CC[N@@H+]1CCC[C@H](CN)[C@@H]1C)CC(C)(C)C ZINC001205905166 1123069908 /nfs/dbraw/zinc/06/99/08/1123069908.db2.gz ZDNHALHDCWEQCT-QLFBSQMISA-N 1 3 254.462 3.508 20 0 CHADHO C[C@H](CC[N@H+]1CCC[C@H](CN)[C@@H]1C)CC(C)(C)C ZINC001205905166 1123069914 /nfs/dbraw/zinc/06/99/14/1123069914.db2.gz ZDNHALHDCWEQCT-QLFBSQMISA-N 1 3 254.462 3.508 20 0 CHADHO CC[C@@H]1CCCC[N@@H+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167995310 1123106077 /nfs/dbraw/zinc/10/60/77/1123106077.db2.gz ZTBDIWIPDNBAPH-HRBLRVMOSA-N 1 3 276.468 3.656 20 0 CHADHO CC[C@@H]1CCCC[N@H+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167995310 1123106080 /nfs/dbraw/zinc/10/60/80/1123106080.db2.gz ZTBDIWIPDNBAPH-HRBLRVMOSA-N 1 3 276.468 3.656 20 0 CHADHO CCC(CC)C[N@@H+]1CCCC[C@H]1C[C@@H]1CCCN1C ZINC001201536327 1123115851 /nfs/dbraw/zinc/11/58/51/1123115851.db2.gz YHCAKYOHHDKTDN-IRXDYDNUSA-N 1 3 266.473 3.761 20 0 CHADHO CCC(CC)C[N@H+]1CCCC[C@H]1C[C@@H]1CCCN1C ZINC001201536327 1123115853 /nfs/dbraw/zinc/11/58/53/1123115853.db2.gz YHCAKYOHHDKTDN-IRXDYDNUSA-N 1 3 266.473 3.761 20 0 CHADHO CCCC[C@H](CC)C[NH+]1CCC(N(C)C2CC2)CC1 ZINC001201567612 1123125734 /nfs/dbraw/zinc/12/57/34/1123125734.db2.gz GICYEXHGBHWZMS-HNNXBMFYSA-N 1 3 266.473 3.761 20 0 CHADHO CCCC[C@H](CC)CN1CCC([N@H+](C)C2CC2)CC1 ZINC001201567612 1123125736 /nfs/dbraw/zinc/12/57/36/1123125736.db2.gz GICYEXHGBHWZMS-HNNXBMFYSA-N 1 3 266.473 3.761 20 0 CHADHO CCCC[C@H](CC)CN1CCC([N@@H+](C)C2CC2)CC1 ZINC001201567612 1123125737 /nfs/dbraw/zinc/12/57/37/1123125737.db2.gz GICYEXHGBHWZMS-HNNXBMFYSA-N 1 3 266.473 3.761 20 0 CHADHO C(CN1CCCC1)[C@H]1CCCC[N@@H+]1CC1CCCC1 ZINC001202167786 1123180275 /nfs/dbraw/zinc/18/02/75/1123180275.db2.gz VBODFQZVFRITIX-QGZVFWFLSA-N 1 3 264.457 3.517 20 0 CHADHO C(CN1CCCC1)[C@H]1CCCC[N@H+]1CC1CCCC1 ZINC001202167786 1123180278 /nfs/dbraw/zinc/18/02/78/1123180278.db2.gz VBODFQZVFRITIX-QGZVFWFLSA-N 1 3 264.457 3.517 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@@H+]1CC1CCCC1 ZINC001202178559 1123182178 /nfs/dbraw/zinc/18/21/78/1123182178.db2.gz VKRCIJNZKSYWEK-DLBZAZTESA-N 1 3 264.457 3.515 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@H+]1CC1CCCC1 ZINC001202178559 1123182181 /nfs/dbraw/zinc/18/21/81/1123182181.db2.gz VKRCIJNZKSYWEK-DLBZAZTESA-N 1 3 264.457 3.515 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCc1ccc(-c2cccs2)cc1 ZINC000665237536 1123238534 /nfs/dbraw/zinc/23/85/34/1123238534.db2.gz CUPFHCGOPZJVPC-STQMWFEESA-N 1 3 274.433 3.631 20 0 CHADHO Cc1cccc2c1CCC[C@H]2NC1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000850573657 1123295327 /nfs/dbraw/zinc/29/53/27/1123295327.db2.gz PCGJIGZQNXHYBK-IHBAFOEMSA-N 1 3 284.447 3.587 20 0 CHADHO Cc1cccc2c1CCC[C@H]2NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000850573657 1123295334 /nfs/dbraw/zinc/29/53/34/1123295334.db2.gz PCGJIGZQNXHYBK-IHBAFOEMSA-N 1 3 284.447 3.587 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@H](C)C1CCCCC1 ZINC000665284047 1123316001 /nfs/dbraw/zinc/31/60/01/1123316001.db2.gz ZMNBZCMGQYYFSN-KBPBESRZSA-N 1 3 289.467 3.716 20 0 CHADHO F[C@@H]1CCC[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000335383551 1123367558 /nfs/dbraw/zinc/36/75/58/1123367558.db2.gz AZVFNWDFPWNFGP-GDBMZVCRSA-N 1 3 282.447 3.654 20 0 CHADHO c1ccc([C@@H]2CC[C@@H](C[N@@H+]3CC[C@@]4(C3)CCCNC4)C2)cc1 ZINC000852748419 1123415029 /nfs/dbraw/zinc/41/50/29/1123415029.db2.gz VDBVCKLLYXYBRE-RLLQIKCJSA-N 1 3 298.474 3.646 20 0 CHADHO c1ccc([C@@H]2CC[C@@H](C[N@H+]3CC[C@@]4(C3)CCCNC4)C2)cc1 ZINC000852748419 1123415033 /nfs/dbraw/zinc/41/50/33/1123415033.db2.gz VDBVCKLLYXYBRE-RLLQIKCJSA-N 1 3 298.474 3.646 20 0 CHADHO CCc1ccc(C[NH2+]C2CCN(C(C)(C)C)CC2)s1 ZINC000051718606 1123469422 /nfs/dbraw/zinc/46/94/22/1123469422.db2.gz LGUNKRSUUGKJMW-UHFFFAOYSA-N 1 3 280.481 3.663 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1NCc1ccc2ccccc2c1 ZINC000157307541 1129126706 /nfs/dbraw/zinc/12/67/06/1129126706.db2.gz DDKLNRFRMRWSHR-VCBZYWHSSA-N 1 3 282.431 3.658 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1NCc1ccc2ccccc2c1 ZINC000157307541 1129126707 /nfs/dbraw/zinc/12/67/07/1129126707.db2.gz DDKLNRFRMRWSHR-VCBZYWHSSA-N 1 3 282.431 3.658 20 0 CHADHO C[C@H](N[C@H]1CCCC[C@H]1C[NH3+])c1cccc(Cl)c1 ZINC000147865625 1123560740 /nfs/dbraw/zinc/56/07/40/1123560740.db2.gz MUZQWDAOIPKCBH-WHOFXGATSA-N 1 3 266.816 3.508 20 0 CHADHO CN(C)[C@@H]1CCC[N@H+](Cc2ccc3ccccc3c2)CC1 ZINC000429540769 1123585185 /nfs/dbraw/zinc/58/51/85/1123585185.db2.gz UANHFAFGOMPVDE-LJQANCHMSA-N 1 3 282.431 3.756 20 0 CHADHO CN(C)[C@@H]1CCC[N@@H+](Cc2ccc3ccccc3c2)CC1 ZINC000429540769 1123585189 /nfs/dbraw/zinc/58/51/89/1123585189.db2.gz UANHFAFGOMPVDE-LJQANCHMSA-N 1 3 282.431 3.756 20 0 CHADHO C[C@@H](CNc1ccnc2ccccc21)C[NH+]1CCCCC1 ZINC000041720954 1123594586 /nfs/dbraw/zinc/59/45/86/1123594586.db2.gz GROLWXKHQQTXPN-HNNXBMFYSA-N 1 3 283.419 3.769 20 0 CHADHO CC[C@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccc(Cl)s1 ZINC000158243901 1129142411 /nfs/dbraw/zinc/14/24/11/1129142411.db2.gz MVMOLLFHIYSQQX-RYUDHWBXSA-N 1 3 286.872 3.784 20 0 CHADHO CC[C@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccc(Cl)s1 ZINC000158243901 1129142413 /nfs/dbraw/zinc/14/24/13/1129142413.db2.gz MVMOLLFHIYSQQX-RYUDHWBXSA-N 1 3 286.872 3.784 20 0 CHADHO C[C@H]1C[C@H](C[NH3+])CN1Cc1cc(-c2ccccc2)cs1 ZINC000469860036 1123757588 /nfs/dbraw/zinc/75/75/88/1123757588.db2.gz DRITXTWZOYNUOG-UONOGXRCSA-N 1 3 286.444 3.584 20 0 CHADHO CN1CCC2(CCC[N@@H+]2CC2CCC(C)(C)CC2)CC1 ZINC000475113597 1123796498 /nfs/dbraw/zinc/79/64/98/1123796498.db2.gz DUWWPTKPVABPFY-UHFFFAOYSA-N 1 3 278.484 3.763 20 0 CHADHO CN1CCC2(CCC[N@H+]2CC2CCC(C)(C)CC2)CC1 ZINC000475113597 1123796502 /nfs/dbraw/zinc/79/65/02/1123796502.db2.gz DUWWPTKPVABPFY-UHFFFAOYSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@@]1(N)CC[N@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001204782673 1123811948 /nfs/dbraw/zinc/81/19/48/1123811948.db2.gz IJWAXLFEFDOYEN-GOSISDBHSA-N 1 3 296.439 3.978 20 0 CHADHO C[C@@]1(N)CC[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001204782673 1123811955 /nfs/dbraw/zinc/81/19/55/1123811955.db2.gz IJWAXLFEFDOYEN-GOSISDBHSA-N 1 3 296.439 3.978 20 0 CHADHO CN(C)C1CC[NH+](CCCCc2cccc(Cl)c2)CC1 ZINC000621246518 1129152652 /nfs/dbraw/zinc/15/26/52/1129152652.db2.gz GOAAURSUBIZKGP-UHFFFAOYSA-N 1 3 294.870 3.689 20 0 CHADHO Cc1ccc(CN[C@@H](CC(C)C)C[NH+]2CCCC2)c(C)c1 ZINC001202513640 1123932936 /nfs/dbraw/zinc/93/29/36/1123932936.db2.gz PSFCOMONJHWYTM-IBGZPJMESA-N 1 3 288.479 3.904 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CCCc2ccccc2F)CC1 ZINC000475562240 1124011913 /nfs/dbraw/zinc/01/19/13/1124011913.db2.gz NFGBSHXICHEWFO-UHFFFAOYSA-N 1 3 292.442 3.611 20 0 CHADHO CCN(CCC[NH+]1CCCCC1)[C@H](C)Cc1ccsc1 ZINC000444632285 1124046522 /nfs/dbraw/zinc/04/65/22/1124046522.db2.gz ZBWYGXYSSLZROW-MRXNPFEDSA-N 1 3 294.508 3.877 20 0 CHADHO C[N@H+](CCCN1CCCCC1)CC1(c2ccccc2)CC1 ZINC000444684118 1124053589 /nfs/dbraw/zinc/05/35/89/1124053589.db2.gz KJSLJBISFXDNTD-UHFFFAOYSA-N 1 3 286.463 3.526 20 0 CHADHO C[N@@H+](CCCN1CCCCC1)CC1(c2ccccc2)CC1 ZINC000444684118 1124053594 /nfs/dbraw/zinc/05/35/94/1124053594.db2.gz KJSLJBISFXDNTD-UHFFFAOYSA-N 1 3 286.463 3.526 20 0 CHADHO CC1(C)C[NH2+]CC[C@@H](N[C@H](c2ccccc2)C2CC2)C1 ZINC000635008477 1129170553 /nfs/dbraw/zinc/17/05/53/1129170553.db2.gz DXDQOXZEZPXDSU-IAGOWNOFSA-N 1 3 272.436 3.506 20 0 CHADHO Cc1cc([C@H](C)[NH2+]CC2(CN(C)C)CCCC2)c(C)o1 ZINC000447599211 1124497996 /nfs/dbraw/zinc/49/79/96/1124497996.db2.gz JKSJNHGEVYRGJF-AWEZNQCLSA-N 1 3 278.440 3.669 20 0 CHADHO CC(C)CCC[NH2+]C1CCN(CC2CCCC2)CC1 ZINC000527355299 1124571246 /nfs/dbraw/zinc/57/12/46/1124571246.db2.gz HDEAZECFKPBTOI-UHFFFAOYSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@H](Cc1coc2ccccc12)N[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000449091055 1124649315 /nfs/dbraw/zinc/64/93/15/1124649315.db2.gz OZTVGBVUVSAXRB-OIISXLGYSA-N 1 3 298.430 3.580 20 0 CHADHO C[C@H](Cc1coc2ccccc12)N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000449091055 1124649317 /nfs/dbraw/zinc/64/93/17/1124649317.db2.gz OZTVGBVUVSAXRB-OIISXLGYSA-N 1 3 298.430 3.580 20 0 CHADHO C[C@@H](CC(C)(C)C)[NH2+]C1CCN(C2CCCC2)CC1 ZINC000449183680 1124667136 /nfs/dbraw/zinc/66/71/36/1124667136.db2.gz LEMZUNRHYZGXDF-AWEZNQCLSA-N 1 3 266.473 3.808 20 0 CHADHO C(=C/c1ccccc1)\CCN1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000450429943 1125022658 /nfs/dbraw/zinc/02/26/58/1125022658.db2.gz OGFXQAUBXCEISO-KBMDHIKASA-N 1 3 284.447 3.508 20 0 CHADHO C[N@H+](CC1CC1)C[C@H]1CCN(CC/C=C\c2ccccc2)C1 ZINC000450459106 1125035432 /nfs/dbraw/zinc/03/54/32/1125035432.db2.gz ZRGCURRDFKBSFK-FMSOUQGNSA-N 1 3 298.474 3.754 20 0 CHADHO C[N@@H+](CC1CC1)C[C@H]1CCN(CC/C=C\c2ccccc2)C1 ZINC000450459106 1125035440 /nfs/dbraw/zinc/03/54/40/1125035440.db2.gz ZRGCURRDFKBSFK-FMSOUQGNSA-N 1 3 298.474 3.754 20 0 CHADHO c1ccc([C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CCNC23CCC3)cc1 ZINC000530177151 1125129857 /nfs/dbraw/zinc/12/98/57/1125129857.db2.gz HRUPILPMQWZXIQ-OKZBNKHCSA-N 1 3 284.447 3.587 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2c(C)cc(C)cc2C)C[C@@H]1C ZINC000531139903 1125197188 /nfs/dbraw/zinc/19/71/88/1125197188.db2.gz BQXAETJUODIXPL-ROUUACIJSA-N 1 3 288.479 3.916 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2c(C)cc(C)cc2C)C[C@@H]1C ZINC000531139903 1125197190 /nfs/dbraw/zinc/19/71/90/1125197190.db2.gz BQXAETJUODIXPL-ROUUACIJSA-N 1 3 288.479 3.916 20 0 CHADHO CCCC[C@H](Cc1ccccc1)[NH2+]C1(C)CCNCC1 ZINC001246129169 1131344089 /nfs/dbraw/zinc/34/40/89/1131344089.db2.gz QHEAYXRWVLHWLZ-QGZVFWFLSA-N 1 3 274.452 3.520 20 0 CHADHO CS[C@H]1CCC[C@@H]([NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000129379366 1125331424 /nfs/dbraw/zinc/33/14/24/1125331424.db2.gz HDUMDHBBEKLAFB-WBVHZDCISA-N 1 3 296.524 3.657 20 0 CHADHO Cc1ccc(CN2CCC([C@@H]3CCC[NH2+]3)CC2)c(Cl)c1 ZINC000235998863 1125440423 /nfs/dbraw/zinc/44/04/23/1125440423.db2.gz AEBHWHTZKUQADI-KRWDZBQOSA-N 1 3 292.854 3.612 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+][C@H](c1ccccc1)C1CCC1 ZINC000348267281 1125453083 /nfs/dbraw/zinc/45/30/83/1125453083.db2.gz PUGGNPFLRWNURP-QZTJIDSGSA-N 1 3 272.436 3.602 20 0 CHADHO C[N@@H+]1CCC[C@@H]1CCN[C@H](c1ccccc1)C1CCC1 ZINC000348267281 1125453085 /nfs/dbraw/zinc/45/30/85/1125453085.db2.gz PUGGNPFLRWNURP-QZTJIDSGSA-N 1 3 272.436 3.602 20 0 CHADHO C[N@H+]1CCC[C@@H]1CCN[C@H](c1ccccc1)C1CCC1 ZINC000348267281 1125453087 /nfs/dbraw/zinc/45/30/87/1125453087.db2.gz PUGGNPFLRWNURP-QZTJIDSGSA-N 1 3 272.436 3.602 20 0 CHADHO CSC(C)(C)C[C@H](C)[NH2+]CCCN1CCCC[C@H]1C ZINC001258320842 1129193988 /nfs/dbraw/zinc/19/39/88/1129193988.db2.gz FSKPCWIGSPUKBW-LSDHHAIUSA-N 1 3 286.529 3.761 20 0 CHADHO NC[C@H]1CCC[C@H]1[NH2+]CCc1ccc(-c2ccccc2)cc1 ZINC000643467723 1129442290 /nfs/dbraw/zinc/44/22/90/1129442290.db2.gz XGGPLUBUFGTDBF-WOJBJXKFSA-N 1 3 294.442 3.613 20 0 CHADHO CC[C@@H]([NH2+][C@H](C)c1ccc(CN)nc1C)C1CCCCC1 ZINC000643462357 1129442338 /nfs/dbraw/zinc/44/23/38/1129442338.db2.gz FBELGJNWJQDOSE-RDTXWAMCSA-N 1 3 289.467 3.858 20 0 CHADHO CCC[C@@H]([NH2+]C[C@@H](C)N)c1ccc(Cl)c(Cl)c1 ZINC000643528909 1129444512 /nfs/dbraw/zinc/44/45/12/1129444512.db2.gz QUBVXDZCIJBUKA-NOZJJQNGSA-N 1 3 275.223 3.771 20 0 CHADHO Cc1ccccc1C[C@H]([NH2+][C@@H]1CCNC2(CCC2)C1)C1CC1 ZINC000643547472 1129445208 /nfs/dbraw/zinc/44/52/08/1129445208.db2.gz FXSMSMJTWLXTRS-MOPGFXCFSA-N 1 3 298.474 3.580 20 0 CHADHO C[C@@H]([C@H](C)[NH2+][C@@H]1CCNC2(CCC2)C1)C1CCCCC1 ZINC000643546867 1129445518 /nfs/dbraw/zinc/44/55/18/1129445518.db2.gz VZCDHCMBYYHSDY-YQQAZPJKSA-N 1 3 278.484 3.856 20 0 CHADHO CC(C)C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCNC3(CCC3)C2)C1 ZINC000643548672 1129445922 /nfs/dbraw/zinc/44/59/22/1129445922.db2.gz SXQKHRHQLYSTLQ-GVDBMIGSSA-N 1 3 278.484 3.856 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H]2CC[C@H]3CCCC[C@H]3C2)C1 ZINC000250520316 1129483443 /nfs/dbraw/zinc/48/34/43/1129483443.db2.gz SLSWYLUJORKMEP-ZJPYXAASSA-N 1 3 278.484 3.665 20 0 CHADHO CCN(C)C1CC[NH+]([C@H]2C[C@@H](C)CC(C)(C)C2)CC1 ZINC001258705722 1129536836 /nfs/dbraw/zinc/53/68/36/1129536836.db2.gz YIIKRFXBEBCQEB-ZBFHGGJFSA-N 1 3 266.473 3.617 20 0 CHADHO CCC[N@H+](Cc1ccccc1C1CC1)C1CCNCC1 ZINC000647484466 1129579254 /nfs/dbraw/zinc/57/92/54/1129579254.db2.gz MTEIGIKAPDFQDR-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO CCC[N@@H+](Cc1ccccc1C1CC1)C1CCNCC1 ZINC000647484466 1129579257 /nfs/dbraw/zinc/57/92/57/1129579257.db2.gz MTEIGIKAPDFQDR-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO CCCN(Cc1ccccc1C1CC1)C1CC[NH2+]CC1 ZINC000647484466 1129579258 /nfs/dbraw/zinc/57/92/58/1129579258.db2.gz MTEIGIKAPDFQDR-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO Clc1cccc([C@@H](NC[C@@H]2CC[NH2+]C2)C2CCCC2)c1 ZINC000647992099 1129591031 /nfs/dbraw/zinc/59/10/31/1129591031.db2.gz FLBUNXRSRDOKGF-DYVFJYSZSA-N 1 3 292.854 3.770 20 0 CHADHO Cc1nc2ccc(Nc3c[nH+]ccc3N3CCCC3)cc2[nH]1 ZINC001213073171 1129618276 /nfs/dbraw/zinc/61/82/76/1129618276.db2.gz HPPBCQBRJSCRPT-UHFFFAOYSA-N 1 3 293.374 3.610 20 0 CHADHO C[C@H](N[C@H](c1ccco1)c1ccccc1)C1CC[NH+](C)CC1 ZINC000387341337 1129654062 /nfs/dbraw/zinc/65/40/62/1129654062.db2.gz WFWYTUXPFIHUOE-KXBFYZLASA-N 1 3 298.430 3.689 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@H](NCc1cccc3ccccc31)C2 ZINC001169077960 1129697392 /nfs/dbraw/zinc/69/73/92/1129697392.db2.gz CKDFJJVMCLZJRS-NNZMDNLPSA-N 1 3 280.415 3.555 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](NCc1cccc3ccccc31)C2 ZINC001169077960 1129697394 /nfs/dbraw/zinc/69/73/94/1129697394.db2.gz CKDFJJVMCLZJRS-NNZMDNLPSA-N 1 3 280.415 3.555 20 0 CHADHO CN1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1(c3ccc(Cl)cc3)CC1)C2 ZINC001169082387 1129698186 /nfs/dbraw/zinc/69/81/86/1129698186.db2.gz ZBTFUENNEDDIII-PHZGNYQRSA-N 1 3 290.838 3.544 20 0 CHADHO CC[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cc(C)ccc1C ZINC001169118046 1129700665 /nfs/dbraw/zinc/70/06/65/1129700665.db2.gz CHDBQHLOVBOBGA-VXIBKDFQSA-N 1 3 286.463 3.969 20 0 CHADHO CC[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc(C)ccc1C ZINC001169118046 1129700667 /nfs/dbraw/zinc/70/06/67/1129700667.db2.gz CHDBQHLOVBOBGA-VXIBKDFQSA-N 1 3 286.463 3.969 20 0 CHADHO CC1(C)C[C@H](Nc2c[nH]cc3ccnc2-3)C[C@@](C)(C[NH3+])C1 ZINC001169142520 1129704019 /nfs/dbraw/zinc/70/40/19/1129704019.db2.gz HCBJSJZXTJRQTP-SUMWQHHRSA-N 1 3 286.423 3.519 20 0 CHADHO CC1(C)C[C@H](Nc2cncc3cc[nH]c32)C[C@@](C)(C[NH3+])C1 ZINC001169142520 1129704022 /nfs/dbraw/zinc/70/40/22/1129704022.db2.gz HCBJSJZXTJRQTP-SUMWQHHRSA-N 1 3 286.423 3.519 20 0 CHADHO Cc1ccc(C)c([C@H](C)N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1 ZINC001169115512 1129704469 /nfs/dbraw/zinc/70/44/69/1129704469.db2.gz KHZXEXSNKYPFTO-LUKYLMHMSA-N 1 3 272.436 3.579 20 0 CHADHO Cc1ccc(C)c([C@H](C)N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1 ZINC001169115512 1129704471 /nfs/dbraw/zinc/70/44/71/1129704471.db2.gz KHZXEXSNKYPFTO-LUKYLMHMSA-N 1 3 272.436 3.579 20 0 CHADHO CC1(C)C[C@H](Nc2c[nH]cc3ccnc2-3)C[C@](C)(C[NH3+])C1 ZINC001169142518 1129704605 /nfs/dbraw/zinc/70/46/05/1129704605.db2.gz HCBJSJZXTJRQTP-GUYCJALGSA-N 1 3 286.423 3.519 20 0 CHADHO CC1(C)C[C@H](Nc2cncc3cc[nH]c32)C[C@](C)(C[NH3+])C1 ZINC001169142518 1129704608 /nfs/dbraw/zinc/70/46/08/1129704608.db2.gz HCBJSJZXTJRQTP-GUYCJALGSA-N 1 3 286.423 3.519 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](N1CCC[C@@H]1c1cccc(F)c1)C2 ZINC001169142442 1129704785 /nfs/dbraw/zinc/70/47/85/1129704785.db2.gz USYUIFQTQFKZET-VSZNYVQBSA-N 1 3 288.410 3.588 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](N1CCC[C@@H]1c1cccc(F)c1)C2 ZINC001169142442 1129704787 /nfs/dbraw/zinc/70/47/87/1129704787.db2.gz USYUIFQTQFKZET-VSZNYVQBSA-N 1 3 288.410 3.588 20 0 CHADHO C[C@H](N[C@H]1C[C@H](C[NH3+])C1)c1cc(F)c(Cl)cc1Cl ZINC000902488296 1130017205 /nfs/dbraw/zinc/01/72/05/1130017205.db2.gz LMOLQQZJPORTIM-CIUDSAMLSA-N 1 3 291.197 3.520 20 0 CHADHO CCCC(CCC)N[C@@H](CC[NH+](C)C)c1cccnc1 ZINC000903384996 1130170028 /nfs/dbraw/zinc/17/00/28/1130170028.db2.gz UWNGJKGRQWGZEG-KRWDZBQOSA-N 1 3 277.456 3.633 20 0 CHADHO C[C@@H]1CC[C@H](N2CCC([NH3+])(c3cccc(Cl)c3)CC2)C1 ZINC001170119610 1130275036 /nfs/dbraw/zinc/27/50/36/1130275036.db2.gz ZCZVSHRMADFLMK-CJNGLKHVSA-N 1 3 292.854 3.778 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@H]2N[C@@H]1CC[N@H+](CC2CC2)C1 ZINC000678114371 1130349888 /nfs/dbraw/zinc/34/98/88/1130349888.db2.gz DNHIWLKOJDQTID-QGPMSJSTSA-N 1 3 284.447 3.617 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@H]2N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000678114371 1130349893 /nfs/dbraw/zinc/34/98/93/1130349893.db2.gz DNHIWLKOJDQTID-QGPMSJSTSA-N 1 3 284.447 3.617 20 0 CHADHO Cc1ccoc1CN1CCC(C[NH+]2CCCCCC2)CC1 ZINC000678139421 1130358234 /nfs/dbraw/zinc/35/82/34/1130358234.db2.gz YHFDRQHKECPADW-UHFFFAOYSA-N 1 3 290.451 3.676 20 0 CHADHO CCC[NH+]1CCC(N[C@@H]2c3ccccc3CC[C@H]2C)CC1 ZINC000678773995 1130453733 /nfs/dbraw/zinc/45/37/33/1130453733.db2.gz DBNUTUCQIWFISD-BEFAXECRSA-N 1 3 286.463 3.774 20 0 CHADHO CN1CCC[C@H]1CC[NH2+][C@@H](CC1CC1)c1ccccc1 ZINC000678776498 1130453916 /nfs/dbraw/zinc/45/39/16/1130453916.db2.gz GAJHQLLQWAQNMV-ROUUACIJSA-N 1 3 272.436 3.602 20 0 CHADHO C[N@@H+]1CCC[C@H]1CCN[C@@H](CC1CC1)c1ccccc1 ZINC000678776498 1130453921 /nfs/dbraw/zinc/45/39/21/1130453921.db2.gz GAJHQLLQWAQNMV-ROUUACIJSA-N 1 3 272.436 3.602 20 0 CHADHO C[N@H+]1CCC[C@H]1CCN[C@@H](CC1CC1)c1ccccc1 ZINC000678776498 1130453924 /nfs/dbraw/zinc/45/39/24/1130453924.db2.gz GAJHQLLQWAQNMV-ROUUACIJSA-N 1 3 272.436 3.602 20 0 CHADHO CCC(CC)(CC)C[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000679840902 1130559942 /nfs/dbraw/zinc/55/99/42/1130559942.db2.gz PXYBYNUWFVYNFG-MRXNPFEDSA-N 1 3 268.489 3.913 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2cccc3cnccc32)C[C@H]1C ZINC000679990548 1130568516 /nfs/dbraw/zinc/56/85/16/1130568516.db2.gz VEPYPQYFZSTHCC-QAPCUYQASA-N 1 3 297.446 3.539 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2cccc3cnccc32)C[C@H]1C ZINC000679990548 1130568520 /nfs/dbraw/zinc/56/85/20/1130568520.db2.gz VEPYPQYFZSTHCC-QAPCUYQASA-N 1 3 297.446 3.539 20 0 CHADHO CCCCCC[C@H](C)[NH2+]C1CCC(N2CCOCC2)CC1 ZINC001256681800 1130677865 /nfs/dbraw/zinc/67/78/65/1130677865.db2.gz CRZUTPHDICQPOF-AOCRQIFASA-N 1 3 296.499 3.578 20 0 CHADHO C[C@H](CN1CC[C@]2(CC[NH2+]C2)C1)c1cccc2ccccc21 ZINC001235033276 1130703362 /nfs/dbraw/zinc/70/33/62/1130703362.db2.gz XBJLMLOFNMRNFW-UZLBHIALSA-N 1 3 294.442 3.629 20 0 CHADHO c1cc(CN2CCC[C@@]3(CCC[NH2+]3)CC2)c2cccccc1-2 ZINC001235039654 1130704739 /nfs/dbraw/zinc/70/47/39/1130704739.db2.gz OZBSBTSJVLTZAJ-FQEVSTJZSA-N 1 3 294.442 3.900 20 0 CHADHO c1ccc(C2CC2)c(CN2CCC[C@]3(CCC[NH2+]3)CC2)c1 ZINC001235046505 1130706517 /nfs/dbraw/zinc/70/65/17/1130706517.db2.gz QTZMQCAMBSZZAV-LJQANCHMSA-N 1 3 284.447 3.672 20 0 CHADHO C[C@@H](C[N@@H+]1CCC12CCNCC2)c1cccc2ccccc21 ZINC001235103121 1130710985 /nfs/dbraw/zinc/71/09/85/1130710985.db2.gz SBBGUDQOJSYCLZ-INIZCTEOSA-N 1 3 294.442 3.771 20 0 CHADHO C[C@@H](C[N@H+]1CCC12CCNCC2)c1cccc2ccccc21 ZINC001235103121 1130710989 /nfs/dbraw/zinc/71/09/89/1130710989.db2.gz SBBGUDQOJSYCLZ-INIZCTEOSA-N 1 3 294.442 3.771 20 0 CHADHO C[C@@H](CN1CCC12CC[NH2+]CC2)c1cccc2ccccc21 ZINC001235103121 1130710992 /nfs/dbraw/zinc/71/09/92/1130710992.db2.gz SBBGUDQOJSYCLZ-INIZCTEOSA-N 1 3 294.442 3.771 20 0 CHADHO CC(C)c1ccc(C[N@@H+]2CCCC23CCNCC3)cc1 ZINC001235139586 1130714426 /nfs/dbraw/zinc/71/44/26/1130714426.db2.gz APHICKHIHCLUMY-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO CC(C)c1ccc(C[N@H+]2CCCC23CCNCC3)cc1 ZINC001235139586 1130714429 /nfs/dbraw/zinc/71/44/29/1130714429.db2.gz APHICKHIHCLUMY-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO CC(C)=CCCC1=CC[C@H](CN2C[C@@H]3C[NH2+]CC[C@H]32)CC1 ZINC001235254717 1130730118 /nfs/dbraw/zinc/73/01/18/1130730118.db2.gz CRXYQAGLJSPIBS-GBESFXJTSA-N 1 3 288.479 3.753 20 0 CHADHO CC(C)=CCCC1=CC[C@H](C[N@@H+]2C[C@@H]3CNCC[C@H]32)CC1 ZINC001235254717 1130730119 /nfs/dbraw/zinc/73/01/19/1130730119.db2.gz CRXYQAGLJSPIBS-GBESFXJTSA-N 1 3 288.479 3.753 20 0 CHADHO CC(C)=CCCC1=CC[C@H](C[N@H+]2C[C@@H]3CNCC[C@H]32)CC1 ZINC001235254717 1130730122 /nfs/dbraw/zinc/73/01/22/1130730122.db2.gz CRXYQAGLJSPIBS-GBESFXJTSA-N 1 3 288.479 3.753 20 0 CHADHO CC/C=C\CCCCC[N@@H+]1CC[C@]2(C1)CNCC[C@@H]2F ZINC001235402325 1130739628 /nfs/dbraw/zinc/73/96/28/1130739628.db2.gz IWNDTQHDWOOAOA-OPCNFVSTSA-N 1 3 282.447 3.537 20 0 CHADHO CC/C=C\CCCCC[N@H+]1CC[C@]2(C1)CNCC[C@@H]2F ZINC001235402325 1130739630 /nfs/dbraw/zinc/73/96/30/1130739630.db2.gz IWNDTQHDWOOAOA-OPCNFVSTSA-N 1 3 282.447 3.537 20 0 CHADHO c1ccc([C@@H]2CCC[N@H+]2Cc2ccc3c(c2)CNC3)cc1 ZINC001235674825 1130765775 /nfs/dbraw/zinc/76/57/75/1130765775.db2.gz PUVNYYDFHVEKRO-IBGZPJMESA-N 1 3 278.399 3.627 20 0 CHADHO c1ccc([C@@H]2CCC[N@@H+]2Cc2ccc3c(c2)CNC3)cc1 ZINC001235674825 1130765780 /nfs/dbraw/zinc/76/57/80/1130765780.db2.gz PUVNYYDFHVEKRO-IBGZPJMESA-N 1 3 278.399 3.627 20 0 CHADHO Clc1ccc(CN2CCC(C3CC[NH2+]CC3)CC2)cc1 ZINC001235702431 1130770327 /nfs/dbraw/zinc/77/03/27/1130770327.db2.gz VARWHYGBPDKNQB-UHFFFAOYSA-N 1 3 292.854 3.552 20 0 CHADHO [NH3+]Cc1cccc(CN2CCC[C@@H]2c2cccc(F)c2)c1 ZINC001235713553 1130771135 /nfs/dbraw/zinc/77/11/35/1130771135.db2.gz CUMPWDVCYPIXQB-GOSISDBHSA-N 1 3 284.378 3.622 20 0 CHADHO CN(Cc1ccccc1-c1ccc(F)cc1)C[C@H]1CC[NH2+]C1 ZINC001235843630 1130787264 /nfs/dbraw/zinc/78/72/64/1130787264.db2.gz ZYRYYAYTCVUJOR-HNNXBMFYSA-N 1 3 298.405 3.534 20 0 CHADHO C[C@H]1CC[C@@H](N)C[N@@H+]1Cc1ccccc1-c1ccccc1 ZINC001235906862 1130803213 /nfs/dbraw/zinc/80/32/13/1130803213.db2.gz OZXZIDCWXSTSBK-MAUKXSAKSA-N 1 3 280.415 3.665 20 0 CHADHO C[C@H]1CC[C@@H](N)C[N@H+]1Cc1ccccc1-c1ccccc1 ZINC001235906862 1130803216 /nfs/dbraw/zinc/80/32/16/1130803216.db2.gz OZXZIDCWXSTSBK-MAUKXSAKSA-N 1 3 280.415 3.665 20 0 CHADHO Cc1ccc(CN(C)C[C@H]2CCC[NH2+]C2)c2ccccc12 ZINC001235952474 1130814642 /nfs/dbraw/zinc/81/46/42/1130814642.db2.gz XVVUOXAGHXEFFN-INIZCTEOSA-N 1 3 282.431 3.580 20 0 CHADHO CC[C@H](c1ccccc1)N(C)CC[C@H]1CCCC[NH2+]1 ZINC001235960670 1130818496 /nfs/dbraw/zinc/81/84/96/1130818496.db2.gz WTYMWAJISIBTCF-IAGOWNOFSA-N 1 3 260.425 3.602 20 0 CHADHO CC[C@@H](c1ccccc1)N(C)CC[C@@H]1CCCC[NH2+]1 ZINC001235960672 1130819693 /nfs/dbraw/zinc/81/96/93/1130819693.db2.gz WTYMWAJISIBTCF-IRXDYDNUSA-N 1 3 260.425 3.602 20 0 CHADHO C[C@@H]1C[C@@H](N)C[N@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001236046406 1130836878 /nfs/dbraw/zinc/83/68/78/1130836878.db2.gz GGPOLPFVGNTJHF-CRAIPNDOSA-N 1 3 280.415 3.523 20 0 CHADHO C[C@@H]1C[C@@H](N)C[N@@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001236046406 1130836885 /nfs/dbraw/zinc/83/68/85/1130836885.db2.gz GGPOLPFVGNTJHF-CRAIPNDOSA-N 1 3 280.415 3.523 20 0 CHADHO C[C@H]1C[C@@H](N)C[N@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001236044873 1130837219 /nfs/dbraw/zinc/83/72/19/1130837219.db2.gz AQXQNHUZUPZECV-DZGCQCFKSA-N 1 3 294.398 3.755 20 0 CHADHO C[C@H]1C[C@@H](N)C[N@@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001236044873 1130837222 /nfs/dbraw/zinc/83/72/22/1130837222.db2.gz AQXQNHUZUPZECV-DZGCQCFKSA-N 1 3 294.398 3.755 20 0 CHADHO C[C@H]1C[C@H](N)C[N@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001236044880 1130837869 /nfs/dbraw/zinc/83/78/69/1130837869.db2.gz AQXQNHUZUPZECV-ZFWWWQNUSA-N 1 3 294.398 3.755 20 0 CHADHO C[C@H]1C[C@H](N)C[N@@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001236044880 1130837872 /nfs/dbraw/zinc/83/78/72/1130837872.db2.gz AQXQNHUZUPZECV-ZFWWWQNUSA-N 1 3 294.398 3.755 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@@H+]1C[C@@H](C)C[C@H](N)C1 ZINC001236049865 1130838568 /nfs/dbraw/zinc/83/85/68/1130838568.db2.gz QZIOGPIHUXMEIT-YJBOKZPZSA-N 1 3 294.442 3.831 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@H+]1C[C@@H](C)C[C@H](N)C1 ZINC001236049865 1130838573 /nfs/dbraw/zinc/83/85/73/1130838573.db2.gz QZIOGPIHUXMEIT-YJBOKZPZSA-N 1 3 294.442 3.831 20 0 CHADHO C[NH2+]C[C@@H]1CCN(Cc2cccc(-c3ccccc3)c2C)C1 ZINC001236067898 1130846388 /nfs/dbraw/zinc/84/63/88/1130846388.db2.gz RKLHDEDMIFYFQW-KRWDZBQOSA-N 1 3 294.442 3.703 20 0 CHADHO C[NH2+]CCCN(C)CCC(c1ccccc1)c1ccccc1 ZINC001236092670 1130857343 /nfs/dbraw/zinc/85/73/43/1130857343.db2.gz OGAHTLSVFQRHEH-UHFFFAOYSA-N 1 3 296.458 3.750 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](CN2C[C@@H](C)[C@@H]([NH3+])C2)CC1 ZINC001236094105 1130857628 /nfs/dbraw/zinc/85/76/28/1130857628.db2.gz NSZMWWQBSUMOJK-NXHRZFHOSA-N 1 3 276.468 3.738 20 0 CHADHO CCC[N@H+](Cc1ccc(C2CCC2)cc1)C1CCNCC1 ZINC001236184416 1130882633 /nfs/dbraw/zinc/88/26/33/1130882633.db2.gz LDPWWWDXNJVRRC-UHFFFAOYSA-N 1 3 286.463 3.918 20 0 CHADHO CCC[N@@H+](Cc1ccc(C2CCC2)cc1)C1CCNCC1 ZINC001236184416 1130882641 /nfs/dbraw/zinc/88/26/41/1130882641.db2.gz LDPWWWDXNJVRRC-UHFFFAOYSA-N 1 3 286.463 3.918 20 0 CHADHO CCCN(Cc1ccc(C2CCC2)cc1)C1CC[NH2+]CC1 ZINC001236184416 1130882648 /nfs/dbraw/zinc/88/26/48/1130882648.db2.gz LDPWWWDXNJVRRC-UHFFFAOYSA-N 1 3 286.463 3.918 20 0 CHADHO CC(C)c1cccc(C[N@H+](C)[C@@H]2CCCC[C@@H]2N)c1 ZINC001236214068 1130891366 /nfs/dbraw/zinc/89/13/66/1130891366.db2.gz DUKJBQMQIXDRBZ-DLBZAZTESA-N 1 3 260.425 3.512 20 0 CHADHO C[N@H+](Cc1c[nH]c2c1cccc2Cl)[C@H]1CCCC[C@H]1N ZINC001236214723 1130891453 /nfs/dbraw/zinc/89/14/53/1130891453.db2.gz DWSNVQLURBLEJU-CABCVRRESA-N 1 3 291.826 3.523 20 0 CHADHO C[N@@H+](Cc1c[nH]c2c1cccc2Cl)[C@H]1CCCC[C@H]1N ZINC001236214723 1130891459 /nfs/dbraw/zinc/89/14/59/1130891459.db2.gz DWSNVQLURBLEJU-CABCVRRESA-N 1 3 291.826 3.523 20 0 CHADHO C[C@@H](CN1CCC[NH2+]CCC1)c1cccc2ccccc21 ZINC001236239536 1130901988 /nfs/dbraw/zinc/90/19/88/1130901988.db2.gz FGAJLSSZFYWJGJ-INIZCTEOSA-N 1 3 282.431 3.629 20 0 CHADHO CC/C=C\CC[N@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236373276 1130923601 /nfs/dbraw/zinc/92/36/01/1130923601.db2.gz VVWBOTRVLRWILT-QGZUEGPWSA-N 1 3 264.457 3.587 20 0 CHADHO CC/C=C\CC[N@@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236373276 1130923603 /nfs/dbraw/zinc/92/36/03/1130923603.db2.gz VVWBOTRVLRWILT-QGZUEGPWSA-N 1 3 264.457 3.587 20 0 CHADHO CCC[C@@H](C)C[N@H+](Cc1cccc(F)c1)C1CCNCC1 ZINC001236402315 1130929016 /nfs/dbraw/zinc/92/90/16/1130929016.db2.gz XYFRUWBBIYDPEP-OAHLLOKOSA-N 1 3 292.442 3.816 20 0 CHADHO CCC[C@@H](C)C[N@@H+](Cc1cccc(F)c1)C1CCNCC1 ZINC001236402315 1130929019 /nfs/dbraw/zinc/92/90/19/1130929019.db2.gz XYFRUWBBIYDPEP-OAHLLOKOSA-N 1 3 292.442 3.816 20 0 CHADHO CCC[C@@H](C)CN(Cc1cccc(F)c1)C1CC[NH2+]CC1 ZINC001236402315 1130929023 /nfs/dbraw/zinc/92/90/23/1130929023.db2.gz XYFRUWBBIYDPEP-OAHLLOKOSA-N 1 3 292.442 3.816 20 0 CHADHO Cc1ccccc1C[N@H+](CC(C)(C)C)C1CCNCC1 ZINC001236458639 1130947238 /nfs/dbraw/zinc/94/72/38/1130947238.db2.gz UTVWFKFBQPGKRH-UHFFFAOYSA-N 1 3 274.452 3.595 20 0 CHADHO Cc1ccccc1C[N@@H+](CC(C)(C)C)C1CCNCC1 ZINC001236458639 1130947239 /nfs/dbraw/zinc/94/72/39/1130947239.db2.gz UTVWFKFBQPGKRH-UHFFFAOYSA-N 1 3 274.452 3.595 20 0 CHADHO CC[C@@H](C)C[N@H+](Cc1cc(F)ccc1C)C1CCNCC1 ZINC001236510249 1130959867 /nfs/dbraw/zinc/95/98/67/1130959867.db2.gz ZBEFVEAHZMURMQ-CQSZACIVSA-N 1 3 292.442 3.734 20 0 CHADHO CC[C@@H](C)C[N@@H+](Cc1cc(F)ccc1C)C1CCNCC1 ZINC001236510249 1130959871 /nfs/dbraw/zinc/95/98/71/1130959871.db2.gz ZBEFVEAHZMURMQ-CQSZACIVSA-N 1 3 292.442 3.734 20 0 CHADHO CC[C@@H](C)CN(Cc1cc(F)ccc1C)C1CC[NH2+]CC1 ZINC001236510249 1130959873 /nfs/dbraw/zinc/95/98/73/1130959873.db2.gz ZBEFVEAHZMURMQ-CQSZACIVSA-N 1 3 292.442 3.734 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@H+](C[C@H]1CCCNC1)C1CC1 ZINC001236584860 1130980606 /nfs/dbraw/zinc/98/06/06/1130980606.db2.gz XKYXBPYHPWJYTK-IRXDYDNUSA-N 1 3 278.484 3.833 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@@H+](C[C@H]1CCCNC1)C1CC1 ZINC001236584860 1130980611 /nfs/dbraw/zinc/98/06/11/1130980611.db2.gz XKYXBPYHPWJYTK-IRXDYDNUSA-N 1 3 278.484 3.833 20 0 CHADHO CC/C=C\CCCCC[N@H+](C[C@@H]1CCCNC1)C1CC1 ZINC001236584700 1130980767 /nfs/dbraw/zinc/98/07/67/1130980767.db2.gz QCHPHPMLSAGQOS-CWIOURORSA-N 1 3 278.484 3.977 20 0 CHADHO CC/C=C\CCCCC[N@@H+](C[C@@H]1CCCNC1)C1CC1 ZINC001236584700 1130980770 /nfs/dbraw/zinc/98/07/70/1130980770.db2.gz QCHPHPMLSAGQOS-CWIOURORSA-N 1 3 278.484 3.977 20 0 CHADHO C[C@]1(C[NH3+])CCN(Cc2cccc(-c3ccc(F)cc3)c2)C1 ZINC001236603686 1130981662 /nfs/dbraw/zinc/98/16/62/1130981662.db2.gz CIZCTZWLVXIBLF-LJQANCHMSA-N 1 3 298.405 3.663 20 0 CHADHO Cc1ccc2ccccc2c1CN1CC[C@@H]2[NH2+]CCC[C@@H]2C1 ZINC001237408186 1131097302 /nfs/dbraw/zinc/09/73/02/1131097302.db2.gz ZAFWLDFHUKQROJ-XLIONFOSSA-N 1 3 294.442 3.722 20 0 CHADHO CCCC[N@H+](C)Cc1ccc2c(c1)C(C(C)C)=NCC2 ZINC001237881501 1131149258 /nfs/dbraw/zinc/14/92/58/1131149258.db2.gz UQMQDRFYFNTBBS-UHFFFAOYSA-N 1 3 272.436 3.920 20 0 CHADHO CCCC[N@@H+](C)Cc1ccc2c(c1)C(C(C)C)=NCC2 ZINC001237881501 1131149261 /nfs/dbraw/zinc/14/92/61/1131149261.db2.gz UQMQDRFYFNTBBS-UHFFFAOYSA-N 1 3 272.436 3.920 20 0 CHADHO C[C@H](N[C@H](c1ccccc1)C1CCCCC1)C1C[NH2+]C1 ZINC000817909100 1131188100 /nfs/dbraw/zinc/18/81/00/1131188100.db2.gz XULLHUZBBPOQIN-KBXCAEBGSA-N 1 3 272.436 3.506 20 0 CHADHO CC[C@@H](NCc1ccc(CC[NH3+])cc1)c1ccccc1F ZINC000817948416 1131189478 /nfs/dbraw/zinc/18/94/78/1131189478.db2.gz JLTVPOPGUHZZSY-GOSISDBHSA-N 1 3 286.394 3.568 20 0 CHADHO Cc1ccc(/C=C/c2ccc(N[C@@H](N)CCC[NH3+])cc2)cc1 ZINC001170901037 1131208551 /nfs/dbraw/zinc/20/85/51/1131208551.db2.gz ULPKIFHYPPMMQE-CSHXORCISA-N 1 3 295.430 3.601 20 0 CHADHO CC[C@@H]([NH3+])CCN[C@H](C)Cc1ccc(Cl)cc1Cl ZINC001246307715 1131457465 /nfs/dbraw/zinc/45/74/65/1131457465.db2.gz NXOKGETZQQVMMQ-ZWNOBZJWSA-N 1 3 289.250 3.641 20 0 CHADHO CCC[C@@]1(CN[C@@H](C)C[C@@H](C)CC(C)C)CC[NH2+]1 ZINC001246454167 1131503358 /nfs/dbraw/zinc/50/33/58/1131503358.db2.gz ABHRLNGPZQLRTJ-JYJNAYRXSA-N 1 3 254.462 3.569 20 0 CHADHO N[C@@H]1CCC[N@@H+](C2CCC3(CCCCC3)CC2)CC1 ZINC001246543054 1131586234 /nfs/dbraw/zinc/58/62/34/1131586234.db2.gz RTYUSZBMARFMCM-OAHLLOKOSA-N 1 3 264.457 3.693 20 0 CHADHO C[C@@H](CSc1ccc(F)cc1)N1CCC[C@](C)([NH3+])CC1 ZINC001246550655 1131606110 /nfs/dbraw/zinc/60/61/10/1131606110.db2.gz JPRVPTHSRYTFIU-BBRMVZONSA-N 1 3 296.455 3.510 20 0 CHADHO CC[N@H+](CCCNC1CC(C(F)F)C1)C1CCCCC1 ZINC000846022216 1131677892 /nfs/dbraw/zinc/67/78/92/1131677892.db2.gz KRPFWNLFQCBYET-UHFFFAOYSA-N 1 3 288.426 3.664 20 0 CHADHO CC[N@@H+](CCCNC1CC(C(F)F)C1)C1CCCCC1 ZINC000846022216 1131677895 /nfs/dbraw/zinc/67/78/95/1131677895.db2.gz KRPFWNLFQCBYET-UHFFFAOYSA-N 1 3 288.426 3.664 20 0 CHADHO CCCCC(CCCC)N1CC[C@@]2(C1)CCCC[NH2+]2 ZINC001246624759 1131722071 /nfs/dbraw/zinc/72/20/71/1131722071.db2.gz RVKKOLKCPUYYMD-QGZVFWFLSA-N 1 3 266.473 3.953 20 0 CHADHO CCCCC(CCCC)N1CC[C@]2(C1)CCCC[NH2+]2 ZINC001246624755 1131722415 /nfs/dbraw/zinc/72/24/15/1131722415.db2.gz RVKKOLKCPUYYMD-KRWDZBQOSA-N 1 3 266.473 3.953 20 0 CHADHO CCC[C@@H]1CCCC[N@@H+]1[C@@H]1CCN[C@@H](C(C)(C)C)C1 ZINC001246787669 1131781671 /nfs/dbraw/zinc/78/16/71/1131781671.db2.gz FEJFKCBIBBEIJE-BZUAXINKSA-N 1 3 266.473 3.808 20 0 CHADHO CCC[C@@H]1CCCC[N@H+]1[C@@H]1CCN[C@@H](C(C)(C)C)C1 ZINC001246787669 1131781674 /nfs/dbraw/zinc/78/16/74/1131781674.db2.gz FEJFKCBIBBEIJE-BZUAXINKSA-N 1 3 266.473 3.808 20 0 CHADHO CCN(CC)CCC[N@@H+]1CC[C@@H](c2ccccc2)C1(C)C ZINC001171268485 1131781870 /nfs/dbraw/zinc/78/18/70/1131781870.db2.gz XFRCCMHAKISERW-SFHVURJKSA-N 1 3 288.479 3.986 20 0 CHADHO CCN(CC)CCC[N@H+]1CC[C@@H](c2ccccc2)C1(C)C ZINC001171268485 1131781876 /nfs/dbraw/zinc/78/18/76/1131781876.db2.gz XFRCCMHAKISERW-SFHVURJKSA-N 1 3 288.479 3.986 20 0 CHADHO C[C@@H]1[C@@H]([NH3+])CCCN1[C@@H]1CCCC2(CCCCC2)C1 ZINC001246940566 1131826898 /nfs/dbraw/zinc/82/68/98/1131826898.db2.gz WWFJSSCGCIQVPS-OAGGEKHMSA-N 1 3 264.457 3.691 20 0 CHADHO CC/C=C\CN[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716693634 1132027981 /nfs/dbraw/zinc/02/79/81/1132027981.db2.gz PKCXEMACMXKXRN-KQDLWMLUSA-N 1 3 284.447 3.595 20 0 CHADHO CC/C=C\CN[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716693634 1132027990 /nfs/dbraw/zinc/02/79/90/1132027990.db2.gz PKCXEMACMXKXRN-KQDLWMLUSA-N 1 3 284.447 3.595 20 0 CHADHO CC/C=C\C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000716693634 1132027997 /nfs/dbraw/zinc/02/79/97/1132027997.db2.gz PKCXEMACMXKXRN-KQDLWMLUSA-N 1 3 284.447 3.595 20 0 CHADHO C[C@@H]1C[N@@H+](C2CC(C)(C)N(C)C(C)(C)C2)CCC1(F)F ZINC001171631516 1132060368 /nfs/dbraw/zinc/06/03/68/1132060368.db2.gz KJSASOULOHIOBK-GFCCVEGCSA-N 1 3 288.426 3.615 20 0 CHADHO C[C@@H]1C[N@H+](C2CC(C)(C)N(C)C(C)(C)C2)CCC1(F)F ZINC001171631516 1132060373 /nfs/dbraw/zinc/06/03/73/1132060373.db2.gz KJSASOULOHIOBK-GFCCVEGCSA-N 1 3 288.426 3.615 20 0 CHADHO C[C@@H]1CN(C2CC(C)(C)[NH+](C)C(C)(C)C2)CCC1(F)F ZINC001171631516 1132060378 /nfs/dbraw/zinc/06/03/78/1132060378.db2.gz KJSASOULOHIOBK-GFCCVEGCSA-N 1 3 288.426 3.615 20 0 CHADHO C[NH+]1C(C)(C)CC(N[C@H]2C[C@@H]2c2ccccc2)CC1(C)C ZINC001171620677 1132064859 /nfs/dbraw/zinc/06/48/59/1132064859.db2.gz DBNJSORHMCQKGG-SJORKVTESA-N 1 3 286.463 3.784 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@H]2C[C@@H]2c2ccccc2)CC1(C)C ZINC001171620677 1132064864 /nfs/dbraw/zinc/06/48/64/1132064864.db2.gz DBNJSORHMCQKGG-SJORKVTESA-N 1 3 286.463 3.784 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@H]2CC[C@@H](F)CC2)CC1(C)C ZINC001171613992 1132065050 /nfs/dbraw/zinc/06/50/50/1132065050.db2.gz SSZOWBFQROLZDV-BETUJISGSA-N 1 3 270.436 3.508 20 0 CHADHO C[C@@H]1CCC[C@@H]([NH2+]C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001171613183 1132066097 /nfs/dbraw/zinc/06/60/97/1132066097.db2.gz GYZJEMGOEGMCOT-ZIAGYGMSSA-N 1 3 266.473 3.806 20 0 CHADHO Cc1ccc(CC[C@H](C)[NH2+][C@@H]2CCC[C@H](N(C)C)C2)cc1 ZINC001171664333 1132071715 /nfs/dbraw/zinc/07/17/15/1132071715.db2.gz XWIQTEFHLUFHLT-UHOSZYNNSA-N 1 3 288.479 3.779 20 0 CHADHO CN1C(C)(C)CC([N@H+](C)C[C@@H]2CC2(C)C)CC1(C)C ZINC001171639610 1132081296 /nfs/dbraw/zinc/08/12/96/1132081296.db2.gz QGGWGWGJAZYZJE-ZDUSSCGKSA-N 1 3 266.473 3.616 20 0 CHADHO CN1C(C)(C)CC([N@@H+](C)C[C@@H]2CC2(C)C)CC1(C)C ZINC001171639610 1132081305 /nfs/dbraw/zinc/08/13/05/1132081305.db2.gz QGGWGWGJAZYZJE-ZDUSSCGKSA-N 1 3 266.473 3.616 20 0 CHADHO CN1C(C)(C)CC([NH+]2CC(C)(C)OC(C)(C)C2)CC1(C)C ZINC001171641093 1132081518 /nfs/dbraw/zinc/08/15/18/1132081518.db2.gz CLRTWZXHZXAIDE-UHFFFAOYSA-N 1 3 296.499 3.527 20 0 CHADHO CN(CCc1cccs1)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171638218 1132082265 /nfs/dbraw/zinc/08/22/65/1132082265.db2.gz XCJYRDGILHFCDS-UHFFFAOYSA-N 1 3 294.508 3.874 20 0 CHADHO CN1C(C)(C)CC([N@H+](C)CCc2cccs2)CC1(C)C ZINC001171638218 1132082271 /nfs/dbraw/zinc/08/22/71/1132082271.db2.gz XCJYRDGILHFCDS-UHFFFAOYSA-N 1 3 294.508 3.874 20 0 CHADHO CN1C(C)(C)CC([N@@H+](C)CCc2cccs2)CC1(C)C ZINC001171638218 1132082276 /nfs/dbraw/zinc/08/22/76/1132082276.db2.gz XCJYRDGILHFCDS-UHFFFAOYSA-N 1 3 294.508 3.874 20 0 CHADHO Cc1ccc([C@H](C)N[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172100554 1132125827 /nfs/dbraw/zinc/12/58/27/1132125827.db2.gz DYOIEYYOWBZRQX-OWLYRPNTSA-N 1 3 272.436 3.661 20 0 CHADHO Cc1ccc([C@H](C)N[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172100554 1132125832 /nfs/dbraw/zinc/12/58/32/1132125832.db2.gz DYOIEYYOWBZRQX-OWLYRPNTSA-N 1 3 272.436 3.661 20 0 CHADHO CC[C@H](C)OCC[C@H](C)[NH+]1C(C)(C)CC(N)CC1(C)C ZINC001172320710 1132158315 /nfs/dbraw/zinc/15/83/15/1132158315.db2.gz ZSAQFWQHGLRDSP-KBPBESRZSA-N 1 3 284.488 3.560 20 0 CHADHO CC[NH+](CC)C1CCN([C@@H]2CC[C@@H](C)[C@@H](C)C2)CC1 ZINC001172374351 1132168051 /nfs/dbraw/zinc/16/80/51/1132168051.db2.gz QATCPFBCUMKHSI-HLLBOEOZSA-N 1 3 266.473 3.617 20 0 CHADHO CCN(CC)C1CC[NH+]([C@@H]2CC[C@@H](C)[C@@H](C)C2)CC1 ZINC001172374351 1132168053 /nfs/dbraw/zinc/16/80/53/1132168053.db2.gz QATCPFBCUMKHSI-HLLBOEOZSA-N 1 3 266.473 3.617 20 0 CHADHO CC[C@@H](CC(C)C)[NH+]1CCC(N2CCCCC2)CC1 ZINC001172402339 1132222721 /nfs/dbraw/zinc/22/27/21/1132222721.db2.gz RPDBHJPCKRCRPP-INIZCTEOSA-N 1 3 266.473 3.761 20 0 CHADHO Cc1ccc(CNC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc12 ZINC000840840766 1132292345 /nfs/dbraw/zinc/29/23/45/1132292345.db2.gz BHLILDXPXRBRCS-AYHJJNSGSA-N 1 3 294.442 3.863 20 0 CHADHO Cc1ccc(CNC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc12 ZINC000840840766 1132292350 /nfs/dbraw/zinc/29/23/50/1132292350.db2.gz BHLILDXPXRBRCS-AYHJJNSGSA-N 1 3 294.442 3.863 20 0 CHADHO c1cc(N2CC[NH+](C3CCC4(CCCC4)CC3)CC2)ccn1 ZINC001172726327 1132300191 /nfs/dbraw/zinc/30/01/91/1132300191.db2.gz GISQMQHWGOQJGK-UHFFFAOYSA-N 1 3 299.462 3.707 20 0 CHADHO c1cc(N2CCN(C3CCC4(CCCC4)CC3)CC2)cc[nH+]1 ZINC001172726327 1132300196 /nfs/dbraw/zinc/30/01/96/1132300196.db2.gz GISQMQHWGOQJGK-UHFFFAOYSA-N 1 3 299.462 3.707 20 0 CHADHO C[N@@H+](CCCc1ccccc1)Cc1cc2cnccc2[nH]1 ZINC001232013989 1132411651 /nfs/dbraw/zinc/41/16/51/1132411651.db2.gz FLZKPJYKWHANAG-UHFFFAOYSA-N 1 3 279.387 3.628 20 0 CHADHO C[N@H+](CCCc1ccccc1)Cc1cc2cnccc2[nH]1 ZINC001232013989 1132411647 /nfs/dbraw/zinc/41/16/47/1132411647.db2.gz FLZKPJYKWHANAG-UHFFFAOYSA-N 1 3 279.387 3.628 20 0 CHADHO CCCC[C@H](CC(C)C)[N@H+]1C[C@H]2CN(CCC)C[C@H]2C1 ZINC001173259085 1132427203 /nfs/dbraw/zinc/42/72/03/1132427203.db2.gz FMQYMULNCJAZFP-FGTMMUONSA-N 1 3 280.500 3.865 20 0 CHADHO CCCC[C@H](CC(C)C)[N@@H+]1C[C@H]2CN(CCC)C[C@H]2C1 ZINC001173259085 1132427206 /nfs/dbraw/zinc/42/72/06/1132427206.db2.gz FMQYMULNCJAZFP-FGTMMUONSA-N 1 3 280.500 3.865 20 0 CHADHO CCc1ccc(C[C@H](C)[NH2+][C@@H]2CCC[C@H](N(C)C)C2)cc1 ZINC001173240900 1132441641 /nfs/dbraw/zinc/44/16/41/1132441641.db2.gz KOACAUYCXXZJMB-IPELMVKDSA-N 1 3 288.479 3.642 20 0 CHADHO CCc1ccc(C[C@H](C)[NH2+][C@H]2CCC[C@H](N(C)C)C2)cc1 ZINC001173240904 1132441820 /nfs/dbraw/zinc/44/18/20/1132441820.db2.gz KOACAUYCXXZJMB-SNRMKQJTSA-N 1 3 288.479 3.642 20 0 CHADHO CCSC[C@@H](C)N(C)C1CC[NH+](C2CCCCC2)CC1 ZINC001173308607 1132449495 /nfs/dbraw/zinc/44/94/95/1132449495.db2.gz NKNUOUJVACRVAE-OAHLLOKOSA-N 1 3 298.540 3.857 20 0 CHADHO CCSC[C@@H](C)[N@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001173308607 1132449497 /nfs/dbraw/zinc/44/94/97/1132449497.db2.gz NKNUOUJVACRVAE-OAHLLOKOSA-N 1 3 298.540 3.857 20 0 CHADHO CCSC[C@@H](C)[N@@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001173308607 1132449499 /nfs/dbraw/zinc/44/94/99/1132449499.db2.gz NKNUOUJVACRVAE-OAHLLOKOSA-N 1 3 298.540 3.857 20 0 CHADHO Cc1cc(Cl)cc(C)c1CN1CCCC[C@H](C[NH3+])C1 ZINC001206641082 1132569183 /nfs/dbraw/zinc/56/91/83/1132569183.db2.gz SGYNDQLKINHILE-CQSZACIVSA-N 1 3 280.843 3.518 20 0 CHADHO C[C@@H](CC[NH2+]Cc1ccc(-c2cccs2)cc1)N(C)C ZINC001203271558 1133308951 /nfs/dbraw/zinc/30/89/51/1133308951.db2.gz VKASMOACULRPMT-AWEZNQCLSA-N 1 3 288.460 3.845 20 0 CHADHO Cc1ccc(C[N@@H+]2CCCC[C@H]2CCN2CCCC2)cc1 ZINC001204172231 1133414398 /nfs/dbraw/zinc/41/43/98/1133414398.db2.gz ZQWBQJKMZNECQZ-IBGZPJMESA-N 1 3 286.463 3.835 20 0 CHADHO Cc1ccc(C[N@H+]2CCCC[C@H]2CCN2CCCC2)cc1 ZINC001204172231 1133414403 /nfs/dbraw/zinc/41/44/03/1133414403.db2.gz ZQWBQJKMZNECQZ-IBGZPJMESA-N 1 3 286.463 3.835 20 0 CHADHO C[NH2+]C[C@@H]1CCCN(C[C@H](C)c2cccc3ccccc32)C1 ZINC001205002080 1133516427 /nfs/dbraw/zinc/51/64/27/1133516427.db2.gz YXFPUYVITYWACA-IRXDYDNUSA-N 1 3 296.458 3.875 20 0 CHADHO [NH3+][C@@H]1CCCN(Cc2cccc(-c3ccc(F)cc3)c2)CC1 ZINC001205103113 1133530284 /nfs/dbraw/zinc/53/02/84/1133530284.db2.gz ZJFRVHWOITZYJD-LJQANCHMSA-N 1 3 298.405 3.806 20 0 CHADHO CCCCN1CCC([N@H+](C)Cc2ccc(F)c(C)c2)CC1 ZINC001205205786 1133546505 /nfs/dbraw/zinc/54/65/05/1133546505.db2.gz HWRJJVGJESVVCD-UHFFFAOYSA-N 1 3 292.442 3.830 20 0 CHADHO CCCCN1CCC([N@@H+](C)Cc2ccc(F)c(C)c2)CC1 ZINC001205205786 1133546508 /nfs/dbraw/zinc/54/65/08/1133546508.db2.gz HWRJJVGJESVVCD-UHFFFAOYSA-N 1 3 292.442 3.830 20 0 CHADHO CC(C)c1ccc(CCN2CCC[C@@](C)([NH3+])CC2)cc1 ZINC001205257993 1133551865 /nfs/dbraw/zinc/55/18/65/1133551865.db2.gz ZUEVYIXZUPMYFL-GOSISDBHSA-N 1 3 274.452 3.556 20 0 CHADHO C[C@@]1([NH3+])CCCN(Cc2cc3ccccc3s2)CC1 ZINC001205266328 1133552452 /nfs/dbraw/zinc/55/24/52/1133552452.db2.gz TUHWCDWDXSVGSI-MRXNPFEDSA-N 1 3 274.433 3.605 20 0 CHADHO CC(C)(C)Oc1cccc(CN2CCC[C@@](C)([NH3+])CC2)c1 ZINC001205288522 1133554578 /nfs/dbraw/zinc/55/45/78/1133554578.db2.gz KYQDARXQWBZPHQ-GOSISDBHSA-N 1 3 290.451 3.567 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@H+]1CCNCC[C@H]1C ZINC001205330977 1133562628 /nfs/dbraw/zinc/56/26/28/1133562628.db2.gz BOFRZAGLFPUUPX-QGZVFWFLSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@@H+]1CCNCC[C@H]1C ZINC001205330977 1133562630 /nfs/dbraw/zinc/56/26/30/1133562630.db2.gz BOFRZAGLFPUUPX-QGZVFWFLSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1c(C)c(C)c(C[N@@H+]2CCCC[C@H](N)C2)c(C)c1C ZINC001205931517 1133632681 /nfs/dbraw/zinc/63/26/81/1133632681.db2.gz KKQIPFDYNZSGPK-KRWDZBQOSA-N 1 3 274.452 3.542 20 0 CHADHO Cc1c(C)c(C)c(C[N@H+]2CCCC[C@H](N)C2)c(C)c1C ZINC001205931517 1133632683 /nfs/dbraw/zinc/63/26/83/1133632683.db2.gz KKQIPFDYNZSGPK-KRWDZBQOSA-N 1 3 274.452 3.542 20 0 CHADHO C[C@H]1CNCCC[N@@H+]1Cc1c2ccccc2[nH]c1C(C)(C)C ZINC001206258076 1133677828 /nfs/dbraw/zinc/67/78/28/1133677828.db2.gz QGPMHOFMEFPPHE-AWEZNQCLSA-N 1 3 299.462 3.649 20 0 CHADHO C[C@H]1CNCCC[N@H+]1Cc1c2ccccc2[nH]c1C(C)(C)C ZINC001206258076 1133677831 /nfs/dbraw/zinc/67/78/31/1133677831.db2.gz QGPMHOFMEFPPHE-AWEZNQCLSA-N 1 3 299.462 3.649 20 0 CHADHO C[C@H]1CNCC[N@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001206269206 1133679982 /nfs/dbraw/zinc/67/99/82/1133679982.db2.gz GSAKQDJDCQPMRE-AWEZNQCLSA-N 1 3 299.462 3.507 20 0 CHADHO C[C@H]1CNCC[N@@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001206269206 1133679986 /nfs/dbraw/zinc/67/99/86/1133679986.db2.gz GSAKQDJDCQPMRE-AWEZNQCLSA-N 1 3 299.462 3.507 20 0 CHADHO Cc1cc(C)c(Cl)c(CN2CCC(CC[NH3+])CC2)c1 ZINC001206506846 1133711815 /nfs/dbraw/zinc/71/18/15/1133711815.db2.gz SPODGLXUXJDEGM-UHFFFAOYSA-N 1 3 280.843 3.518 20 0 CHADHO NC[C@@H]1CCCC[N@H+](C[C@H]2C[C@@H]2c2ccc(Cl)cc2)C1 ZINC001206606562 1133726642 /nfs/dbraw/zinc/72/66/42/1133726642.db2.gz PHFGOPMOCPKKKX-YSVLISHTSA-N 1 3 292.854 3.504 20 0 CHADHO NC[C@@H]1CCCC[N@@H+](C[C@H]2C[C@@H]2c2ccc(Cl)cc2)C1 ZINC001206606562 1133726649 /nfs/dbraw/zinc/72/66/49/1133726649.db2.gz PHFGOPMOCPKKKX-YSVLISHTSA-N 1 3 292.854 3.504 20 0 CHADHO Cc1ccc2ccccc2c1C[N@H+]1C[C@H](CN)CC[C@@H]1C ZINC001206770179 1133745209 /nfs/dbraw/zinc/74/52/09/1133745209.db2.gz RWFSEBMDSUIROU-HOTGVXAUSA-N 1 3 282.431 3.707 20 0 CHADHO Cc1ccc2ccccc2c1C[N@@H+]1C[C@H](CN)CC[C@@H]1C ZINC001206770179 1133745214 /nfs/dbraw/zinc/74/52/14/1133745214.db2.gz RWFSEBMDSUIROU-HOTGVXAUSA-N 1 3 282.431 3.707 20 0 CHADHO CC1=CC[C@@H](CCN2CCC([NH+]3CCCC3)CC2)C1(C)C ZINC001207267285 1133783736 /nfs/dbraw/zinc/78/37/36/1133783736.db2.gz DHLWXXMEPGBXMW-KRWDZBQOSA-N 1 3 290.495 3.929 20 0 CHADHO CCC[NH+]1C[C@H]2CN(CCCC3CCCCC3)C[C@@H]2C1 ZINC001207608429 1133830064 /nfs/dbraw/zinc/83/00/64/1133830064.db2.gz NPFBJWPRQUEDKK-ROUUACIJSA-N 1 3 278.484 3.621 20 0 CHADHO CCCN1C[C@H]2C[NH+](CCCC3CCCCC3)C[C@@H]2C1 ZINC001207608429 1133830069 /nfs/dbraw/zinc/83/00/69/1133830069.db2.gz NPFBJWPRQUEDKK-ROUUACIJSA-N 1 3 278.484 3.621 20 0 CHADHO CC[C@@H](Cc1ccccc1)[NH2+][C@@H](C)CCN(CC)CC ZINC001207858176 1133855432 /nfs/dbraw/zinc/85/54/32/1133855432.db2.gz GETGORICOQCKEW-WMZOPIPTSA-N 1 3 276.468 3.718 20 0 CHADHO CC[NH+]1CCC(CN(C)Cc2ccccc2Cl)CC1 ZINC001208600411 1133920309 /nfs/dbraw/zinc/92/03/09/1133920309.db2.gz REAIENWLNQLLQS-UHFFFAOYSA-N 1 3 280.843 3.504 20 0 CHADHO CC(C)CCC[N@@H+]1CCCC[C@H]1C[C@@H]1CCCN1C ZINC001208736143 1133937678 /nfs/dbraw/zinc/93/76/78/1133937678.db2.gz CVCANKBYSLUOIL-IRXDYDNUSA-N 1 3 266.473 3.761 20 0 CHADHO CC(C)CCC[N@H+]1CCCC[C@H]1C[C@@H]1CCCN1C ZINC001208736143 1133937679 /nfs/dbraw/zinc/93/76/79/1133937679.db2.gz CVCANKBYSLUOIL-IRXDYDNUSA-N 1 3 266.473 3.761 20 0 CHADHO CC(C)CCC[N@@H+]1CCCC[C@@H]1C[C@@H]1CCCN1C ZINC001208736142 1133938058 /nfs/dbraw/zinc/93/80/58/1133938058.db2.gz CVCANKBYSLUOIL-DLBZAZTESA-N 1 3 266.473 3.761 20 0 CHADHO CC(C)CCC[N@H+]1CCCC[C@@H]1C[C@@H]1CCCN1C ZINC001208736142 1133938064 /nfs/dbraw/zinc/93/80/64/1133938064.db2.gz CVCANKBYSLUOIL-DLBZAZTESA-N 1 3 266.473 3.761 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@@H+]1CCN[C@@H](C)CC1 ZINC001210500033 1134230820 /nfs/dbraw/zinc/23/08/20/1134230820.db2.gz ZFVJVBZFZWPCOP-KRWDZBQOSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@H+]1CCN[C@@H](C)CC1 ZINC001210500033 1134230823 /nfs/dbraw/zinc/23/08/23/1134230823.db2.gz ZFVJVBZFZWPCOP-KRWDZBQOSA-N 1 3 294.442 3.846 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)C1 ZINC000309931831 1135118771 /nfs/dbraw/zinc/11/87/71/1135118771.db2.gz WPFPVZLIVCWSDY-DABHTEOTSA-N 1 3 298.474 3.675 20 0 CHADHO Cc1csc(CN2CCCC[C@@]3(CCCC[NH2+]C3)C2)c1 ZINC001222161883 1135203381 /nfs/dbraw/zinc/20/33/81/1135203381.db2.gz SFJALLXKTXSMNX-QGZVFWFLSA-N 1 3 292.492 3.802 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@@H+]1CCC[C@]12CCCNC2 ZINC001222231641 1135211710 /nfs/dbraw/zinc/21/17/10/1135211710.db2.gz OSWAKPFLMQYDIP-IRXDYDNUSA-N 1 3 264.457 3.587 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@H+]1CCC[C@]12CCCNC2 ZINC001222231641 1135211714 /nfs/dbraw/zinc/21/17/14/1135211714.db2.gz OSWAKPFLMQYDIP-IRXDYDNUSA-N 1 3 264.457 3.587 20 0 CHADHO CC(C)=CCC[C@H](C)CN1CCC[C@]12CCC[NH2+]C2 ZINC001222231641 1135211716 /nfs/dbraw/zinc/21/17/16/1135211716.db2.gz OSWAKPFLMQYDIP-IRXDYDNUSA-N 1 3 264.457 3.587 20 0 CHADHO Cc1ccc2[nH]c(CN3CCC[C@]34CCC[NH2+]CC4)cc2c1 ZINC001222316097 1135223995 /nfs/dbraw/zinc/22/39/95/1135223995.db2.gz SMKCKSPMCWLLRF-IBGZPJMESA-N 1 3 297.446 3.584 20 0 CHADHO CC[C@H](NCCC1CC[NH+](CC)CC1)c1ccccc1F ZINC000352794691 529595566 /nfs/dbraw/zinc/59/55/66/529595566.db2.gz HQJHMKNMPACESA-SFHVURJKSA-N 1 3 292.442 3.988 20 0 CHADHO CC[C@H](N[C@@H]1CCC[C@@H]([NH+](C)C)C1)c1cccc(C)c1 ZINC000353525786 529657814 /nfs/dbraw/zinc/65/78/14/529657814.db2.gz ZEWIBWPEGSGPNQ-KURKYZTESA-N 1 3 274.452 3.909 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1cccc(C)c1 ZINC000353525786 529657816 /nfs/dbraw/zinc/65/78/16/529657816.db2.gz ZEWIBWPEGSGPNQ-KURKYZTESA-N 1 3 274.452 3.909 20 0 CHADHO CCCC[C@H](C)[C@@H](C)[NH2+]C[C@H]1CCN(CCC)C1 ZINC000574601028 335033079 /nfs/dbraw/zinc/03/30/79/335033079.db2.gz QIKFRSWDGWUANX-ARFHVFGLSA-N 1 3 254.462 3.523 20 0 CHADHO CCc1ccc(CNCc2ccc([C@H](C)[NH3+])cc2)s1 ZINC000574782202 335047225 /nfs/dbraw/zinc/04/72/25/335047225.db2.gz ZTVIQOGKJSEVCR-LBPRGKRZSA-N 1 3 274.433 3.620 20 0 CHADHO CC(C)CC[C@H](C)[NH2+]CCCN1CCCC[C@@H]1C ZINC000020545055 171242919 /nfs/dbraw/zinc/24/29/19/171242919.db2.gz OJFUJKXEAOUBNN-HOTGVXAUSA-N 1 3 254.462 3.665 20 0 CHADHO CCN(CC)CCC[NH2+][C@H]1C[C@@H](C)CC(C)(C)C1 ZINC000021009376 171286129 /nfs/dbraw/zinc/28/61/29/171286129.db2.gz BHFCHRYQDUYFIO-CABCVRRESA-N 1 3 254.462 3.523 20 0 CHADHO CCCCCN1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000078775211 177385742 /nfs/dbraw/zinc/38/57/42/177385742.db2.gz UEZDVZOPGUTSGG-IRXDYDNUSA-N 1 3 266.473 3.763 20 0 CHADHO CCCCCN1CCC[C@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000078775211 177385744 /nfs/dbraw/zinc/38/57/44/177385744.db2.gz UEZDVZOPGUTSGG-IRXDYDNUSA-N 1 3 266.473 3.763 20 0 CHADHO CCCCC[N@@H+]1CCC[C@H](CN2CCCC[C@@H]2C)C1 ZINC000078775211 177385746 /nfs/dbraw/zinc/38/57/46/177385746.db2.gz UEZDVZOPGUTSGG-IRXDYDNUSA-N 1 3 266.473 3.763 20 0 CHADHO CCCCC[N@H+]1CCC[C@H](CN2CCCC[C@@H]2C)C1 ZINC000078775211 177385747 /nfs/dbraw/zinc/38/57/47/177385747.db2.gz UEZDVZOPGUTSGG-IRXDYDNUSA-N 1 3 266.473 3.763 20 0 CHADHO C[C@@H]1CN(Cc2cccc(-c3ccccc3)c2)CC[C@H]1[NH3+] ZINC000347058563 226008141 /nfs/dbraw/zinc/00/81/41/226008141.db2.gz WRDJPWPKNGNSAB-DNVCBOLYSA-N 1 3 280.415 3.523 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N[C@H](C)c1csc(C)n1 ZINC000036914512 260050862 /nfs/dbraw/zinc/05/08/62/260050862.db2.gz XEDWABKHQGERJB-QWHCGFSZSA-N 1 3 283.485 3.613 20 0 CHADHO CC[C@@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1cccc(Cl)c1 ZINC000037649104 260115563 /nfs/dbraw/zinc/11/55/63/260115563.db2.gz CPWICGKPQTUAFJ-CXAGYDPISA-N 1 3 292.854 3.865 20 0 CHADHO CC[C@@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1cccc(Cl)c1 ZINC000037649104 260115565 /nfs/dbraw/zinc/11/55/65/260115565.db2.gz CPWICGKPQTUAFJ-CXAGYDPISA-N 1 3 292.854 3.865 20 0 CHADHO CC[NH+]1CCC(N[C@H](C)c2ccc(OC(C)C)cc2)CC1 ZINC000037878836 260119011 /nfs/dbraw/zinc/11/90/11/260119011.db2.gz VYHNAVSVIJXEGE-OAHLLOKOSA-N 1 3 290.451 3.609 20 0 CHADHO C1CCC2(C1)CCCC[C@H]2[NH2+][C@H]1CCN2CCC[C@@H]2C1 ZINC000312510715 260135895 /nfs/dbraw/zinc/13/58/95/260135895.db2.gz GQUPAMMYNXXQBC-GVDBMIGSSA-N 1 3 276.468 3.706 20 0 CHADHO C[C@@H](c1ccc(F)c(Cl)c1)N1CCC[C@H](CC[NH3+])C1 ZINC000070169795 260152658 /nfs/dbraw/zinc/15/26/58/260152658.db2.gz JKLOVEUAEPAVKZ-NWDGAFQWSA-N 1 3 284.806 3.601 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CCC[C@H]([C@@H](C)[NH3+])C2)cc1 ZINC000070171482 260153596 /nfs/dbraw/zinc/15/35/96/260153596.db2.gz PMZCRRSZHVWILH-VKJFTORMSA-N 1 3 274.452 3.930 20 0 CHADHO C1C[C@@H]2C[C@H]([NH2+][C@H]3CCCC34CCCCC4)CCN2C1 ZINC000313037047 260240343 /nfs/dbraw/zinc/24/03/43/260240343.db2.gz NEKVRRIQQNLPFY-ZACQAIPSSA-N 1 3 276.468 3.706 20 0 CHADHO CC(C)CN1CCC([NH2+]CC2CCC(C)CC2)CC1 ZINC000222672158 260287526 /nfs/dbraw/zinc/28/75/26/260287526.db2.gz IFEPBUVCDQCDFA-UHFFFAOYSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@@H](c1ccccc1Cl)N(CC1CC[NH2+]CC1)C1CC1 ZINC000094021284 260342875 /nfs/dbraw/zinc/34/28/75/260342875.db2.gz HLPBYCSOEDMRLK-ZDUSSCGKSA-N 1 3 292.854 3.865 20 0 CHADHO CC(C)Oc1ccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000130122679 260394067 /nfs/dbraw/zinc/39/40/67/260394067.db2.gz MIIDCWDURZPSBY-YQQAZPJKSA-N 1 3 290.451 3.607 20 0 CHADHO CC(C)Oc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000130122679 260394068 /nfs/dbraw/zinc/39/40/68/260394068.db2.gz MIIDCWDURZPSBY-YQQAZPJKSA-N 1 3 290.451 3.607 20 0 CHADHO C[C@@H]1CN(Cc2ccc(-c3ccccc3)cc2)CC[C@@H]1[NH3+] ZINC000094338961 262197469 /nfs/dbraw/zinc/19/74/69/262197469.db2.gz HOZPSIKIMBSFJW-BEFAXECRSA-N 1 3 280.415 3.523 20 0 CHADHO CN1CCC[C@@H]1CC[N@@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000502721300 262226165 /nfs/dbraw/zinc/22/61/65/262226165.db2.gz IPDYHIFIXGMJKG-SJORKVTESA-N 1 3 292.854 3.961 20 0 CHADHO CN1CCC[C@@H]1CC[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000502721300 262226167 /nfs/dbraw/zinc/22/61/67/262226167.db2.gz IPDYHIFIXGMJKG-SJORKVTESA-N 1 3 292.854 3.961 20 0 CHADHO CC(C)CN1CCC([NH2+][C@H]2CCCc3sccc32)CC1 ZINC000221943934 262332997 /nfs/dbraw/zinc/33/29/97/262332997.db2.gz SUFXFQKACPZIKD-INIZCTEOSA-N 1 3 292.492 3.836 20 0 CHADHO CCCCN1CCC([NH2+][C@H]2CCCc3occc32)CC1 ZINC000122190685 262344958 /nfs/dbraw/zinc/34/49/58/262344958.db2.gz JKNDNGDRULMHES-INIZCTEOSA-N 1 3 276.424 3.511 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H](Cc2ccccc2)C(C)C)C1 ZINC000187048731 262377437 /nfs/dbraw/zinc/37/74/37/262377437.db2.gz BZEVSBDEVZHCQV-MOPGFXCFSA-N 1 3 288.479 3.575 20 0 CHADHO [NH3+]C[C@H]1CCCC[C@@H]1NCc1cc2ccccc2s1 ZINC000414795722 263050201 /nfs/dbraw/zinc/05/02/01/263050201.db2.gz HACJDQFFWKPUSF-HIFRSBDPSA-N 1 3 274.433 3.508 20 0 CHADHO NC[C@H]1CCCC[C@@H]1[NH2+]Cc1cc2ccccc2s1 ZINC000414795722 263050202 /nfs/dbraw/zinc/05/02/02/263050202.db2.gz HACJDQFFWKPUSF-HIFRSBDPSA-N 1 3 274.433 3.508 20 0 CHADHO Cc1cccc(C)c1CNCc1ccc([C@@H](C)[NH3+])cc1 ZINC000414803439 263051647 /nfs/dbraw/zinc/05/16/47/263051647.db2.gz CQPQEDMCLSRDOT-OAHLLOKOSA-N 1 3 268.404 3.613 20 0 CHADHO Cc1cccc(CNCc2ccc([C@H](C)[NH3+])cc2)c1C ZINC000414809251 263052524 /nfs/dbraw/zinc/05/25/24/263052524.db2.gz LUUSPHBWLDTOLJ-HNNXBMFYSA-N 1 3 268.404 3.613 20 0 CHADHO COc1ccccc1/C=C\CNCc1ccc([C@H](C)[NH3+])cc1 ZINC000414808135 263052545 /nfs/dbraw/zinc/05/25/45/263052545.db2.gz KIIKUTSTNHLZGB-PKYBCLHXSA-N 1 3 296.414 3.518 20 0 CHADHO Clc1scc(CNCC[C@@H]2CCC[NH2+]C2)c1Cl ZINC000414835835 263057018 /nfs/dbraw/zinc/05/70/18/263057018.db2.gz IQGXQGREIWHPOW-VIFPVBQESA-N 1 3 293.263 3.534 20 0 CHADHO [NH3+]C1(CN[C@@H]2CCC[C@H]2c2ccc(F)cc2)CCCCC1 ZINC000414836743 263057292 /nfs/dbraw/zinc/05/72/92/263057292.db2.gz GGJDIHPUYGGBSG-DLBZAZTESA-N 1 3 290.426 3.713 20 0 CHADHO C[C@H]([NH2+]C1CCC(c2ccccc2)CC1)[C@H]1CCCNC1 ZINC000414855000 263071503 /nfs/dbraw/zinc/07/15/03/263071503.db2.gz MOYKHYXMNYDPAX-BARLLCKDSA-N 1 3 286.463 3.691 20 0 CHADHO C[C@H](NCC1([NH3+])CCCCCC1)[C@@H](C)c1ccccc1 ZINC000414858048 263073996 /nfs/dbraw/zinc/07/39/96/263073996.db2.gz HPAPQDQYTJOVNY-CVEARBPZSA-N 1 3 274.452 3.820 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+][C@@H]1CCCNCC1 ZINC000414906323 263113199 /nfs/dbraw/zinc/11/31/99/263113199.db2.gz ARKUPRXUPKNDHZ-QZTJIDSGSA-N 1 3 274.452 3.520 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2c2ccccc2Cl)CCN1 ZINC000414946383 263155194 /nfs/dbraw/zinc/15/51/94/263155194.db2.gz JMBJDJNTWGAHOH-SMKXDYDZSA-N 1 3 292.854 3.706 20 0 CHADHO C[C@@H]1C[C@H](N[C@H]2CCC[C@@H]2c2ccccc2Cl)CC[NH2+]1 ZINC000414946383 263155195 /nfs/dbraw/zinc/15/51/95/263155195.db2.gz JMBJDJNTWGAHOH-SMKXDYDZSA-N 1 3 292.854 3.706 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2c2ccccc2Cl)CCN1 ZINC000414946380 263155355 /nfs/dbraw/zinc/15/53/55/263155355.db2.gz JMBJDJNTWGAHOH-LNCBFAARSA-N 1 3 292.854 3.706 20 0 CHADHO C[C@@H]1C[C@H](N[C@@H]2CCC[C@H]2c2ccccc2Cl)CC[NH2+]1 ZINC000414946380 263155356 /nfs/dbraw/zinc/15/53/56/263155356.db2.gz JMBJDJNTWGAHOH-LNCBFAARSA-N 1 3 292.854 3.706 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](CNCc2c(Cl)cccc2Cl)C1 ZINC000414989118 263185796 /nfs/dbraw/zinc/18/57/96/263185796.db2.gz GSINYJNGBRWADR-GHMZBOCLSA-N 1 3 287.234 3.601 20 0 CHADHO Cc1cc([C@H](C)[NH2+][C@H]2CCC[C@H](N(C)C)C2)cs1 ZINC000453133912 263193854 /nfs/dbraw/zinc/19/38/54/263193854.db2.gz NIFJEBUWWVPVRQ-QEJZJMRPSA-N 1 3 266.454 3.580 20 0 CHADHO CC[C@H](Cc1ccc(Cl)cc1Cl)N[C@@H](C)[C@@H](C)[NH3+] ZINC000415007232 263220639 /nfs/dbraw/zinc/22/06/39/263220639.db2.gz CLPYUDLEGNKJGP-GBIKHYSHSA-N 1 3 289.250 3.640 20 0 CHADHO Cc1ccsc1CN[C@H](CCC[NH3+])c1ccccc1 ZINC000415047633 263258093 /nfs/dbraw/zinc/25/80/93/263258093.db2.gz FFLQERYMGDQEPQ-OAHLLOKOSA-N 1 3 274.433 3.626 20 0 CHADHO c1ccc(C[C@@H]2CCCC[C@H]2[NH2+][C@H]2CCCNCC2)cc1 ZINC000415072783 263262915 /nfs/dbraw/zinc/26/29/15/263262915.db2.gz ABNUNEMCOOWFNE-GBESFXJTSA-N 1 3 286.463 3.520 20 0 CHADHO C[C@H](N[C@H]1CCC[C@H]1C[NH3+])c1ccc(Cl)c(Cl)c1 ZINC000252678190 264305131 /nfs/dbraw/zinc/30/51/31/264305131.db2.gz FFHAAQCNAXYGOX-CHIMOYNISA-N 1 3 287.234 3.771 20 0 CHADHO CCCc1cccc(CN2CCC[C@H]3C[N@H+](C)CC[C@H]32)c1 ZINC000518837995 265122438 /nfs/dbraw/zinc/12/24/38/265122438.db2.gz GPHVFNSDAQVLRX-RBUKOAKNSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1cccc(CN2CCC[C@H]3C[N@@H+](C)CC[C@H]32)c1 ZINC000518837995 265122441 /nfs/dbraw/zinc/12/24/41/265122441.db2.gz GPHVFNSDAQVLRX-RBUKOAKNSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1cccc(C[N@@H+]2CCC[C@H]3CN(C)CC[C@H]32)c1 ZINC000518837995 265122444 /nfs/dbraw/zinc/12/24/44/265122444.db2.gz GPHVFNSDAQVLRX-RBUKOAKNSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1cccc(C[N@H+]2CCC[C@H]3CN(C)CC[C@H]32)c1 ZINC000518837995 265122447 /nfs/dbraw/zinc/12/24/47/265122447.db2.gz GPHVFNSDAQVLRX-RBUKOAKNSA-N 1 3 286.463 3.555 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]C[C@H]2C[C@H]2c2ccccc2)C1 ZINC000348240491 265147783 /nfs/dbraw/zinc/14/77/83/265147783.db2.gz IBIXIGBDIHYSNH-QRQLOZEOSA-N 1 3 286.463 3.500 20 0 CHADHO C[NH+](C)C1(CNc2ccnc3ccccc32)CCCC1 ZINC000096474176 265368062 /nfs/dbraw/zinc/36/80/62/265368062.db2.gz RNPPLNCEXYIQOM-UHFFFAOYSA-N 1 3 269.392 3.521 20 0 CHADHO CC(C)C[C@H](C)C[NH2+]Cc1ccc(CN(C)C)cc1 ZINC000580127645 327705669 /nfs/dbraw/zinc/70/56/69/327705669.db2.gz VTURUHKQCXWGJC-HNNXBMFYSA-N 1 3 262.441 3.520 20 0 CHADHO c1ccc([C@@H](CC2CC2)NCCC[NH+]2CCCC2)cc1 ZINC000531688787 328024101 /nfs/dbraw/zinc/02/41/01/328024101.db2.gz NEVXZDQSUUKXBH-GOSISDBHSA-N 1 3 272.436 3.603 20 0 CHADHO c1ccc([C@@H](CC2CC2)[NH2+]CCCN2CCCC2)cc1 ZINC000531688787 328024102 /nfs/dbraw/zinc/02/41/02/328024102.db2.gz NEVXZDQSUUKXBH-GOSISDBHSA-N 1 3 272.436 3.603 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H]2CCc3c2cccc3Cl)C1 ZINC000531700577 328025682 /nfs/dbraw/zinc/02/56/82/328025682.db2.gz REXPJBNLASSRIO-DYVFJYSZSA-N 1 3 292.854 3.649 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H]2CCc3c2cccc3Cl)C1 ZINC000531700580 328025689 /nfs/dbraw/zinc/02/56/89/328025689.db2.gz REXPJBNLASSRIO-SUMWQHHRSA-N 1 3 292.854 3.649 20 0 CHADHO C[C@H]1C[C@@H]([NH3+])CCN1Cc1cccc(-c2ccccc2)c1 ZINC000571578191 328134819 /nfs/dbraw/zinc/13/48/19/328134819.db2.gz GKKVZHHZFNPFOA-KXBFYZLASA-N 1 3 280.415 3.665 20 0 CHADHO Cc1ccc([C@H](C)NCCCCC[NH+]2CCCCC2)o1 ZINC000164648746 328137525 /nfs/dbraw/zinc/13/75/25/328137525.db2.gz AVTDZOURUDDGKG-INIZCTEOSA-N 1 3 278.440 3.895 20 0 CHADHO C[C@@H](N)[C@@H]1CC[N@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC000414655070 328208694 /nfs/dbraw/zinc/20/86/94/328208694.db2.gz CTHCBFGCRYDQSE-JVGQSUMCSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@@H](N)[C@@H]1CC[N@@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC000414655070 328208695 /nfs/dbraw/zinc/20/86/95/328208695.db2.gz CTHCBFGCRYDQSE-JVGQSUMCSA-N 1 3 286.463 3.630 20 0 CHADHO CC(C)C[C@@H](Cc1cccc(Cl)c1)NC[C@H]([NH3+])C1CC1 ZINC000414884486 328249863 /nfs/dbraw/zinc/24/98/63/328249863.db2.gz FIWZFGFFHPMVSB-IRXDYDNUSA-N 1 3 294.870 3.624 20 0 CHADHO C[C@H](CCC1CCCCC1)[NH2+][C@@H]1CCC[C@@H](N)C1 ZINC000414928607 328273471 /nfs/dbraw/zinc/27/34/71/328273471.db2.gz QIWYHDBFDFQNFP-FVQBIDKESA-N 1 3 252.446 3.595 20 0 CHADHO CC(C)(C)CC[NH2+]C[C@@H]1CNCC[C@@H]1c1ccc(F)cc1 ZINC000414997174 328291582 /nfs/dbraw/zinc/29/15/82/328291582.db2.gz HERLLDKYKIKNAL-DOTOQJQBSA-N 1 3 292.442 3.545 20 0 CHADHO CC(C)C[C@H]([NH3+])CN[C@@H](C)CC(C)(C)c1ccccc1 ZINC000415080335 328302332 /nfs/dbraw/zinc/30/23/32/328302332.db2.gz IXLMMKMAISTDQN-RDJZCZTQSA-N 1 3 276.468 3.706 20 0 CHADHO CCSc1ccc([C@@H](C)NC[C@H]2CCC[N@H+](C)C2)cc1 ZINC000534496748 328304759 /nfs/dbraw/zinc/30/47/59/328304759.db2.gz VAICCWUGKMOYHX-HUUCEWRRSA-N 1 3 292.492 3.791 20 0 CHADHO CCSc1ccc([C@@H](C)NC[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000534496748 328304761 /nfs/dbraw/zinc/30/47/61/328304761.db2.gz VAICCWUGKMOYHX-HUUCEWRRSA-N 1 3 292.492 3.791 20 0 CHADHO CC[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1ccc(Cl)cc1 ZINC000093212017 328510814 /nfs/dbraw/zinc/51/08/14/328510814.db2.gz CQGQQLZBNCWHFM-ZNMIVQPWSA-N 1 3 266.816 3.651 20 0 CHADHO C[NH+](C)CCC1CCN(C/C=C\c2ccc(F)cc2)CC1 ZINC000255564284 326994095 /nfs/dbraw/zinc/99/40/95/326994095.db2.gz RIHLHDJXZLVKRP-ARJAWSKDSA-N 1 3 290.426 3.503 20 0 CHADHO CC(C)c1ccc([C@H](C)N2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)cc1 ZINC000261721557 327035195 /nfs/dbraw/zinc/03/51/95/327035195.db2.gz KGSXJCNNIYCPGI-XDKFSHSGSA-N 1 3 272.436 3.540 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)C/C(C)=C/c2ccccc2)[C@H](C)C1 ZINC000093639234 327198832 /nfs/dbraw/zinc/19/88/32/327198832.db2.gz TZACIYWDEMMGGA-OXDQUIRFSA-N 1 3 286.463 3.752 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)C/C(C)=C/c2ccccc2)[C@H](C)C1 ZINC000093639234 327198834 /nfs/dbraw/zinc/19/88/34/327198834.db2.gz TZACIYWDEMMGGA-OXDQUIRFSA-N 1 3 286.463 3.752 20 0 CHADHO CC(C)C[C@H](C)C[NH2+]C[C@H]1CCCN(CC(C)C)C1 ZINC000584258734 327202728 /nfs/dbraw/zinc/20/27/28/327202728.db2.gz FUMCIRSWFPGIAX-DLBZAZTESA-N 1 3 268.489 3.626 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCc1ccc(-c2ccccc2F)s1 ZINC000566230229 327248558 /nfs/dbraw/zinc/24/85/58/327248558.db2.gz SPIVUZSZQJMXHP-NWDGAFQWSA-N 1 3 292.423 3.770 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@@H]1N[C@H](CC(C)(C)C)c1ccccc1 ZINC000261807154 327352921 /nfs/dbraw/zinc/35/29/21/327352921.db2.gz RWULJKZPYOXVNA-HYVNUMGLSA-N 1 3 274.452 3.752 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H](CC(C)(C)C)c1ccccc1 ZINC000261807154 327352922 /nfs/dbraw/zinc/35/29/22/327352922.db2.gz RWULJKZPYOXVNA-HYVNUMGLSA-N 1 3 274.452 3.752 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)N1CC[C@]2(CC[NH2+]C2)C1 ZINC000261807946 327352998 /nfs/dbraw/zinc/35/29/98/327352998.db2.gz ZKODUUBDZUYHMX-BEFAXECRSA-N 1 3 280.415 3.586 20 0 CHADHO CC[NH+](CC)CC1CCN(Cc2ccsc2C)CC1 ZINC000507213494 332797115 /nfs/dbraw/zinc/79/71/15/332797115.db2.gz OUBTZGKAFFCCJA-UHFFFAOYSA-N 1 3 280.481 3.610 20 0 CHADHO C[C@@H]1CCC[C@H](N[C@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC000261573618 327384917 /nfs/dbraw/zinc/38/49/17/327384917.db2.gz VTMIVTFQRSATCS-OQUILHJVSA-N 1 3 258.409 3.690 20 0 CHADHO CN(C)Cc1ccc(C[NH2+][C@@H]2CC[C@@H]2C(C)(C)C)cc1 ZINC000570505080 327596420 /nfs/dbraw/zinc/59/64/20/327596420.db2.gz YKNLUJUFBWXLRJ-DLBZAZTESA-N 1 3 274.452 3.663 20 0 CHADHO Cc1c2ccccc2oc1C[NH2+][C@@H]1CCN(C)[C@H]2CCC[C@@H]21 ZINC000583709259 329093429 /nfs/dbraw/zinc/09/34/29/329093429.db2.gz SNPMIYVZCOHQNF-ZACQAIPSSA-N 1 3 298.430 3.704 20 0 CHADHO C[C@@H](NCCCCC[NH+]1CCCC1)c1cc(F)cc(F)c1 ZINC000572384112 330037566 /nfs/dbraw/zinc/03/75/66/330037566.db2.gz ALQDEEYBODBIAR-CQSZACIVSA-N 1 3 296.405 3.882 20 0 CHADHO CCCC[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000422710384 330151373 /nfs/dbraw/zinc/15/13/73/330151373.db2.gz LCCVDOXRFPJCTK-HDMKZQKVSA-N 1 3 289.467 3.858 20 0 CHADHO CC[C@H](CN[C@@H]1C[C@@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000422710960 330151571 /nfs/dbraw/zinc/15/15/71/330151571.db2.gz GNNUPHJZSCMJTA-NIKGAXFTSA-N 1 3 280.415 3.915 20 0 CHADHO CC(C)Sc1ccc([C@@H](C)N[C@@H](C)C[C@H](C)[NH3+])cc1 ZINC000422715437 330151792 /nfs/dbraw/zinc/15/17/92/330151792.db2.gz MDBKRHZRSNOMOA-MELADBBJSA-N 1 3 280.481 3.964 20 0 CHADHO CC(C)Sc1ccc([C@@H](C)N[C@H](C)C[C@H](C)[NH3+])cc1 ZINC000422715435 330151896 /nfs/dbraw/zinc/15/18/96/330151896.db2.gz MDBKRHZRSNOMOA-BFHYXJOUSA-N 1 3 280.481 3.964 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@@H](C)CCc1ccccc1 ZINC000422725606 330152354 /nfs/dbraw/zinc/15/23/54/330152354.db2.gz BYMSHIPFOLZMEE-LSDHHAIUSA-N 1 3 297.446 3.521 20 0 CHADHO C[C@@H](N[C@@H](c1ccc(Cl)cc1)C1CCCC1)C1C[NH2+]C1 ZINC000422746912 330153024 /nfs/dbraw/zinc/15/30/24/330153024.db2.gz XNBPABYFHONOKZ-SJKOYZFVSA-N 1 3 292.854 3.769 20 0 CHADHO C[C@H](N[C@@H](C)[C@H]1CCC[NH2+]C1)c1ccc2ccccc2c1 ZINC000422749595 330153298 /nfs/dbraw/zinc/15/32/98/330153298.db2.gz ZVIYJEOEKVXFAH-DOXZYTNZSA-N 1 3 282.431 3.879 20 0 CHADHO [NH3+][C@H]1CCC[C@H]1NCC1(c2cccc(Cl)c2)CCCC1 ZINC000422764428 330153818 /nfs/dbraw/zinc/15/38/18/330153818.db2.gz PMEHMPFTLIFATF-JKSUJKDBSA-N 1 3 292.854 3.621 20 0 CHADHO CC(C)C[C@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1 ZINC000422770603 330154369 /nfs/dbraw/zinc/15/43/69/330154369.db2.gz UWCMAQOGSSPCNC-WFFDWFOESA-N 1 3 272.436 3.646 20 0 CHADHO C[C@H](CN[C@H]1C[C@@H]([NH3+])c2ccccc21)Cc1cccs1 ZINC000422775683 330154472 /nfs/dbraw/zinc/15/44/72/330154472.db2.gz BEELQQJTJSGLTC-VUCTXSBTSA-N 1 3 286.444 3.661 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H](c1ccccc1)C1CCCC1 ZINC000422777753 330154732 /nfs/dbraw/zinc/15/47/32/330154732.db2.gz GLVISXKGVXGUEP-JJRVBVJISA-N 1 3 260.425 3.633 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)[C@H]1CCCNC1)[C@H](C)C1CCCCC1 ZINC000422822796 330156454 /nfs/dbraw/zinc/15/64/54/330156454.db2.gz KQGIAVFJVAYDTA-IVSAIRAKSA-N 1 3 266.473 3.569 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](c1cccc(F)c1)C(C)(C)C ZINC000422840442 330157231 /nfs/dbraw/zinc/15/72/31/330157231.db2.gz SYCIOPBGPDRYJK-ZOWXZIJZSA-N 1 3 266.404 3.628 20 0 CHADHO [NH3+][C@@H]1CCC[C@H]1NCC1(Sc2ccccc2)CCCC1 ZINC000422912488 330160111 /nfs/dbraw/zinc/16/01/11/330160111.db2.gz WGZPJMVBIQPXBT-HZPDHXFCSA-N 1 3 290.476 3.561 20 0 CHADHO CC[C@@H](N[C@@H](C)CCCC[NH3+])c1cc(F)ccc1F ZINC000422923640 330160480 /nfs/dbraw/zinc/16/04/80/330160480.db2.gz SEOIBZPXVWYSKK-XHDPSFHLSA-N 1 3 270.367 3.523 20 0 CHADHO CCCc1ccc([C@@H](N[C@@H](C)C2C[NH2+]C2)C(C)C)cc1 ZINC000422937204 330161404 /nfs/dbraw/zinc/16/14/04/330161404.db2.gz NZBPYUDPMWPWPM-KSSFIOAISA-N 1 3 274.452 3.534 20 0 CHADHO CCCc1ccc([C@@H]([NH2+][C@@H](C)C2CNC2)C(C)C)cc1 ZINC000422937204 330161406 /nfs/dbraw/zinc/16/14/06/330161406.db2.gz NZBPYUDPMWPWPM-KSSFIOAISA-N 1 3 274.452 3.534 20 0 CHADHO CC1(C)CC[C@H](N[C@H]2CCC[NH2+]CC2)c2ccccc21 ZINC000422943126 330161794 /nfs/dbraw/zinc/16/17/94/330161794.db2.gz KEHMYEACOWTSET-YOEHRIQHSA-N 1 3 272.436 3.531 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@H](Cc1ccccc1)c1cccs1 ZINC000422979820 330162566 /nfs/dbraw/zinc/16/25/66/330162566.db2.gz KKPAOUIQKXRBTB-OFQRWUPVSA-N 1 3 288.460 3.747 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]CC(C)(C)CCCc1ccccc1 ZINC000422983923 330162682 /nfs/dbraw/zinc/16/26/82/330162682.db2.gz VWRQBLRKOLHBLK-JKSUJKDBSA-N 1 3 276.468 3.751 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]CC(C)(C)CCCc1ccccc1 ZINC000422983921 330162723 /nfs/dbraw/zinc/16/27/23/330162723.db2.gz VWRQBLRKOLHBLK-HOTGVXAUSA-N 1 3 276.468 3.751 20 0 CHADHO C[C@@H](N)C[C@H](C)[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC000422989889 330162990 /nfs/dbraw/zinc/16/29/90/330162990.db2.gz MKTHQGBHYXQWJL-WWXIPJKBSA-N 1 3 274.452 3.602 20 0 CHADHO CC[C@H](CSc1ccc(C)c(C)c1)N[C@@H](C)C[C@H](C)[NH3+] ZINC000422998459 330163452 /nfs/dbraw/zinc/16/34/52/330163452.db2.gz CUJMENDVHPAKEA-HRCADAONSA-N 1 3 294.508 3.890 20 0 CHADHO CC[C@H](CSc1ccc(C)c(C)c1)[NH2+][C@@H](C)C[C@H](C)N ZINC000422998459 330163453 /nfs/dbraw/zinc/16/34/53/330163453.db2.gz CUJMENDVHPAKEA-HRCADAONSA-N 1 3 294.508 3.890 20 0 CHADHO C[C@@H](CCC[NH3+])N[C@@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000423029394 330166174 /nfs/dbraw/zinc/16/61/74/330166174.db2.gz UZWWNFAJAKDGME-GWCFXTLKSA-N 1 3 292.320 3.536 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CCCNCC1)C1(c2ccccc2)CCCC1 ZINC000423045926 330167101 /nfs/dbraw/zinc/16/71/01/330167101.db2.gz CXMXIJNVCCMDEE-SJLPKXTDSA-N 1 3 286.463 3.619 20 0 CHADHO C[C@H]([NH2+][C@H]1CCCNCC1)C1(c2ccccc2)CCCC1 ZINC000423045928 330167159 /nfs/dbraw/zinc/16/71/59/330167159.db2.gz CXMXIJNVCCMDEE-WMZOPIPTSA-N 1 3 286.463 3.619 20 0 CHADHO NC[C@H]1CCC[C@H]1[NH2+]CC1(Cc2ccccc2)CCCC1 ZINC000423049474 330167167 /nfs/dbraw/zinc/16/71/67/330167167.db2.gz XSBCGSBBYREHDY-QZTJIDSGSA-N 1 3 286.463 3.507 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](C)c1cc2ccccc2s1 ZINC000423058673 330167753 /nfs/dbraw/zinc/16/77/53/330167753.db2.gz KBXPILSWCUZMOS-SRVKXCTJSA-N 1 3 262.422 3.678 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC1(C)CCC(C)CC1 ZINC000423086241 330168795 /nfs/dbraw/zinc/16/87/95/330168795.db2.gz MONHMVFSGRQYBE-FVRSWCFKSA-N 1 3 289.467 3.716 20 0 CHADHO CC(C)[C@H]1C[C@@H](N[C@@H]2CCC[NH2+]CC2)c2ccccc21 ZINC000423089785 330169074 /nfs/dbraw/zinc/16/90/74/330169074.db2.gz VYROMWUHMBVLGO-ZTFGCOKTSA-N 1 3 272.436 3.603 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H](C)CC1CCCCC1 ZINC000423087645 330169156 /nfs/dbraw/zinc/16/91/56/330169156.db2.gz ONSWYZSJDDFNPO-KGLIPLIRSA-N 1 3 289.467 3.858 20 0 CHADHO c1ccc([C@H](CN[C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)C2CC2)cc1 ZINC000423122787 330171234 /nfs/dbraw/zinc/17/12/34/330171234.db2.gz CZULOODJUZLJSF-FUMNGEBKSA-N 1 3 298.474 3.691 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CC(C)(C)C(C)(C)C ZINC000423131811 330171829 /nfs/dbraw/zinc/17/18/29/330171829.db2.gz OLLXWWDOIPTNMF-GFCCVEGCSA-N 1 3 277.456 3.572 20 0 CHADHO C[C@@H](N[C@@H]1CCC[NH2+]CC1)c1ccc(F)c2ccccc21 ZINC000423137154 330172370 /nfs/dbraw/zinc/17/23/70/330172370.db2.gz ZSVIVMCWPBQUGB-ZIAGYGMSSA-N 1 3 286.394 3.772 20 0 CHADHO [NH3+][C@H]1C[C@H](NCC2(C3CCC3)CCC2)c2ccccc21 ZINC000423162350 330173729 /nfs/dbraw/zinc/17/37/29/330173729.db2.gz KQWVDMLCBVYMQU-IRXDYDNUSA-N 1 3 270.420 3.691 20 0 CHADHO Cc1ccc(CN[C@H]2CC[NH2+]CC[C@@H]2C)c2ccccc12 ZINC000423172109 330174530 /nfs/dbraw/zinc/17/45/30/330174530.db2.gz RIMZWDLAPSDYTK-KXBFYZLASA-N 1 3 282.431 3.626 20 0 CHADHO Clc1ccc([C@@H]2CC[C@H]([NH2+][C@H]3CCCNCC3)C2)cc1 ZINC000423174189 330174857 /nfs/dbraw/zinc/17/48/57/330174857.db2.gz BOHYGERWNRWDEE-PVAVHDDUSA-N 1 3 292.854 3.708 20 0 CHADHO NC1(C[NH2+][C@@H](c2ccc(F)cc2)C2CC2)CCCCC1 ZINC000423176806 330175033 /nfs/dbraw/zinc/17/50/33/330175033.db2.gz HYNZTTPEDIGERN-MRXNPFEDSA-N 1 3 276.399 3.528 20 0 CHADHO Clc1ccc([C@@H](CC2CC2)[NH2+]C2CCNCC2)cc1 ZINC000423179655 330175234 /nfs/dbraw/zinc/17/52/34/330175234.db2.gz HWXVBXLWSLCPRT-MRXNPFEDSA-N 1 3 278.827 3.523 20 0 CHADHO CC(C)(C)[C@H](CCC1CCCC1)[NH2+]C1CCNCC1 ZINC000423180139 330175434 /nfs/dbraw/zinc/17/54/34/330175434.db2.gz IEVCXDGJAPMIDL-INIZCTEOSA-N 1 3 266.473 3.713 20 0 CHADHO CC(C)CC[C@@H]1CC[C@H]([NH2+][C@@H](C)[C@@H]2CCCNC2)C1 ZINC000423205172 330177062 /nfs/dbraw/zinc/17/70/62/330177062.db2.gz AZILXZQZPOHECX-HZMVEIRTSA-N 1 3 266.473 3.569 20 0 CHADHO Clc1cccc([C@@H]2CC[C@@H]([NH2+]C[C@H]3CCCNC3)C2)c1 ZINC000423208252 330177248 /nfs/dbraw/zinc/17/72/48/330177248.db2.gz HOXMLRJQOBRBHF-YSVLISHTSA-N 1 3 292.854 3.565 20 0 CHADHO C[C@H](N[C@@H](C)[C@H]1CCC[NH2+]C1)c1cc2c(s1)CCCC2 ZINC000423212633 330177935 /nfs/dbraw/zinc/17/79/35/330177935.db2.gz ISTMZNPDKRJUAD-YDHLFZDLSA-N 1 3 292.492 3.666 20 0 CHADHO C[C@H]([NH2+][C@@H](C)[C@H]1CCCNC1)c1cc2c(s1)CCCC2 ZINC000423212633 330177936 /nfs/dbraw/zinc/17/79/36/330177936.db2.gz ISTMZNPDKRJUAD-YDHLFZDLSA-N 1 3 292.492 3.666 20 0 CHADHO C[C@H](N)CC[NH2+][C@@H]1CCC[C@H](c2cccc(Cl)c2)C1 ZINC000423222641 330179868 /nfs/dbraw/zinc/17/98/68/330179868.db2.gz BYQQXPIOWAKZFS-DUVNUKRYSA-N 1 3 280.843 3.693 20 0 CHADHO CC(C)Sc1ccc([C@H](C)[NH2+]CC(C)(C)N)cc1 ZINC000423281372 330185537 /nfs/dbraw/zinc/18/55/37/330185537.db2.gz BDFNUMLAFIWCPD-LBPRGKRZSA-N 1 3 266.454 3.575 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCCc2c3ccccc3[nH]c21 ZINC000423282464 330185799 /nfs/dbraw/zinc/18/57/99/330185799.db2.gz VCLHDKWGIXRAJJ-QANKJYHBSA-N 1 3 297.446 3.652 20 0 CHADHO [NH3+]C[C@@H]1CCCC[C@@H]1N[C@@H]1CCCc2c3ccccc3[nH]c21 ZINC000423282464 330185800 /nfs/dbraw/zinc/18/58/00/330185800.db2.gz VCLHDKWGIXRAJJ-QANKJYHBSA-N 1 3 297.446 3.652 20 0 CHADHO NC[C@@H]1CCCC[C@H]1[NH2+][C@H]1CCCc2c3ccccc3[nH]c21 ZINC000423282465 330185809 /nfs/dbraw/zinc/18/58/09/330185809.db2.gz VCLHDKWGIXRAJJ-XCRHUMRWSA-N 1 3 297.446 3.652 20 0 CHADHO [NH3+]C[C@@H]1CCCC[C@H]1N[C@H]1CCCc2c3ccccc3[nH]c21 ZINC000423282465 330185811 /nfs/dbraw/zinc/18/58/11/330185811.db2.gz VCLHDKWGIXRAJJ-XCRHUMRWSA-N 1 3 297.446 3.652 20 0 CHADHO CC[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1cccc(OC)c1 ZINC000423288972 330186507 /nfs/dbraw/zinc/18/65/07/330186507.db2.gz AEVQWHOZBHXDKT-IFXJQAMLSA-N 1 3 298.430 3.956 20 0 CHADHO C[C@H](NCC(C)(C)[NH3+])C(c1ccccc1)c1ccccc1 ZINC000423290336 330186723 /nfs/dbraw/zinc/18/67/23/330186723.db2.gz ZSRVUEPXLWZCGU-HNNXBMFYSA-N 1 3 282.431 3.534 20 0 CHADHO CCC([NH3+])(CC)CN[C@H]1C[C@@H](c2ccccc2)C1(C)C ZINC000423290357 330186750 /nfs/dbraw/zinc/18/67/50/330186750.db2.gz ZTYMNNZRUHHIGI-HOTGVXAUSA-N 1 3 274.452 3.676 20 0 CHADHO CCC([NH3+])(CC)CN[C@@H](Cc1ccccc1Cl)C1CC1 ZINC000423290764 330186925 /nfs/dbraw/zinc/18/69/25/330186925.db2.gz FJHYWZSHAVDZBU-INIZCTEOSA-N 1 3 294.870 3.768 20 0 CHADHO COc1ccc([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)c(C)c1 ZINC000423291060 330187172 /nfs/dbraw/zinc/18/71/72/330187172.db2.gz GMWBCJYAUVGWKH-LSDHHAIUSA-N 1 3 298.430 3.874 20 0 CHADHO COc1ccc([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)c(C)c1 ZINC000423291058 330187240 /nfs/dbraw/zinc/18/72/40/330187240.db2.gz GMWBCJYAUVGWKH-GJZGRUSLSA-N 1 3 298.430 3.874 20 0 CHADHO Cc1ccccc1[C@H](C)NCc1ccc([C@@H](C)[NH3+])cc1 ZINC000423292506 330187340 /nfs/dbraw/zinc/18/73/40/330187340.db2.gz NFMJUDUXRNXIII-CABCVRRESA-N 1 3 268.404 3.866 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H]2CCCc3c(O)cccc32)cc1 ZINC000423293107 330187817 /nfs/dbraw/zinc/18/78/17/330187817.db2.gz PSTVWYWNZXYSKH-FZKQIMNGSA-N 1 3 296.414 3.579 20 0 CHADHO N[C@H](C[NH2+][C@@H](c1ccc(Cl)c(Cl)c1)C1CC1)C1CC1 ZINC000423313176 330189730 /nfs/dbraw/zinc/18/97/30/330189730.db2.gz FGWSNIGBKHQCOE-HUUCEWRRSA-N 1 3 299.245 3.771 20 0 CHADHO CC(C)Sc1ccc([C@H](C)[NH2+]C[C@H](N)C2CC2)cc1 ZINC000423317880 330190111 /nfs/dbraw/zinc/19/01/11/330190111.db2.gz KUCZZZNYBGTMSB-LRDDRELGSA-N 1 3 278.465 3.575 20 0 CHADHO C[C@H](CC(C)(C)c1c[nH]c2ccccc21)NC[C@@H]([NH3+])C1CC1 ZINC000423322194 330190460 /nfs/dbraw/zinc/19/04/60/330190460.db2.gz NVDVOAQMLGCRRF-CXAGYDPISA-N 1 3 299.462 3.551 20 0 CHADHO Clc1ccc([C@@H]2CCC[C@H](NC[C@H]3CC[NH2+]C3)C2)cc1 ZINC000423328496 330191034 /nfs/dbraw/zinc/19/10/34/330191034.db2.gz DSJPOHXDZQHUDP-LXZKKBNFSA-N 1 3 292.854 3.565 20 0 CHADHO C[C@H](NC[C@]1(C)CCC[NH2+]C1)c1cc2c(s1)CCCC2 ZINC000423345332 330192403 /nfs/dbraw/zinc/19/24/03/330192403.db2.gz YTNMXPUZANEJAW-SUMWQHHRSA-N 1 3 292.492 3.667 20 0 CHADHO C[C@H]([NH2+]C[C@]1(C)CCCNC1)c1cc2c(s1)CCCC2 ZINC000423345332 330192405 /nfs/dbraw/zinc/19/24/05/330192405.db2.gz YTNMXPUZANEJAW-SUMWQHHRSA-N 1 3 292.492 3.667 20 0 CHADHO CC[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccc(F)cc1 ZINC000423352440 330192848 /nfs/dbraw/zinc/19/28/48/330192848.db2.gz ATEGXIDDCBSZIT-GOSISDBHSA-N 1 3 284.378 3.670 20 0 CHADHO Clc1cccc([C@H]2CC[C@@H](NCC[C@H]3CCC[NH2+]3)C2)c1 ZINC000423355548 330193481 /nfs/dbraw/zinc/19/34/81/330193481.db2.gz ICLGJFMNAYVBLN-USXIJHARSA-N 1 3 292.854 3.708 20 0 CHADHO N[C@@H]1CCC[C@@H]([NH2+][C@H](Cc2ccccc2Cl)C2CC2)C1 ZINC000423360965 330193706 /nfs/dbraw/zinc/19/37/06/330193706.db2.gz GILUCECUHZKJHF-BFYDXBDKSA-N 1 3 292.854 3.521 20 0 CHADHO Cc1ccc(C)c([C@@H](C)NCc2ccc3c(c2)C[NH2+]C3)c1 ZINC000423362846 330194129 /nfs/dbraw/zinc/19/41/29/330194129.db2.gz TXXYZJWNSHXRRY-OAHLLOKOSA-N 1 3 280.415 3.757 20 0 CHADHO CCC[C@H]([NH2+][C@@H]1CCNC[C@H]1C)c1ccc(Cl)cc1 ZINC000423363924 330194381 /nfs/dbraw/zinc/19/43/81/330194381.db2.gz CDEDSFXDBGZPNU-WQVCFCJDSA-N 1 3 280.843 3.769 20 0 CHADHO CCC[C@H]([NH2+][C@@H]1CCC[C@@H](N)C1)C1CCCCC1 ZINC000423363722 330194424 /nfs/dbraw/zinc/19/44/24/330194424.db2.gz AGKKMXZKUSUKNC-OAGGEKHMSA-N 1 3 252.446 3.595 20 0 CHADHO CCCC[C@H]([NH2+][C@@H]1CCN[C@@H](C)C1)c1ccccc1 ZINC000423370141 330194870 /nfs/dbraw/zinc/19/48/70/330194870.db2.gz GTBHFQWLEOUPNT-UAGQMJEPSA-N 1 3 260.425 3.648 20 0 CHADHO Fc1ccc2c(c1)CCC[C@@H]2NCc1ccc2c(c1)C[NH2+]C2 ZINC000423372829 330195350 /nfs/dbraw/zinc/19/53/50/330195350.db2.gz HGGVNXUAHSYCRN-IBGZPJMESA-N 1 3 296.389 3.596 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@@H]([NH3+])C1)c1ccc2ccccc2c1 ZINC000423403936 330196559 /nfs/dbraw/zinc/19/65/59/330196559.db2.gz XKXCRAWUNDXJND-MORSLUCNSA-N 1 3 268.404 3.760 20 0 CHADHO CC(C)COc1ccc([C@H](C)N[C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000423405477 330196568 /nfs/dbraw/zinc/19/65/68/330196568.db2.gz YAFTWRUIJRAQGK-XIRDDKMYSA-N 1 3 290.451 3.642 20 0 CHADHO C[C@H]1[C@H](c2ccccc2)C[C@@H]1[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423382160 330199134 /nfs/dbraw/zinc/19/91/34/330199134.db2.gz JXNPWMIKWKENFT-KPOBHBOGSA-N 1 3 292.426 3.572 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCN[C@H](C)C1)c1cccc(Cl)c1 ZINC000423383199 330199265 /nfs/dbraw/zinc/19/92/65/330199265.db2.gz PGEXXCFVDVUPOL-UGFHNGPFSA-N 1 3 266.816 3.521 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H]1CCCCc2ccc(Cl)cc21 ZINC000423384468 330199514 /nfs/dbraw/zinc/19/95/14/330199514.db2.gz FZRUGERXVRNKBJ-DQYPLSBCSA-N 1 3 292.854 3.695 20 0 CHADHO CCCC[C@H](N[C@H]1CC[NH2+]C[C@H]1C)c1ccccc1 ZINC000423384491 330199688 /nfs/dbraw/zinc/19/96/88/330199688.db2.gz GAAXVVPWWHYOFI-PVAVHDDUSA-N 1 3 260.425 3.506 20 0 CHADHO CCCC[C@H]([NH2+][C@H]1CCNC[C@H]1C)c1ccccc1 ZINC000423384491 330199689 /nfs/dbraw/zinc/19/96/89/330199689.db2.gz GAAXVVPWWHYOFI-PVAVHDDUSA-N 1 3 260.425 3.506 20 0 CHADHO CC[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)c1ccc(Cl)s1 ZINC000423384290 330199741 /nfs/dbraw/zinc/19/97/41/330199741.db2.gz KSFAKOUBOQIYCX-VWYCJHECSA-N 1 3 272.845 3.712 20 0 CHADHO CC[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1ccc(Cl)s1 ZINC000423384287 330199751 /nfs/dbraw/zinc/19/97/51/330199751.db2.gz KSFAKOUBOQIYCX-AXFHLTTASA-N 1 3 272.845 3.712 20 0 CHADHO c1cc(C[NH2+][C@H]2CCCC23CCCCC3)cc2c1CNC2 ZINC000423393122 330200603 /nfs/dbraw/zinc/20/06/03/330200603.db2.gz QLCFLTXSJXZJTM-SFHVURJKSA-N 1 3 284.447 3.882 20 0 CHADHO CC(C)[C@H]1C[C@@H]([NH2+][C@@H]2CCN[C@H](C)C2)c2ccccc21 ZINC000423394086 330200755 /nfs/dbraw/zinc/20/07/55/330200755.db2.gz ZLYSBKLKACQZIM-DTTOXWODSA-N 1 3 272.436 3.601 20 0 CHADHO Cc1c2ccccc2oc1[C@H](C)N[C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423452884 330203190 /nfs/dbraw/zinc/20/31/90/330203190.db2.gz ZKTANGOEBNLQNO-RRQGHBQHSA-N 1 3 298.430 3.780 20 0 CHADHO C[C@H](NC[C@H]1CCC[C@H]([NH3+])C1)c1ccc(F)cc1Cl ZINC000423455115 330203322 /nfs/dbraw/zinc/20/33/22/330203322.db2.gz DRFFPNCEEMFYJP-GVXVVHGQSA-N 1 3 284.806 3.647 20 0 CHADHO CC[C@@H](N)C[NH2+][C@H](CC)c1ccc(Cl)c(Cl)c1 ZINC000423461103 330204110 /nfs/dbraw/zinc/20/41/10/330204110.db2.gz JJWKCKHIFZAWFE-ZWNOBZJWSA-N 1 3 275.223 3.771 20 0 CHADHO CC[C@H](C)[C@@H](C)[NH2+]C[C@@H]1CNCC[C@@H]1c1ccc(F)cc1 ZINC000423476798 330205588 /nfs/dbraw/zinc/20/55/88/330205588.db2.gz RNJVPBKKWDWSLW-JSSFPYSZSA-N 1 3 292.442 3.543 20 0 CHADHO C[C@H](N[C@@H]1CC[C@H](C[NH3+])C1)c1cc(Cl)sc1Cl ZINC000423494180 330207612 /nfs/dbraw/zinc/20/76/12/330207612.db2.gz RWQPYCVIAUPYEH-XHNCKOQMSA-N 1 3 293.263 3.833 20 0 CHADHO C[C@H](N[C@H]1CC[C@@H](C[NH3+])C1)c1cc(Cl)ccc1Cl ZINC000423496349 330207953 /nfs/dbraw/zinc/20/79/53/330207953.db2.gz WLVXABNSBICYCY-UMNHJUIQSA-N 1 3 287.234 3.771 20 0 CHADHO Cc1ccncc1[C@H](C)N[C@H](CCC[NH3+])c1ccccc1 ZINC000423497045 330207984 /nfs/dbraw/zinc/20/79/84/330207984.db2.gz FWTDTUDQRODZPN-MAUKXSAKSA-N 1 3 283.419 3.521 20 0 CHADHO C[C@H](N[C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc(F)cc1Cl ZINC000423538725 330210852 /nfs/dbraw/zinc/21/08/52/330210852.db2.gz HABGUHQXBLCKLJ-CIQGVGRVSA-N 1 3 296.817 3.518 20 0 CHADHO C[C@H](N[C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc(F)cc1Cl ZINC000423538727 330210858 /nfs/dbraw/zinc/21/08/58/330210858.db2.gz HABGUHQXBLCKLJ-KZVDOYCCSA-N 1 3 296.817 3.518 20 0 CHADHO COc1ccc([C@H](C)[NH2+][C@H]2CCCCNC2)c2ccccc12 ZINC000423570793 330212250 /nfs/dbraw/zinc/21/22/50/330212250.db2.gz XDBHTORJVSRSIG-GJZGRUSLSA-N 1 3 298.430 3.641 20 0 CHADHO C[C@H](C[NH2+]CCCN1CCCC[C@@H]1C)c1ccc(F)cc1 ZINC000527116831 330223347 /nfs/dbraw/zinc/22/33/47/330223347.db2.gz LAUAPSUSCLHHEP-CVEARBPZSA-N 1 3 292.442 3.783 20 0 CHADHO C[C@H](CNCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(F)cc1 ZINC000527116831 330223348 /nfs/dbraw/zinc/22/33/48/330223348.db2.gz LAUAPSUSCLHHEP-CVEARBPZSA-N 1 3 292.442 3.783 20 0 CHADHO C[C@H](CNCCC[N@H+]1CCCC[C@@H]1C)c1ccc(F)cc1 ZINC000527116831 330223350 /nfs/dbraw/zinc/22/33/50/330223350.db2.gz LAUAPSUSCLHHEP-CVEARBPZSA-N 1 3 292.442 3.783 20 0 CHADHO C[NH+](C)Cc1cccc(CNCc2ccc3cc[nH]c3c2)c1 ZINC000527634327 330267339 /nfs/dbraw/zinc/26/73/39/330267339.db2.gz MGBWFYBEQZNOTC-UHFFFAOYSA-N 1 3 293.414 3.519 20 0 CHADHO CN1CC=C(C[NH2+][C@H]2CCC[C@@H](c3ccccc3)CC2)CC1 ZINC000527682510 330271168 /nfs/dbraw/zinc/27/11/68/330271168.db2.gz HJZAHRHFUSROGQ-UXHICEINSA-N 1 3 298.474 3.954 20 0 CHADHO CC(C)c1cccc([C@@H](C)NC[C@@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000527850767 330288307 /nfs/dbraw/zinc/28/83/07/330288307.db2.gz NZTYWPYVYPCWRB-CVEARBPZSA-N 1 3 286.463 3.945 20 0 CHADHO CC(C)c1cccc([C@@H](C)NC[C@@H]2CC[N@H+](C3CC3)C2)c1 ZINC000527850767 330288308 /nfs/dbraw/zinc/28/83/08/330288308.db2.gz NZTYWPYVYPCWRB-CVEARBPZSA-N 1 3 286.463 3.945 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H](CC)CCc2ccccc2)C1 ZINC000527855324 330288915 /nfs/dbraw/zinc/28/89/15/330288915.db2.gz WAYUZHBNFUUNNI-MOPGFXCFSA-N 1 3 288.479 3.719 20 0 CHADHO Cc1cc(C)c([C@H](C)NC[C@@H]2CCC[N@H+](C)C2)cc1C ZINC000044534199 330329714 /nfs/dbraw/zinc/32/97/14/330329714.db2.gz BZCDDUFVZXAZQB-IRXDYDNUSA-N 1 3 274.452 3.604 20 0 CHADHO Cc1cc(C)c([C@H](C)NC[C@@H]2CCC[N@@H+](C)C2)cc1C ZINC000044534199 330329715 /nfs/dbraw/zinc/32/97/15/330329715.db2.gz BZCDDUFVZXAZQB-IRXDYDNUSA-N 1 3 274.452 3.604 20 0 CHADHO C[C@@H](NCCCC[NH+](C)C)c1cc(Cl)ccc1Cl ZINC000045663114 330347623 /nfs/dbraw/zinc/34/76/23/330347623.db2.gz JNPBRLBIGRZFQS-LLVKDONJSA-N 1 3 289.250 3.986 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@@H]1C[NH3+])c1ccc(Cl)c(Cl)c1 ZINC000089147700 330380917 /nfs/dbraw/zinc/38/09/17/330380917.db2.gz FFHAAQCNAXYGOX-DRCTWCGVSA-N 1 3 287.234 3.771 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1N[C@@H]1CCCc2cc(F)ccc21 ZINC000090964343 330397290 /nfs/dbraw/zinc/39/72/90/330397290.db2.gz NSNHKKMVHSZSBZ-JGTCGTHISA-N 1 3 290.426 3.521 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1N[C@@H]1CCCc2cc(F)ccc21 ZINC000090964343 330397291 /nfs/dbraw/zinc/39/72/91/330397291.db2.gz NSNHKKMVHSZSBZ-JGTCGTHISA-N 1 3 290.426 3.521 20 0 CHADHO C[C@H]([NH2+]CC[C@H]1CCCN1C)c1cccc(C2CC2)c1 ZINC000451108990 331015765 /nfs/dbraw/zinc/01/57/65/331015765.db2.gz AYXOLXYLGUJHFN-KBXCAEBGSA-N 1 3 272.436 3.699 20 0 CHADHO C[C@@H]([NH2+]CC[C@@H]1CCCN1C)c1cccc(C2CC2)c1 ZINC000451108991 331015783 /nfs/dbraw/zinc/01/57/83/331015783.db2.gz AYXOLXYLGUJHFN-KDOFPFPSSA-N 1 3 272.436 3.699 20 0 CHADHO CC(C)CN1CCC[C@@H](C[NH2+][C@@H](C2CC2)C2CCC2)C1 ZINC000453178867 331097675 /nfs/dbraw/zinc/09/76/75/331097675.db2.gz UFJZRCNPVNRYQE-MAUKXSAKSA-N 1 3 278.484 3.523 20 0 CHADHO C[C@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cc2c(s1)CCC2 ZINC000453373183 331124406 /nfs/dbraw/zinc/12/44/06/331124406.db2.gz WWAVOFNWTCBBNE-PRTUASRFSA-N 1 3 290.476 3.513 20 0 CHADHO C[C@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc2c(s1)CCC2 ZINC000453373183 331124407 /nfs/dbraw/zinc/12/44/07/331124407.db2.gz WWAVOFNWTCBBNE-PRTUASRFSA-N 1 3 290.476 3.513 20 0 CHADHO Cc1ccc(C[NH2+]C2CCN(CC3CC3)CC2)cc1Cl ZINC000195437849 331173425 /nfs/dbraw/zinc/17/34/25/331173425.db2.gz YBVQLISQMCUGEB-UHFFFAOYSA-N 1 3 292.854 3.612 20 0 CHADHO c1ccc([C@@H]2C[C@H]2C[N@@H+]2CC[C@@H](CN3CCCCC3)C2)cc1 ZINC000459380210 331279312 /nfs/dbraw/zinc/27/93/12/331279312.db2.gz SQTRIKJGZDPUTP-IHPCNDPISA-N 1 3 298.474 3.598 20 0 CHADHO c1ccc([C@@H]2C[C@H]2C[N@H+]2CC[C@@H](CN3CCCCC3)C2)cc1 ZINC000459380210 331279313 /nfs/dbraw/zinc/27/93/13/331279313.db2.gz SQTRIKJGZDPUTP-IHPCNDPISA-N 1 3 298.474 3.598 20 0 CHADHO c1ccc([C@@H]2C[C@H]2CN2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC000459380210 331279314 /nfs/dbraw/zinc/27/93/14/331279314.db2.gz SQTRIKJGZDPUTP-IHPCNDPISA-N 1 3 298.474 3.598 20 0 CHADHO C[C@@H](c1ccc2c(c1)CCC2)[N@@H+]1CCC[C@@H](N(C)C)CC1 ZINC000459418179 331280474 /nfs/dbraw/zinc/28/04/74/331280474.db2.gz FQONOWJDVXALEU-HNAYVOBHSA-N 1 3 286.463 3.652 20 0 CHADHO C[C@@H](c1ccc2c(c1)CCC2)[N@H+]1CCC[C@@H](N(C)C)CC1 ZINC000459418179 331280475 /nfs/dbraw/zinc/28/04/75/331280475.db2.gz FQONOWJDVXALEU-HNAYVOBHSA-N 1 3 286.463 3.652 20 0 CHADHO CN(C)[C@H]1CCC[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC000459435970 331281264 /nfs/dbraw/zinc/28/12/64/331281264.db2.gz XYYTWDFCEIBQAL-MSOLQXFVSA-N 1 3 272.436 3.526 20 0 CHADHO CC[C@@H](NCC[C@@H]1CCC[N@H+](C)C1)c1ccccc1F ZINC000459724242 331295798 /nfs/dbraw/zinc/29/57/98/331295798.db2.gz AKIMHFIXFLXIJE-WMLDXEAASA-N 1 3 278.415 3.598 20 0 CHADHO CC[C@@H](NCC[C@@H]1CCC[N@@H+](C)C1)c1ccccc1F ZINC000459724242 331295799 /nfs/dbraw/zinc/29/57/99/331295799.db2.gz AKIMHFIXFLXIJE-WMLDXEAASA-N 1 3 278.415 3.598 20 0 CHADHO C[C@@H](NCC[C@H]1CCC[N@H+](C)C1)c1cc2ccccc2o1 ZINC000459732681 331296744 /nfs/dbraw/zinc/29/67/44/331296744.db2.gz MNMMNLOFENQHJF-HUUCEWRRSA-N 1 3 286.419 3.815 20 0 CHADHO C[C@@H](NCC[C@H]1CCC[N@@H+](C)C1)c1cc2ccccc2o1 ZINC000459732681 331296745 /nfs/dbraw/zinc/29/67/45/331296745.db2.gz MNMMNLOFENQHJF-HUUCEWRRSA-N 1 3 286.419 3.815 20 0 CHADHO CC[C@H]([NH2+]C[C@@H](C)CN1CCCC1)c1cccc(F)c1 ZINC000166580118 331307491 /nfs/dbraw/zinc/30/74/91/331307491.db2.gz JHGABKQPPOHUNQ-PBHICJAKSA-N 1 3 278.415 3.598 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@H]1C[C@H](c2ccccc2)C1(C)C ZINC000463538149 331349263 /nfs/dbraw/zinc/34/92/63/331349263.db2.gz AAWJMBDVOPZSIN-MSOLQXFVSA-N 1 3 288.479 3.889 20 0 CHADHO CC(C)[N@H+](C)CCCN[C@H]1C[C@H](c2ccccc2)C1(C)C ZINC000463538149 331349264 /nfs/dbraw/zinc/34/92/64/331349264.db2.gz AAWJMBDVOPZSIN-MSOLQXFVSA-N 1 3 288.479 3.889 20 0 CHADHO CC(C)[N@@H+](C)CCCN[C@H]1C[C@H](c2ccccc2)C1(C)C ZINC000463538149 331349265 /nfs/dbraw/zinc/34/92/65/331349265.db2.gz AAWJMBDVOPZSIN-MSOLQXFVSA-N 1 3 288.479 3.889 20 0 CHADHO CC(C)C[NH+]1CCC(N[C@@H]2CS[C@@H](C(C)(C)C)C2)CC1 ZINC000488429057 332007262 /nfs/dbraw/zinc/00/72/62/332007262.db2.gz IJQJISPOGAMWMU-JKSUJKDBSA-N 1 3 298.540 3.617 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1 ZINC000488433280 332007632 /nfs/dbraw/zinc/00/76/32/332007632.db2.gz HQRDMIPDTBKDQM-OWCLPIDISA-N 1 3 298.540 3.761 20 0 CHADHO C[C@@H]1CCCC[N@@H+]1CCCN[C@@H]1CS[C@@H](C(C)(C)C)C1 ZINC000488433280 332007634 /nfs/dbraw/zinc/00/76/34/332007634.db2.gz HQRDMIPDTBKDQM-OWCLPIDISA-N 1 3 298.540 3.761 20 0 CHADHO C[C@@H]1CCCC[N@H+]1CCCN[C@@H]1CS[C@@H](C(C)(C)C)C1 ZINC000488433280 332007635 /nfs/dbraw/zinc/00/76/35/332007635.db2.gz HQRDMIPDTBKDQM-OWCLPIDISA-N 1 3 298.540 3.761 20 0 CHADHO CC(C)(C)[C@@H]1C[C@@H](NC2CC[NH+](C(C)(C)C)CC2)CS1 ZINC000488456023 332010943 /nfs/dbraw/zinc/01/09/43/332010943.db2.gz FZXBJFTXASWXRX-CABCVRRESA-N 1 3 298.540 3.759 20 0 CHADHO C(CN1C[C@@H]2CCCC[C@@H]2C1)C[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000489356391 332048633 /nfs/dbraw/zinc/04/86/33/332048633.db2.gz DUUZPDVZKQEWHP-QGFMHUBQSA-N 1 3 290.495 3.621 20 0 CHADHO C(CN1C[C@@H]2CCCC[C@@H]2C1)C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000489356391 332048635 /nfs/dbraw/zinc/04/86/35/332048635.db2.gz DUUZPDVZKQEWHP-QGFMHUBQSA-N 1 3 290.495 3.621 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC12CCCC2)[C@@H]1CCCN(C2CCC2)C1 ZINC000249119481 334328351 /nfs/dbraw/zinc/32/83/51/334328351.db2.gz SOGJDBMKPTUXFA-JZXOWHBKSA-N 1 3 290.495 3.952 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)CCc2ccccc2Cl)[C@H](C)C1 ZINC000174773348 333007075 /nfs/dbraw/zinc/00/70/75/333007075.db2.gz HJPLCBBLVXQASX-PBHICJAKSA-N 1 3 294.870 3.545 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)CCc2ccccc2Cl)[C@H](C)C1 ZINC000174773348 333007076 /nfs/dbraw/zinc/00/70/76/333007076.db2.gz HJPLCBBLVXQASX-PBHICJAKSA-N 1 3 294.870 3.545 20 0 CHADHO c1c2ccccc2oc1CN1CCC(C[NH+]2CCCC2)CC1 ZINC000178527482 333074991 /nfs/dbraw/zinc/07/49/91/333074991.db2.gz JJKHAZUMEMBSGZ-UHFFFAOYSA-N 1 3 298.430 3.741 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+]CC(c2ccccc2)c2ccccc2)C1 ZINC000516877606 333085103 /nfs/dbraw/zinc/08/51/03/333085103.db2.gz IWHIKLZSZOTARG-MOPGFXCFSA-N 1 3 294.442 3.678 20 0 CHADHO Cc1cccc2c1ncc(C)c2NC1CC[NH+](C2CC2)CC1 ZINC000185263261 333137987 /nfs/dbraw/zinc/13/79/87/333137987.db2.gz IUVXASQTOKQZBM-UHFFFAOYSA-N 1 3 295.430 3.890 20 0 CHADHO CC(C)CN1CCC[C@@H](C[NH2+][C@@H](C)CCC2CC2)C1 ZINC000186425952 333160390 /nfs/dbraw/zinc/16/03/90/333160390.db2.gz LHCAPZSCEDURTJ-RDJZCZTQSA-N 1 3 266.473 3.523 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](N[C@@H]2CCSc3ccc(Cl)cc32)C1 ZINC000222947626 333202823 /nfs/dbraw/zinc/20/28/23/333202823.db2.gz JUWYTVCXPPRVCT-YRGRVCCFSA-N 1 3 296.867 3.736 20 0 CHADHO C[C@H]1CCCC[N@@H+]1CCCCNc1ccnc2ccccc21 ZINC000521935840 333224238 /nfs/dbraw/zinc/22/42/38/333224238.db2.gz HPCGHUFTLBFONJ-INIZCTEOSA-N 1 3 297.446 3.723 20 0 CHADHO C[C@H]1CCCC[N@H+]1CCCCNc1ccnc2ccccc21 ZINC000521935840 333224239 /nfs/dbraw/zinc/22/42/39/333224239.db2.gz HPCGHUFTLBFONJ-INIZCTEOSA-N 1 3 297.446 3.723 20 0 CHADHO CC(C)C(C)(C)C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCCN1 ZINC000232772915 333342679 /nfs/dbraw/zinc/34/26/79/333342679.db2.gz WDSFFVVKDRTJKD-OWCLPIDISA-N 1 3 266.473 3.569 20 0 CHADHO C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(CC2CCCC2)C1 ZINC000524356422 333360545 /nfs/dbraw/zinc/36/05/45/333360545.db2.gz OBNCLYCAXKJPHS-FUHWJXTLSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(CC2CCCC2)C1 ZINC000524356422 333360546 /nfs/dbraw/zinc/36/05/46/333360546.db2.gz OBNCLYCAXKJPHS-FUHWJXTLSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@H]1CCCCN1C[C@@H]1CCC[N@H+](CC2CCCC2)C1 ZINC000524356422 333360548 /nfs/dbraw/zinc/36/05/48/333360548.db2.gz OBNCLYCAXKJPHS-FUHWJXTLSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@H]1CCCCN1C[C@@H]1CCC[N@@H+](CC2CCCC2)C1 ZINC000524356422 333360550 /nfs/dbraw/zinc/36/05/50/333360550.db2.gz OBNCLYCAXKJPHS-FUHWJXTLSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@H](c1ccc(F)cc1)N1CCC(CCC[NH+](C)C)CC1 ZINC000123336069 333469923 /nfs/dbraw/zinc/46/99/23/333469923.db2.gz QLOLEWHKAMQMOB-OAHLLOKOSA-N 1 3 292.442 3.941 20 0 CHADHO CC[C@@H]([NH2+]CC1CCN(Cc2cccs2)CC1)C(C)C ZINC000125491953 333567169 /nfs/dbraw/zinc/56/71/69/333567169.db2.gz DBHMRDKKDXLWPZ-QGZVFWFLSA-N 1 3 294.508 3.984 20 0 CHADHO CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@H]1C=CCCC1 ZINC000076109773 334072984 /nfs/dbraw/zinc/07/29/84/334072984.db2.gz OCOMCFQUCYFCEC-OALUTQOASA-N 1 3 284.447 3.549 20 0 CHADHO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1C=CCCC1 ZINC000076109773 334072985 /nfs/dbraw/zinc/07/29/85/334072985.db2.gz OCOMCFQUCYFCEC-OALUTQOASA-N 1 3 284.447 3.549 20 0 CHADHO CCN(CC)CCC[NH2+]Cc1cc2ccccc2s1 ZINC000135019146 334112382 /nfs/dbraw/zinc/11/23/82/334112382.db2.gz VFYYKCOVJKVWSI-UHFFFAOYSA-N 1 3 276.449 3.723 20 0 CHADHO CC[C@@H](C[NH2+]CCCN(CC)CC)c1ccccc1 ZINC000135610015 334134579 /nfs/dbraw/zinc/13/45/79/334134579.db2.gz FMDCFARBOALJGW-INIZCTEOSA-N 1 3 262.441 3.502 20 0 CHADHO Clc1ccccc1CNCCCCC[NH+]1CCCC1 ZINC000549875460 334207631 /nfs/dbraw/zinc/20/76/31/334207631.db2.gz OHTLBDNWPBVBGU-UHFFFAOYSA-N 1 3 280.843 3.696 20 0 CHADHO CC(C)=CCC[C@H](C)[NH2+][C@H]1CCC[C@@H](N(C)C)C1 ZINC000246989011 334273502 /nfs/dbraw/zinc/27/35/02/334273502.db2.gz JHKVKTYHVRXUGZ-HRCADAONSA-N 1 3 252.446 3.584 20 0 CHADHO CC[C@H]1CC[C@H]([NH2+]C2CCN(C3CCCC3)CC2)CC1 ZINC000551211968 334241012 /nfs/dbraw/zinc/24/10/12/334241012.db2.gz OLUIXULGCSZIAL-WKILWMFISA-N 1 3 278.484 3.952 20 0 CHADHO CC[N@@H+]1CC[C@H](NCc2cccc3ccccc32)[C@@H](C)C1 ZINC000246825794 334270197 /nfs/dbraw/zinc/27/01/97/334270197.db2.gz AFIUOJWIYIHLPQ-KXBFYZLASA-N 1 3 282.431 3.660 20 0 CHADHO CC[N@H+]1CC[C@H](NCc2cccc3ccccc32)[C@@H](C)C1 ZINC000246825794 334270198 /nfs/dbraw/zinc/27/01/98/334270198.db2.gz AFIUOJWIYIHLPQ-KXBFYZLASA-N 1 3 282.431 3.660 20 0 CHADHO CCN1CC[C@@H]([NH2+]Cc2ccc(C)cc2SC)[C@@H](C)C1 ZINC000246882353 334271193 /nfs/dbraw/zinc/27/11/93/334271193.db2.gz DMQBWLNZMZSTTH-GOEBONIOSA-N 1 3 292.492 3.537 20 0 CHADHO c1ccc(C[C@@H]2CC[C@H]([NH2+][C@H]3CCN4CCC[C@@H]4C3)C2)cc1 ZINC000249144202 334329137 /nfs/dbraw/zinc/32/91/37/334329137.db2.gz WWCLITQMCIRGLJ-LWYYNNOASA-N 1 3 298.474 3.614 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](CC)c2cccc(F)c2)C1 ZINC000249194657 334329773 /nfs/dbraw/zinc/32/97/73/334329773.db2.gz QBFSEBPVEQRNBC-RHSMWYFYSA-N 1 3 278.415 3.598 20 0 CHADHO CC(C)[C@H](N[C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(F)c(F)c1 ZINC000552580092 334337419 /nfs/dbraw/zinc/33/74/19/334337419.db2.gz PJGKDHJRSZDOFX-QEORTHHSSA-N 1 3 296.405 3.734 20 0 CHADHO CC(C)[C@H](N[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(F)c(F)c1 ZINC000552580092 334337421 /nfs/dbraw/zinc/33/74/21/334337421.db2.gz PJGKDHJRSZDOFX-QEORTHHSSA-N 1 3 296.405 3.734 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@H]2CCC[C@H]2C[NH3+])cc1 ZINC000250564366 334346387 /nfs/dbraw/zinc/34/63/87/334346387.db2.gz AVFGGBCDLHOIEP-JQFCIGGWSA-N 1 3 260.425 3.588 20 0 CHADHO C[C@H](N[C@H]1CCCC[C@H]1C[NH3+])c1cc2ccccc2o1 ZINC000251495530 334362352 /nfs/dbraw/zinc/36/23/52/334362352.db2.gz JVMHEHHAKIOWMS-QEJZJMRPSA-N 1 3 272.392 3.601 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)[N@@H+]1C[C@H](CN)C[C@H]1C ZINC000252697235 334385549 /nfs/dbraw/zinc/38/55/49/334385549.db2.gz GEKLZVNQBKDHPD-KFWWJZLASA-N 1 3 268.404 3.570 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)[N@H+]1C[C@H](CN)C[C@H]1C ZINC000252697235 334385551 /nfs/dbraw/zinc/38/55/51/334385551.db2.gz GEKLZVNQBKDHPD-KFWWJZLASA-N 1 3 268.404 3.570 20 0 CHADHO C[C@H](c1ccc(C(C)(C)C)cc1)N1CC[C@H]([C@H](C)[NH3+])C1 ZINC000252767899 334391378 /nfs/dbraw/zinc/39/13/78/334391378.db2.gz JSSYKNNQGDSSRL-LZWOXQAQSA-N 1 3 274.452 3.714 20 0 CHADHO Cc1cccc2c1[C@@H](C)C[C@@H]2NCc1ccc(C[NH3+])cc1 ZINC000565303391 334551081 /nfs/dbraw/zinc/55/10/81/334551081.db2.gz PHZKZFMQRIKSQC-KSSFIOAISA-N 1 3 280.415 3.792 20 0 CHADHO CC(C)[C@H]([NH2+]C1CCN(C2CCCCC2)CC1)C1CC1 ZINC000157553853 334775329 /nfs/dbraw/zinc/77/53/29/334775329.db2.gz DWATWGDRHMUFNZ-SFHVURJKSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@H](NCCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccco1 ZINC000158595690 334806812 /nfs/dbraw/zinc/80/68/12/334806812.db2.gz GVJLQFNZAACCHF-OAGGEKHMSA-N 1 3 278.440 3.688 20 0 CHADHO C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000576536943 335216897 /nfs/dbraw/zinc/21/68/97/335216897.db2.gz JLQPOGAGWINSQL-RACLHMPKSA-N 1 3 298.474 3.675 20 0 CHADHO Cc1cc([C@@H](NCc2ccc(C[NH3+])cc2)C2CC2)ccc1F ZINC000576943495 335267178 /nfs/dbraw/zinc/26/71/78/335267178.db2.gz KTPZXSSBAANYNR-IBGZPJMESA-N 1 3 298.405 3.834 20 0 CHADHO C[C@H]([NH2+]C1CCN(CC2CCCC2)CC1)C1CCCC1 ZINC000178160142 335420007 /nfs/dbraw/zinc/42/00/07/335420007.db2.gz ASOFBTQCCVGPLS-HNNXBMFYSA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)CC[NH+]1CCC(CN[C@@H](C)c2ccoc2)CC1 ZINC000178341794 335426904 /nfs/dbraw/zinc/42/69/04/335426904.db2.gz TYPCIHGIWARNSC-HNNXBMFYSA-N 1 3 278.440 3.688 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]C(C2CCC2)C2CCC2)C1 ZINC000581417329 336073273 /nfs/dbraw/zinc/07/32/73/336073273.db2.gz WCQGICOSRHFUCL-HNNXBMFYSA-N 1 3 278.484 3.665 20 0 CHADHO CCN1CCC[C@@H](C[NH2+]CCC2CCCCCC2)C1 ZINC000581455286 336080200 /nfs/dbraw/zinc/08/02/00/336080200.db2.gz CDKBDESRNKGWGY-KRWDZBQOSA-N 1 3 266.473 3.668 20 0 CHADHO CC[C@H](NCc1ccc(C[NH3+])cc1)c1cc(C)ccc1OC ZINC000581726991 336138469 /nfs/dbraw/zinc/13/84/69/336138469.db2.gz WJFLEYKUKGRVFG-SFHVURJKSA-N 1 3 298.430 3.703 20 0 CHADHO FC(F)(F)CCN1CCC(CCC[NH+]2CCCC2)CC1 ZINC000355893946 534382802 /nfs/dbraw/zinc/38/28/02/534382802.db2.gz TTZQANVETYESLZ-UHFFFAOYSA-N 1 3 292.389 3.527 20 0 CHADHO CCCN1CCC([N@H+](C)Cc2cnc3ccccc3c2)CC1 ZINC000337133032 519843805 /nfs/dbraw/zinc/84/38/05/519843805.db2.gz ASTZYKVDOJDYPS-UHFFFAOYSA-N 1 3 297.446 3.541 20 0 CHADHO CCCN1CCC([N@@H+](C)Cc2cnc3ccccc3c2)CC1 ZINC000337133032 519843806 /nfs/dbraw/zinc/84/38/06/519843806.db2.gz ASTZYKVDOJDYPS-UHFFFAOYSA-N 1 3 297.446 3.541 20 0 CHADHO CCCCN1CCC([NH2+][C@@H](C)c2ccc(OC)cc2)CC1 ZINC000037150403 520576201 /nfs/dbraw/zinc/57/62/01/520576201.db2.gz CZECTTTYLFARKS-HNNXBMFYSA-N 1 3 290.451 3.610 20 0 CHADHO CC[NH+](CC)Cc1ccc(CNCc2cccs2)cc1 ZINC000020146470 520749973 /nfs/dbraw/zinc/74/99/73/520749973.db2.gz MYDRVRNHSWZJMS-UHFFFAOYSA-N 1 3 288.460 3.880 20 0 CHADHO CCC[C@H](NC1CC[NH+](CC)CC1)c1ccsc1 ZINC000276146914 521154155 /nfs/dbraw/zinc/15/41/55/521154155.db2.gz DGSGEHJSTUXULO-HNNXBMFYSA-N 1 3 266.454 3.663 20 0 CHADHO CC[C@H](NCC[C@H]1CCCC[N@@H+]1C)c1ccccc1 ZINC000052206361 522599189 /nfs/dbraw/zinc/59/91/89/522599189.db2.gz SAKWQDYGKWTFJR-SJORKVTESA-N 1 3 260.425 3.602 20 0 CHADHO CC[C@H](NCC[C@H]1CCCC[N@H+]1C)c1ccccc1 ZINC000052206361 522599196 /nfs/dbraw/zinc/59/91/96/522599196.db2.gz SAKWQDYGKWTFJR-SJORKVTESA-N 1 3 260.425 3.602 20 0 CHADHO CC[C@H](N[C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000129625474 522715238 /nfs/dbraw/zinc/71/52/38/522715238.db2.gz OKKDMGPFEUHTQZ-WQVCFCJDSA-N 1 3 280.843 3.863 20 0 CHADHO CC[C@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000129625474 522715246 /nfs/dbraw/zinc/71/52/46/522715246.db2.gz OKKDMGPFEUHTQZ-WQVCFCJDSA-N 1 3 280.843 3.863 20 0 CHADHO CC[C@@H](N[C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000129625685 522927158 /nfs/dbraw/zinc/92/71/58/522927158.db2.gz OKKDMGPFEUHTQZ-DAXOMENPSA-N 1 3 280.843 3.863 20 0 CHADHO CC[C@@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000129625685 522927167 /nfs/dbraw/zinc/92/71/67/522927167.db2.gz OKKDMGPFEUHTQZ-DAXOMENPSA-N 1 3 280.843 3.863 20 0 CHADHO C[C@@H]1CCC[N@H+](CCCCNCc2ccc(Cl)o2)C1 ZINC000340426852 524223625 /nfs/dbraw/zinc/22/36/25/524223625.db2.gz JUWFNUHRYLEOOD-CYBMUJFWSA-N 1 3 284.831 3.535 20 0 CHADHO C[C@@H]1CCC[N@@H+](CCCCNCc2ccc(Cl)o2)C1 ZINC000340426852 524223631 /nfs/dbraw/zinc/22/36/31/524223631.db2.gz JUWFNUHRYLEOOD-CYBMUJFWSA-N 1 3 284.831 3.535 20 0 CHADHO C[C@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1ccsc1 ZINC000050344073 525293448 /nfs/dbraw/zinc/29/34/48/525293448.db2.gz CKSLWWNVDDHWEH-LBPRGKRZSA-N 1 3 266.454 3.662 20 0 CHADHO Cc1sccc1CN[C@@H](CC[NH+](C)C)C(C)(C)C ZINC000339265888 526917809 /nfs/dbraw/zinc/91/78/09/526917809.db2.gz VHIYZKDPBORBCH-AWEZNQCLSA-N 1 3 268.470 3.513 20 0 CHADHO [NH3+][C@@H]1C[C@H](NC2CCC(C(F)(F)F)CC2)c2ccccc21 ZINC000157357167 527375808 /nfs/dbraw/zinc/37/58/08/527375808.db2.gz WWXYPTORGMWHKU-FBDPFYNOSA-N 1 3 298.352 3.842 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](CCC(C)C)c2ccoc2)C1 ZINC000353437155 527815194 /nfs/dbraw/zinc/81/51/94/527815194.db2.gz DGNSHRISKWBOKU-WBVHZDCISA-N 1 3 278.440 3.688 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1cccc(Cl)c1 ZINC000624119846 1117983807 /nfs/dbraw/zinc/98/38/07/1117983807.db2.gz KVUBKYNHKHFSEE-UONOGXRCSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@@H]1CCCC[C@H]1C[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000401383563 1118902454 /nfs/dbraw/zinc/90/24/54/1118902454.db2.gz IDUPPFQJBMRZAH-ZACQAIPSSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@H](CC[NH2+][C@H]1CCC[C@@H]1CCCF)N1CCCCC1 ZINC000511030652 1118962534 /nfs/dbraw/zinc/96/25/34/1118962534.db2.gz OOKGYAYKIADORC-ZACQAIPSSA-N 1 3 284.463 3.759 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@H](C)c1cc2ccccc2s1 ZINC000157181108 1119388256 /nfs/dbraw/zinc/38/82/56/1119388256.db2.gz ZQFWSNKSSNKYRQ-CHWSQXEVSA-N 1 3 276.449 3.892 20 0 CHADHO CCC(C)(C)[C@@H](C)[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663465526 1120980552 /nfs/dbraw/zinc/98/05/52/1120980552.db2.gz KJHNKASHMWVBFK-GDBMZVCRSA-N 1 3 266.473 3.523 20 0 CHADHO CSCC1CCC([NH2+]C[C@@H]2CCCN(C(C)C)C2)CC1 ZINC000449131675 1124654666 /nfs/dbraw/zinc/65/46/66/1124654666.db2.gz OSRGFQTVSYQQNJ-CGZBRXJRSA-N 1 3 298.540 3.618 20 0 CHADHO Cc1ccc([C@H]2CCCN2CC[C@@H]2CCC[N@H+]2C)s1 ZINC000124020468 1125434450 /nfs/dbraw/zinc/43/44/50/1125434450.db2.gz CKIIULIKIXGELX-LSDHHAIUSA-N 1 3 278.465 3.678 20 0 CHADHO Cc1ccc([C@H]2CCCN2CC[C@@H]2CCC[N@@H+]2C)s1 ZINC000124020468 1125434452 /nfs/dbraw/zinc/43/44/52/1125434452.db2.gz CKIIULIKIXGELX-LSDHHAIUSA-N 1 3 278.465 3.678 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[N@H+]1C[C@H](C2(N)CC2)[C@H](CF)C1 ZINC001246687057 1131782113 /nfs/dbraw/zinc/78/21/13/1131782113.db2.gz CXOZSLRDWOYION-JONQDZQNSA-N 1 3 284.463 3.600 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[N@@H+]1C[C@H](C2(N)CC2)[C@H](CF)C1 ZINC001246687057 1131782121 /nfs/dbraw/zinc/78/21/21/1131782121.db2.gz CXOZSLRDWOYION-JONQDZQNSA-N 1 3 284.463 3.600 20 0 CHADHO CC(C)=CCC[C@H](C)CCN1CCCC[C@](F)(C[NH3+])C1 ZINC001206337005 1133691609 /nfs/dbraw/zinc/69/16/09/1133691609.db2.gz QBOQRGRWGRLPAW-IRXDYDNUSA-N 1 3 284.463 3.912 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@H+]1CCC[C@@]12CCCNC2 ZINC001222232517 1135211371 /nfs/dbraw/zinc/21/13/71/1135211371.db2.gz VVAFFQJRHOLYCZ-QZTJIDSGSA-N 1 3 278.484 3.977 20 0 CHADHO CSCCCC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000133585109 1125512445 /nfs/dbraw/zinc/51/24/45/1125512445.db2.gz VSVIZCQWCAHGAO-UHFFFAOYSA-N 1 3 284.513 3.516 20 0 CHADHO Cc1ccc(CN[C@H](CC[NH+](C)C)C(C)(C)C)s1 ZINC000116379072 1125643677 /nfs/dbraw/zinc/64/36/77/1125643677.db2.gz QPWFFOUOLKOYQK-CQSZACIVSA-N 1 3 268.470 3.513 20 0 CHADHO CC(C)[N@@H+]1CCC[C@@H](CN[C@H]2CCCc3ccccc32)C1 ZINC000246933300 1125654711 /nfs/dbraw/zinc/65/47/11/1125654711.db2.gz HDFZYCQBUDNCSC-LPHOPBHVSA-N 1 3 286.463 3.774 20 0 CHADHO CC(C)[N@H+]1CCC[C@@H](CN[C@H]2CCCc3ccccc32)C1 ZINC000246933300 1125654713 /nfs/dbraw/zinc/65/47/13/1125654713.db2.gz HDFZYCQBUDNCSC-LPHOPBHVSA-N 1 3 286.463 3.774 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H]2CCCc3ccccc32)C1 ZINC000246933300 1125654716 /nfs/dbraw/zinc/65/47/16/1125654716.db2.gz HDFZYCQBUDNCSC-LPHOPBHVSA-N 1 3 286.463 3.774 20 0 CHADHO CCc1ccc([C@H](N[C@@H]2CC[NH2+]C[C@H]2C)C(C)C)cc1 ZINC000261734478 1125740929 /nfs/dbraw/zinc/74/09/29/1125740929.db2.gz LKSXSNNRUOBIRR-ZTFGCOKTSA-N 1 3 274.452 3.534 20 0 CHADHO CCc1ccc([C@H]([NH2+][C@@H]2CCNC[C@H]2C)C(C)C)cc1 ZINC000261734478 1125740936 /nfs/dbraw/zinc/74/09/36/1125740936.db2.gz LKSXSNNRUOBIRR-ZTFGCOKTSA-N 1 3 274.452 3.534 20 0 CHADHO CC(C)[N@H+](C)Cc1cccc(CN[C@@H](C)c2cccnc2)c1 ZINC000092741812 1125760663 /nfs/dbraw/zinc/76/06/63/1125760663.db2.gz UDBYOTMAHDXFSE-INIZCTEOSA-N 1 3 297.446 3.773 20 0 CHADHO CC(C)[N@@H+](C)Cc1cccc(CN[C@@H](C)c2cccnc2)c1 ZINC000092741812 1125760670 /nfs/dbraw/zinc/76/06/70/1125760670.db2.gz UDBYOTMAHDXFSE-INIZCTEOSA-N 1 3 297.446 3.773 20 0 CHADHO CC[C@@H]([NH2+]C1CCN(C2CCCC2)CC1)c1ccncc1 ZINC000163784088 1129203808 /nfs/dbraw/zinc/20/38/08/1129203808.db2.gz DMBKQDWTYKWLFQ-GOSISDBHSA-N 1 3 287.451 3.529 20 0 CHADHO Cc1cc2[nH]c(C[N@@H+](C)C[C@H]3CCCN(C)C3)cc2c(C)c1 ZINC000481905868 1126733662 /nfs/dbraw/zinc/73/36/62/1126733662.db2.gz BFIQJZRYJFCSOT-INIZCTEOSA-N 1 3 299.462 3.558 20 0 CHADHO Cc1cc2[nH]c(C[N@H+](C)C[C@H]3CCCN(C)C3)cc2c(C)c1 ZINC000481905868 1126733664 /nfs/dbraw/zinc/73/36/64/1126733664.db2.gz BFIQJZRYJFCSOT-INIZCTEOSA-N 1 3 299.462 3.558 20 0 CHADHO C[C@@H](NCCCCC[NH+]1CCCCC1)c1ccncc1F ZINC000338360715 1126737829 /nfs/dbraw/zinc/73/78/29/1126737829.db2.gz RVNGSTHMUHSGIW-OAHLLOKOSA-N 1 3 293.430 3.528 20 0 CHADHO CC(C)[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000482353526 1126752472 /nfs/dbraw/zinc/75/24/72/1126752472.db2.gz QMUMSUFWNFFEKN-SQNIBIBYSA-N 1 3 280.500 3.911 20 0 CHADHO CCC[C@H](C)[C@@H](CC)[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000482361599 1126752606 /nfs/dbraw/zinc/75/26/06/1126752606.db2.gz REESDXCTJWRJCZ-GVDBMIGSSA-N 1 3 268.489 3.911 20 0 CHADHO CC[NH+](CC)C[C@H]1CCN(CCCC2CCCC2)C1 ZINC000483210028 1126773292 /nfs/dbraw/zinc/77/32/92/1126773292.db2.gz CNZOLUJHITXPNH-QGZVFWFLSA-N 1 3 266.473 3.621 20 0 CHADHO Cc1ccccc1[C@H](C)N1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000483222074 1126773375 /nfs/dbraw/zinc/77/33/75/1126773375.db2.gz SRAAAHIHCBFWPP-FUHWJXTLSA-N 1 3 286.463 3.720 20 0 CHADHO Cc1ccccc1[C@H](C)N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000483222074 1126773378 /nfs/dbraw/zinc/77/33/78/1126773378.db2.gz SRAAAHIHCBFWPP-FUHWJXTLSA-N 1 3 286.463 3.720 20 0 CHADHO C[N@H+](CC1CC1)C[C@@H]1CCN(CCCC2CCCC2)C1 ZINC000483220812 1126774410 /nfs/dbraw/zinc/77/44/10/1126774410.db2.gz POMKVFMTTZKJDM-SFHVURJKSA-N 1 3 278.484 3.621 20 0 CHADHO C[N@@H+](CC1CC1)C[C@@H]1CCN(CCCC2CCCC2)C1 ZINC000483220812 1126774412 /nfs/dbraw/zinc/77/44/12/1126774412.db2.gz POMKVFMTTZKJDM-SFHVURJKSA-N 1 3 278.484 3.621 20 0 CHADHO CC[C@@H]1CN([C@H](C)c2ccc(C(C)C)cc2)CC[C@@H]1[NH3+] ZINC000251899227 1126800328 /nfs/dbraw/zinc/80/03/28/1126800328.db2.gz WQNYHCPRIPLOBK-RKVPGOIHSA-N 1 3 274.452 3.930 20 0 CHADHO Cc1cc(C)cc([C@H](C)[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)c1 ZINC000484480874 1126821174 /nfs/dbraw/zinc/82/11/74/1126821174.db2.gz ANTGERDCBCNOAS-CGTJXYLNSA-N 1 3 274.452 3.827 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1ccc2c(c1)CCC2 ZINC000484488286 1126819133 /nfs/dbraw/zinc/81/91/33/1126819133.db2.gz HHWDMDPOAZDZJX-GDIGMMSISA-N 1 3 286.463 3.699 20 0 CHADHO Cc1ccc2cc(C[NH2+][C@H]3CCC[C@@H](N(C)C)C3)ccc2n1 ZINC000189373368 1126931532 /nfs/dbraw/zinc/93/15/32/1126931532.db2.gz BSDJLENSWBAMGC-ZWKOTPCHSA-N 1 3 297.446 3.506 20 0 CHADHO CC/C=C\CCCCCC[N@H+](C)C[C@@H]1CCCNC1 ZINC001235950890 1130814852 /nfs/dbraw/zinc/81/48/52/1130814852.db2.gz ORKISABXBNJWEK-VGOKWCNXSA-N 1 3 266.473 3.835 20 0 CHADHO CC/C=C\CCCCCC[N@@H+](C)C[C@@H]1CCCNC1 ZINC001235950890 1130814856 /nfs/dbraw/zinc/81/48/56/1130814856.db2.gz ORKISABXBNJWEK-VGOKWCNXSA-N 1 3 266.473 3.835 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]C[C@@H](C)c2ccccc2)C1 ZINC000194422999 1126974927 /nfs/dbraw/zinc/97/49/27/1126974927.db2.gz VATDKUSCLNFRAE-IAGOWNOFSA-N 1 3 274.452 3.500 20 0 CHADHO CC[N@H+](C)Cc1cccc(CN[C@@H](C)c2cccc(O)c2)c1 ZINC000194883521 1126977922 /nfs/dbraw/zinc/97/79/22/1126977922.db2.gz XVVLEMPCCLIWJB-HNNXBMFYSA-N 1 3 298.430 3.695 20 0 CHADHO CC[N@@H+](C)Cc1cccc(CN[C@@H](C)c2cccc(O)c2)c1 ZINC000194883521 1126977925 /nfs/dbraw/zinc/97/79/25/1126977925.db2.gz XVVLEMPCCLIWJB-HNNXBMFYSA-N 1 3 298.430 3.695 20 0 CHADHO CC(C)c1ccccc1C[N@H+](C)[C@H]1CCCC[C@@H]1N ZINC001236219145 1130892668 /nfs/dbraw/zinc/89/26/68/1130892668.db2.gz VCKDPIIMHRAOEP-IRXDYDNUSA-N 1 3 260.425 3.512 20 0 CHADHO CC(C)c1ccccc1C[N@@H+](C)[C@H]1CCCC[C@@H]1N ZINC001236219145 1130892676 /nfs/dbraw/zinc/89/26/76/1130892676.db2.gz VCKDPIIMHRAOEP-IRXDYDNUSA-N 1 3 260.425 3.512 20 0 CHADHO C[C@H]([NH2+]C1CCN(CC2CC2)CC1)c1cc2ccccc2o1 ZINC000268754885 1127022401 /nfs/dbraw/zinc/02/24/01/1127022401.db2.gz WRWVBCSHWOTJFJ-AWEZNQCLSA-N 1 3 298.430 3.958 20 0 CHADHO CC[N@H+](C)Cc1cccc(CN[C@@H](C)c2cnccc2C)c1 ZINC000271588963 1127093728 /nfs/dbraw/zinc/09/37/28/1127093728.db2.gz SQPYWDNOOSMLKO-INIZCTEOSA-N 1 3 297.446 3.693 20 0 CHADHO CC[N@@H+](C)Cc1cccc(CN[C@@H](C)c2cnccc2C)c1 ZINC000271588963 1127093730 /nfs/dbraw/zinc/09/37/30/1127093730.db2.gz SQPYWDNOOSMLKO-INIZCTEOSA-N 1 3 297.446 3.693 20 0 CHADHO c1cc([C@H]2CCC[N@H+]2CCCN2CCCCC2)cs1 ZINC000351310111 1127188139 /nfs/dbraw/zinc/18/81/39/1127188139.db2.gz ZOKJYBFIVTUNBI-MRXNPFEDSA-N 1 3 278.465 3.761 20 0 CHADHO c1cc([C@H]2CCC[N@@H+]2CCCN2CCCCC2)cs1 ZINC000351310111 1127188140 /nfs/dbraw/zinc/18/81/40/1127188140.db2.gz ZOKJYBFIVTUNBI-MRXNPFEDSA-N 1 3 278.465 3.761 20 0 CHADHO C[N@H+](C/C=C/c1ccccc1)C1CCN(CC2CC2)CC1 ZINC001168387993 1127215235 /nfs/dbraw/zinc/21/52/35/1127215235.db2.gz ZFMTYQONZYXSLQ-VMPITWQZSA-N 1 3 284.447 3.506 20 0 CHADHO C[N@@H+](C/C=C/c1ccccc1)C1CCN(CC2CC2)CC1 ZINC001168387993 1127215239 /nfs/dbraw/zinc/21/52/39/1127215239.db2.gz ZFMTYQONZYXSLQ-VMPITWQZSA-N 1 3 284.447 3.506 20 0 CHADHO CCN(Cc1ccc(C)cc1)C1CC[NH+](CC2CC2)CC1 ZINC001168389947 1127219894 /nfs/dbraw/zinc/21/98/94/1127219894.db2.gz YNPNQPGAXIMZGP-UHFFFAOYSA-N 1 3 286.463 3.691 20 0 CHADHO C[N@@H+]1CC[C@@H]2[C@H](CCCN2Cc2ccc(C(F)F)cc2)C1 ZINC000572648018 1127223703 /nfs/dbraw/zinc/22/37/03/1127223703.db2.gz LCROCQZMZDBQLA-HZPDHXFCSA-N 1 3 294.389 3.540 20 0 CHADHO C[N@H+]1CC[C@@H]2[C@H](CCCN2Cc2ccc(C(F)F)cc2)C1 ZINC000572648018 1127223705 /nfs/dbraw/zinc/22/37/05/1127223705.db2.gz LCROCQZMZDBQLA-HZPDHXFCSA-N 1 3 294.389 3.540 20 0 CHADHO C[N@@H+]1CC[C@@H]2[C@@H](CCCN2Cc2ccc(C(F)F)cc2)C1 ZINC000572648019 1127223827 /nfs/dbraw/zinc/22/38/27/1127223827.db2.gz LCROCQZMZDBQLA-JKSUJKDBSA-N 1 3 294.389 3.540 20 0 CHADHO C[N@H+]1CC[C@@H]2[C@@H](CCCN2Cc2ccc(C(F)F)cc2)C1 ZINC000572648019 1127223829 /nfs/dbraw/zinc/22/38/29/1127223829.db2.gz LCROCQZMZDBQLA-JKSUJKDBSA-N 1 3 294.389 3.540 20 0 CHADHO Cc1ccnc([C@H](C)NCCCC[N@@H+]2CCC[C@H](C)C2)c1 ZINC000285464732 1127230155 /nfs/dbraw/zinc/23/01/55/1127230155.db2.gz AJVHAGSIKVJGHB-IRXDYDNUSA-N 1 3 289.467 3.553 20 0 CHADHO Cc1ccnc([C@H](C)NCCCC[N@H+]2CCC[C@H](C)C2)c1 ZINC000285464732 1127230157 /nfs/dbraw/zinc/23/01/57/1127230157.db2.gz AJVHAGSIKVJGHB-IRXDYDNUSA-N 1 3 289.467 3.553 20 0 CHADHO C[N@H+](Cc1ccc(Cl)cc1)C1CCN(CC2CC2)CC1 ZINC001168393169 1127234267 /nfs/dbraw/zinc/23/42/67/1127234267.db2.gz YAHHAXSCSXMFIU-UHFFFAOYSA-N 1 3 292.854 3.646 20 0 CHADHO C[N@@H+](Cc1ccc(Cl)cc1)C1CCN(CC2CC2)CC1 ZINC001168393169 1127234269 /nfs/dbraw/zinc/23/42/69/1127234269.db2.gz YAHHAXSCSXMFIU-UHFFFAOYSA-N 1 3 292.854 3.646 20 0 CHADHO CC1=C[C@@H](C)C[C@H](C[NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000575097993 1127467894 /nfs/dbraw/zinc/46/78/94/1127467894.db2.gz XKQZKZHWWZDCCM-WBVHZDCISA-N 1 3 290.495 3.975 20 0 CHADHO CC[C@H](N[C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(C)cc1 ZINC000361970964 1127603605 /nfs/dbraw/zinc/60/36/05/1127603605.db2.gz JPTLQFVIQXLPOJ-KSZLIROESA-N 1 3 274.452 3.909 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1ccc(C)cc1 ZINC000361970964 1127603606 /nfs/dbraw/zinc/60/36/06/1127603606.db2.gz JPTLQFVIQXLPOJ-KSZLIROESA-N 1 3 274.452 3.909 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1cccc(OC)c1 ZINC000361973444 1127604012 /nfs/dbraw/zinc/60/40/12/1127604012.db2.gz XKEKFNJQADCOCJ-JZXOWHBKSA-N 1 3 290.451 3.609 20 0 CHADHO C[C@@H]([NH2+]CCC(C)(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000295584892 1127646990 /nfs/dbraw/zinc/64/69/90/1127646990.db2.gz BQONSQKKPWLTJH-GDBMZVCRSA-N 1 3 296.405 3.532 20 0 CHADHO Cc1cccc(C2=CC[N@H+](CC[C@H]3CCCCN3C)CC2)c1 ZINC000540045014 1127958363 /nfs/dbraw/zinc/95/83/63/1127958363.db2.gz YTHBGDISKVSUOX-HXUWFJFHSA-N 1 3 298.474 3.959 20 0 CHADHO Cc1cccc(C2=CC[N@@H+](CC[C@H]3CCCCN3C)CC2)c1 ZINC000540045014 1127958365 /nfs/dbraw/zinc/95/83/65/1127958365.db2.gz YTHBGDISKVSUOX-HXUWFJFHSA-N 1 3 298.474 3.959 20 0 CHADHO CC(C)CCC[C@@H](C)[NH2+]CCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000540169134 1127964811 /nfs/dbraw/zinc/96/48/11/1127964811.db2.gz DAUKKPZHXBLKSI-KURKYZTESA-N 1 3 298.515 3.680 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](c2ccc(C)o2)C2CCCC2)C1 ZINC000540475302 1127980129 /nfs/dbraw/zinc/98/01/29/1127980129.db2.gz MLAVUTAKUITNTG-QAPCUYQASA-N 1 3 290.451 3.751 20 0 CHADHO Cc1cccc(C)c1[C@@H](C)[NH2+]CC[C@@H]1CCCCN1C ZINC000545517631 1128018301 /nfs/dbraw/zinc/01/83/01/1128018301.db2.gz RBDGRXFCVKFZNH-SJORKVTESA-N 1 3 274.452 3.828 20 0 CHADHO Cc1cccc(C)c1[C@@H](C)NCC[C@@H]1CCCC[N@@H+]1C ZINC000545517631 1128018304 /nfs/dbraw/zinc/01/83/04/1128018304.db2.gz RBDGRXFCVKFZNH-SJORKVTESA-N 1 3 274.452 3.828 20 0 CHADHO Cc1cccc(C)c1[C@@H](C)NCC[C@@H]1CCCC[N@H+]1C ZINC000545517631 1128018309 /nfs/dbraw/zinc/01/83/09/1128018309.db2.gz RBDGRXFCVKFZNH-SJORKVTESA-N 1 3 274.452 3.828 20 0 CHADHO c1ccc([C@H]2CCCCC[N@H+]2C[C@H]2CCCNC2)cc1 ZINC000469873124 1128057073 /nfs/dbraw/zinc/05/70/73/1128057073.db2.gz XUBQYIKVWGDMCM-FUHWJXTLSA-N 1 3 272.436 3.603 20 0 CHADHO c1ccc([C@H]2CCCCC[N@@H+]2C[C@H]2CCCNC2)cc1 ZINC000469873124 1128057078 /nfs/dbraw/zinc/05/70/78/1128057078.db2.gz XUBQYIKVWGDMCM-FUHWJXTLSA-N 1 3 272.436 3.603 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+]C2CCCCCC2)C1 ZINC000557273965 1128097656 /nfs/dbraw/zinc/09/76/56/1128097656.db2.gz PPMWTHIWTMAFFD-MRXNPFEDSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@H](N[C@@H](C)c1cccc(C[NH+](C)C)c1)c1cccnc1 ZINC000924565008 1128105674 /nfs/dbraw/zinc/10/56/74/1128105674.db2.gz QVFQALKEHRMISB-GJZGRUSLSA-N 1 3 283.419 3.555 20 0 CHADHO COc1c(C)cccc1CN[C@H](CCC[NH3+])c1ccccc1 ZINC000925702284 1128137414 /nfs/dbraw/zinc/13/74/14/1128137414.db2.gz MUKJRZKMPYFHSK-GOSISDBHSA-N 1 3 298.430 3.573 20 0 CHADHO CCC1([NH3+])CCN(C2c3ccccc3-c3ccccc32)CC1 ZINC000925761227 1128140873 /nfs/dbraw/zinc/14/08/73/1128140873.db2.gz XPRINHYFXQZHJK-UHFFFAOYSA-N 1 3 292.426 3.960 20 0 CHADHO CN(C[C@@H]1CCC[N@H+](C)C1)[C@H]1CCc2cc(Cl)ccc21 ZINC000777783644 1128274399 /nfs/dbraw/zinc/27/43/99/1128274399.db2.gz CUHYLOYFMZSWRV-DYVFJYSZSA-N 1 3 292.854 3.601 20 0 CHADHO CN(C[C@@H]1CCC[N@@H+](C)C1)[C@H]1CCc2cc(Cl)ccc21 ZINC000777783644 1128274401 /nfs/dbraw/zinc/27/44/01/1128274401.db2.gz CUHYLOYFMZSWRV-DYVFJYSZSA-N 1 3 292.854 3.601 20 0 CHADHO CC(C)(C)SCCNC1CC[NH+](C2CCCCC2)CC1 ZINC000089516488 1128298506 /nfs/dbraw/zinc/29/85/06/1128298506.db2.gz MJGRRHVYHNWRJY-UHFFFAOYSA-N 1 3 298.540 3.905 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]C[C@H]2CCCC[C@H]2C)C1 ZINC001649175991 1128403651 /nfs/dbraw/zinc/40/36/51/1128403651.db2.gz SYKFQDQYBBGOPE-IXDOHACOSA-N 1 3 266.473 3.523 20 0 CHADHO Cc1ccc([C@@H](C)NC[C@H](C)C[NH+]2CCCC2)cc1C ZINC000062077623 1128435903 /nfs/dbraw/zinc/43/59/03/1128435903.db2.gz CEJNJRLZPKKRFX-WMLDXEAASA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc(C2CC([NH2+]C[C@@H](C)CN3CCCC3)C2)cc1 ZINC000062078456 1128437339 /nfs/dbraw/zinc/43/73/39/1128437339.db2.gz XJFFNHDMDDQBDF-IPJUCJBFSA-N 1 3 286.463 3.563 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H]2c3ccccc3C[C@H]2C)C1 ZINC000125813727 1128453658 /nfs/dbraw/zinc/45/36/58/1128453658.db2.gz PMMKVJYJQKVAGS-JTDSTZFVSA-N 1 3 286.463 3.630 20 0 CHADHO CC(C)[N@@H+]1CCC[C@@H](CN[C@H]2c3ccccc3C[C@H]2C)C1 ZINC000125813727 1128453660 /nfs/dbraw/zinc/45/36/60/1128453660.db2.gz PMMKVJYJQKVAGS-JTDSTZFVSA-N 1 3 286.463 3.630 20 0 CHADHO CC(C)[N@H+]1CCC[C@@H](CN[C@H]2c3ccccc3C[C@H]2C)C1 ZINC000125813727 1128453662 /nfs/dbraw/zinc/45/36/62/1128453662.db2.gz PMMKVJYJQKVAGS-JTDSTZFVSA-N 1 3 286.463 3.630 20 0 CHADHO CC(C)CN1CCC[C@@H](C[NH2+]C2CCC(C)CC2)C1 ZINC000563800766 1128479249 /nfs/dbraw/zinc/47/92/49/1128479249.db2.gz JBIZSMSOZWDGRN-CGZBRXJRSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@@H](C[NH2+][C@H]1CCc2cc(F)ccc21)CN1CCCCC1 ZINC000129198660 1128534376 /nfs/dbraw/zinc/53/43/76/1128534376.db2.gz YNOWLPNZNQNLSS-KSSFIOAISA-N 1 3 290.426 3.525 20 0 CHADHO Clc1ccc2c(c1)CC[C@@H]2[NH2+]CCCN1CCCCC1 ZINC000129809775 1128556970 /nfs/dbraw/zinc/55/69/70/1128556970.db2.gz UWINCBQPPMUAOX-KRWDZBQOSA-N 1 3 292.854 3.793 20 0 CHADHO FC(F)c1ccc(C[NH2+]CCCN2CCCCC2)cc1 ZINC000131303609 1128613519 /nfs/dbraw/zinc/61/35/19/1128613519.db2.gz XIJYDPDDIZAAKR-UHFFFAOYSA-N 1 3 282.378 3.590 20 0 CHADHO CC[C@@H](Cc1ccc(C)cc1)[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000569039320 1128596731 /nfs/dbraw/zinc/59/67/31/1128596731.db2.gz TXBAJEUKHBSXDX-MOPGFXCFSA-N 1 3 288.479 3.636 20 0 CHADHO C[C@H](CC[NH2+]C1CCCCCC1)N1CCCCC1 ZINC000569272364 1128602526 /nfs/dbraw/zinc/60/25/26/1128602526.db2.gz KKYKHBAKSKFHOR-OAHLLOKOSA-N 1 3 252.446 3.563 20 0 CHADHO COc1ccc([C@H](C)[NH2+]CC(C)(C)CN(C)C)cc1Cl ZINC000132122803 1128643680 /nfs/dbraw/zinc/64/36/80/1128643680.db2.gz XVQNOZUVZGSXFV-LBPRGKRZSA-N 1 3 298.858 3.587 20 0 CHADHO C[C@H]1C[C@@H]1c1ccc(CNCCCCC[NH+]2CCCC2)o1 ZINC000339496542 1117808813 /nfs/dbraw/zinc/80/88/13/1117808813.db2.gz CCYKJPFASOWGDX-RDJZCZTQSA-N 1 3 290.451 3.759 20 0 CHADHO Cc1ccc(SCCN[C@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000623341951 1117835821 /nfs/dbraw/zinc/83/58/21/1117835821.db2.gz ZMBKENYQWDAPTB-HNNXBMFYSA-N 1 3 292.492 3.550 20 0 CHADHO Cc1ccc(SCCN[C@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000623341951 1117835827 /nfs/dbraw/zinc/83/58/27/1117835827.db2.gz ZMBKENYQWDAPTB-HNNXBMFYSA-N 1 3 292.492 3.550 20 0 CHADHO Cc1ccc([C@H](N[C@H]2CC[N@@H+](C)C(C)(C)C2)C2CC2)cc1 ZINC000623352082 1117839700 /nfs/dbraw/zinc/83/97/00/1117839700.db2.gz ONQLTJKRLCQZEU-ROUUACIJSA-N 1 3 286.463 3.909 20 0 CHADHO Cc1ccc([C@H](N[C@H]2CC[N@H+](C)C(C)(C)C2)C2CC2)cc1 ZINC000623352082 1117839704 /nfs/dbraw/zinc/83/97/04/1117839704.db2.gz ONQLTJKRLCQZEU-ROUUACIJSA-N 1 3 286.463 3.909 20 0 CHADHO CC[C@H](N[C@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1 ZINC000623384664 1117846723 /nfs/dbraw/zinc/84/67/23/1117846723.db2.gz CLARFDOECNKVLE-HOTGVXAUSA-N 1 3 260.425 3.600 20 0 CHADHO CC[C@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1 ZINC000623384664 1117846729 /nfs/dbraw/zinc/84/67/29/1117846729.db2.gz CLARFDOECNKVLE-HOTGVXAUSA-N 1 3 260.425 3.600 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCc1ccc(-c2cccc(F)c2)s1 ZINC000579121824 1128738718 /nfs/dbraw/zinc/73/87/18/1128738718.db2.gz FQNNEAFJUBZGOK-RYUDHWBXSA-N 1 3 292.423 3.770 20 0 CHADHO Cc1ccc2c(c1)[C@@H](N[C@@H]1CC[N@H+](C)C(C)(C)C1)[C@H](C)C2 ZINC000623571545 1117874061 /nfs/dbraw/zinc/87/40/61/1117874061.db2.gz ZXIOFKWAGGKQRN-KYJSFNMBSA-N 1 3 286.463 3.691 20 0 CHADHO Cc1ccc2c(c1)[C@@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)[C@H](C)C2 ZINC000623571545 1117874065 /nfs/dbraw/zinc/87/40/65/1117874065.db2.gz ZXIOFKWAGGKQRN-KYJSFNMBSA-N 1 3 286.463 3.691 20 0 CHADHO CC[C@H]([NH2+]CCCN1CCCC1)c1ccc(Cl)s1 ZINC000178414604 1117891122 /nfs/dbraw/zinc/89/11/22/1117891122.db2.gz NBIVRJDYMUDBHU-LBPRGKRZSA-N 1 3 286.872 3.928 20 0 CHADHO C[C@@H](c1cccc2ccccc21)[N@H+](C)CC(C)(C)N ZINC000662293580 1117891587 /nfs/dbraw/zinc/89/15/87/1117891587.db2.gz UTGXWQLFBPPXNP-ZDUSSCGKSA-N 1 3 256.393 3.570 20 0 CHADHO C[C@@H](c1cccc2ccccc21)[N@@H+](C)CC(C)(C)N ZINC000662293580 1117891595 /nfs/dbraw/zinc/89/15/95/1117891595.db2.gz UTGXWQLFBPPXNP-ZDUSSCGKSA-N 1 3 256.393 3.570 20 0 CHADHO CC(C)Oc1ccc([C@H](C)[NH2+]CC[C@H]2CCCN2C)cc1 ZINC000179535564 1117907701 /nfs/dbraw/zinc/90/77/01/1117907701.db2.gz YINPIIHMLYDOKZ-DOTOQJQBSA-N 1 3 290.451 3.609 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000624123076 1117985054 /nfs/dbraw/zinc/98/50/54/1117985054.db2.gz FNNGLJWSOUWZCO-FXUDXRNXSA-N 1 3 292.492 3.562 20 0 CHADHO CCC[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccccc1 ZINC000624119413 1117985304 /nfs/dbraw/zinc/98/53/04/1117985304.db2.gz AWTBKMGPSGUCIL-FUHWJXTLSA-N 1 3 274.452 3.849 20 0 CHADHO CCC[C@@H](NC[C@@H]1CCCC[N@H+](C)C1)c1ccccc1 ZINC000624119413 1117985308 /nfs/dbraw/zinc/98/53/08/1117985308.db2.gz AWTBKMGPSGUCIL-FUHWJXTLSA-N 1 3 274.452 3.849 20 0 CHADHO CCC[C@@H](NC[C@@H]1CCCC[N@@H+](C)C1)c1ccccc1 ZINC000624119413 1117985312 /nfs/dbraw/zinc/98/53/12/1117985312.db2.gz AWTBKMGPSGUCIL-FUHWJXTLSA-N 1 3 274.452 3.849 20 0 CHADHO CC[NH+](CC)C[C@H]1CCN(CCCc2ccc(C)cc2)C1 ZINC000181929330 1118009528 /nfs/dbraw/zinc/00/95/28/1118009528.db2.gz YQIAJARCRHTISJ-LJQANCHMSA-N 1 3 288.479 3.591 20 0 CHADHO c1csc(CN(Cc2ccc3c(c2)C[NH2+]CC3)C2CC2)c1 ZINC000211353782 1118040569 /nfs/dbraw/zinc/04/05/69/1118040569.db2.gz PZWXYJDRKZETGU-UHFFFAOYSA-N 1 3 298.455 3.558 20 0 CHADHO CCC[C@H]([NH2+]C[C@@H](C)CN1CCCCC1)c1cccnc1 ZINC000185081625 1118059244 /nfs/dbraw/zinc/05/92/44/1118059244.db2.gz CXIHRIISZAPJEX-AEFFLSMTSA-N 1 3 289.467 3.634 20 0 CHADHO C[C@H](CSC(C)(C)C)[NH2+]CCCN1CCCC[C@@H]1C ZINC000764635089 1118104093 /nfs/dbraw/zinc/10/40/93/1118104093.db2.gz ISWJGYKHSRJVET-CABCVRRESA-N 1 3 286.529 3.761 20 0 CHADHO CN1CCCC[C@@H](C[NH2+][C@@H]2CCCCC23CCCC3)C1 ZINC000706071840 1118140978 /nfs/dbraw/zinc/14/09/78/1118140978.db2.gz WHNAEVLDRASGCO-DLBZAZTESA-N 1 3 278.484 3.811 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+]C2CCC3(CCCC3)CC2)C1 ZINC000129343541 1118156803 /nfs/dbraw/zinc/15/68/03/1118156803.db2.gz DULUREKXFCZWKT-INIZCTEOSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@H](CC[NH2+][C@@H]1CC(C)(C)C[C@H]1C)N1CCCCC1 ZINC001650935098 1118219165 /nfs/dbraw/zinc/21/91/65/1118219165.db2.gz AAABEPCGDZCIAR-BZUAXINKSA-N 1 3 266.473 3.665 20 0 CHADHO CC1CCN(CCC[NH2+]Cc2ccccc2C2CC2)CC1 ZINC000094518120 1118278111 /nfs/dbraw/zinc/27/81/11/1118278111.db2.gz ZZBUZBNQQUEBTL-UHFFFAOYSA-N 1 3 286.463 3.776 20 0 CHADHO C[C@@H]1CC[N@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)CCN1 ZINC001210473207 1118293901 /nfs/dbraw/zinc/29/39/01/1118293901.db2.gz BSOVWHGABZYYIF-CQSZACIVSA-N 1 3 299.462 3.649 20 0 CHADHO C[C@@H]1CC[N@@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)CCN1 ZINC001210473207 1118293906 /nfs/dbraw/zinc/29/39/06/1118293906.db2.gz BSOVWHGABZYYIF-CQSZACIVSA-N 1 3 299.462 3.649 20 0 CHADHO CC(C)C[C@H]([NH2+]CC[C@H]1CCCN1C)c1ccccc1 ZINC000341036120 1118591740 /nfs/dbraw/zinc/59/17/40/1118591740.db2.gz ITISMTWGLKPGES-MSOLQXFVSA-N 1 3 274.452 3.848 20 0 CHADHO CC(C)C[C@H](NCC[C@H]1CCC[N@@H+]1C)c1ccccc1 ZINC000341036120 1118591742 /nfs/dbraw/zinc/59/17/42/1118591742.db2.gz ITISMTWGLKPGES-MSOLQXFVSA-N 1 3 274.452 3.848 20 0 CHADHO CC(C)C[C@H](NCC[C@H]1CCC[N@H+]1C)c1ccccc1 ZINC000341036120 1118591744 /nfs/dbraw/zinc/59/17/44/1118591744.db2.gz ITISMTWGLKPGES-MSOLQXFVSA-N 1 3 274.452 3.848 20 0 CHADHO c1csc(CCNC2CC[NH+](C3CCCCC3)CC2)c1 ZINC000155567698 1118686671 /nfs/dbraw/zinc/68/66/71/1118686671.db2.gz DRLDHJBUDWXEGV-UHFFFAOYSA-N 1 3 292.492 3.677 20 0 CHADHO C[C@@H](CN1CCC[C@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000157084530 1118725924 /nfs/dbraw/zinc/72/59/24/1118725924.db2.gz ZQSCIXLAENBPKK-HKUYNNGSSA-N 1 3 286.463 3.740 20 0 CHADHO C[C@H]1C[C@H]([NH3+])CCN1Cc1ccc(-c2ccccc2)cc1 ZINC000129021255 1118752520 /nfs/dbraw/zinc/75/25/20/1118752520.db2.gz ZEXOKJBPLQKHCH-HNAYVOBHSA-N 1 3 280.415 3.665 20 0 CHADHO CC[NH2+]CC1CCN([C@H](C)c2ccc(Cl)cc2)CC1 ZINC000131507315 1118760583 /nfs/dbraw/zinc/76/05/83/1118760583.db2.gz UGCQDPHCFXAMFJ-CYBMUJFWSA-N 1 3 280.843 3.723 20 0 CHADHO CCC[C@@H]1C[C@H]1[NH2+][C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000430749212 1118766865 /nfs/dbraw/zinc/76/68/65/1118766865.db2.gz INBHRYFWIRPGGD-LCWAXJCOSA-N 1 3 298.474 3.675 20 0 CHADHO C(C1CCCC1)N1CCC([NH2+][C@H]2CC[C@H]2C2CCC2)CC1 ZINC000510668662 1118786425 /nfs/dbraw/zinc/78/64/25/1118786425.db2.gz STWTZKBVZNWGDL-OALUTQOASA-N 1 3 290.495 3.809 20 0 CHADHO C[C@@H](C[NH2+]C1CCC2(CCCC2)CC1)CN1CCCC1 ZINC000129385466 1118809622 /nfs/dbraw/zinc/80/96/22/1118809622.db2.gz ODGDJWADLFFLDJ-INIZCTEOSA-N 1 3 278.484 3.811 20 0 CHADHO CCC(CC)[C@@H](N[C@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000133705546 1118866347 /nfs/dbraw/zinc/86/63/47/1118866347.db2.gz NSPJCVZSNNSSDM-ZWKOTPCHSA-N 1 3 274.452 3.896 20 0 CHADHO CC[C@@H]1CCC[C@@H]1C[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000449433550 1118906164 /nfs/dbraw/zinc/90/61/64/1118906164.db2.gz MUCMYZKPIIBQKH-HUUCEWRRSA-N 1 3 266.473 3.665 20 0 CHADHO C1CC1([NH2+]C1CCN(C2CCCCC2)CC1)C1CCC1 ZINC000651983786 1118931561 /nfs/dbraw/zinc/93/15/61/1118931561.db2.gz KKHFDCTZCDXHFN-UHFFFAOYSA-N 1 3 276.468 3.706 20 0 CHADHO C[N@H+](C1CCC(C(C)(C)C)CC1)[C@H]1CCCNCC1 ZINC000226450389 1118971482 /nfs/dbraw/zinc/97/14/82/1118971482.db2.gz MRBCYXUJHHFHQH-PCKAHOCUSA-N 1 3 266.473 3.665 20 0 CHADHO C[N@@H+](C1CCC(C(C)(C)C)CC1)[C@H]1CCCNCC1 ZINC000226450389 1118971484 /nfs/dbraw/zinc/97/14/84/1118971484.db2.gz MRBCYXUJHHFHQH-PCKAHOCUSA-N 1 3 266.473 3.665 20 0 CHADHO CC[C@H](C[N@@H+]1CCC[C@@H]2CN(C)CC[C@@H]21)c1ccccc1 ZINC000582115070 1119014657 /nfs/dbraw/zinc/01/46/57/1119014657.db2.gz WDJAFCHOAFSJAU-QRQLOZEOSA-N 1 3 286.463 3.596 20 0 CHADHO CC[C@H](C[N@H+]1CCC[C@@H]2CN(C)CC[C@@H]21)c1ccccc1 ZINC000582115070 1119014662 /nfs/dbraw/zinc/01/46/62/1119014662.db2.gz WDJAFCHOAFSJAU-QRQLOZEOSA-N 1 3 286.463 3.596 20 0 CHADHO C[C@]1(C[NH3+])CCN(Cc2ccc(-c3ccccc3)cc2)C1 ZINC000261605694 1119064206 /nfs/dbraw/zinc/06/42/06/1119064206.db2.gz CUWJMQYZQVHNHD-LJQANCHMSA-N 1 3 280.415 3.524 20 0 CHADHO Cc1ccc([C@H](C)C[N@@H+]2CC[C@H]3[C@H](CCCN3C)C2)cc1 ZINC000628190951 1128824048 /nfs/dbraw/zinc/82/40/48/1128824048.db2.gz VPYNNEGENMZAIL-QRQLOZEOSA-N 1 3 286.463 3.515 20 0 CHADHO Cc1ccc([C@H](C)C[N@H+]2CC[C@H]3[C@H](CCCN3C)C2)cc1 ZINC000628190951 1128824051 /nfs/dbraw/zinc/82/40/51/1128824051.db2.gz VPYNNEGENMZAIL-QRQLOZEOSA-N 1 3 286.463 3.515 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H]2CCc3ccc(F)cc32)C1 ZINC000125871990 1119240829 /nfs/dbraw/zinc/24/08/29/1119240829.db2.gz GNRAGLSMTBIWCM-RDTXWAMCSA-N 1 3 290.426 3.523 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H]2CCc3ccc(F)cc32)C1 ZINC000125872216 1119241190 /nfs/dbraw/zinc/24/11/90/1119241190.db2.gz GNRAGLSMTBIWCM-KBXCAEBGSA-N 1 3 290.426 3.523 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000343090270 1119307118 /nfs/dbraw/zinc/30/71/18/1119307118.db2.gz DPSOSMPNGOVSSV-NEWSRXKRSA-N 1 3 286.463 3.644 20 0 CHADHO Cc1ccccc1[C@@H]1C[C@H]1N[C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000650742413 1119397033 /nfs/dbraw/zinc/39/70/33/1119397033.db2.gz XRCMONIFFTTZQS-WKWVNEEDSA-N 1 3 298.474 3.751 20 0 CHADHO C[C@H](NCCC1(C[NH3+])CC1)c1cc(Cl)sc1Cl ZINC000650743199 1119398192 /nfs/dbraw/zinc/39/81/92/1119398192.db2.gz OHANSQPPAZPQQZ-QMMMGPOBSA-N 1 3 293.263 3.835 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@H](C)c1ccc(OC)cc1C ZINC000650756266 1119413570 /nfs/dbraw/zinc/41/35/70/1119413570.db2.gz XYHJBWYDFWGWAH-OAHLLOKOSA-N 1 3 298.430 3.574 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@H]1CC(C)(C)Cc2occc21 ZINC000650758387 1119416307 /nfs/dbraw/zinc/41/63/07/1119416307.db2.gz OJHNUANFZHEYCM-KRWDZBQOSA-N 1 3 298.430 3.802 20 0 CHADHO C[C@H](N(C)CCC[N@H+](C)[C@@H](C)C1(C)CC1)C1(C)CC1 ZINC000343741070 1119499539 /nfs/dbraw/zinc/49/95/39/1119499539.db2.gz MXMSZVDWKDCCTP-GJZGRUSLSA-N 1 3 266.473 3.617 20 0 CHADHO C[C@H](N(C)CCC[N@@H+](C)[C@@H](C)C1(C)CC1)C1(C)CC1 ZINC000343741070 1119499541 /nfs/dbraw/zinc/49/95/41/1119499541.db2.gz MXMSZVDWKDCCTP-GJZGRUSLSA-N 1 3 266.473 3.617 20 0 CHADHO CCC1(C)CCC([NH2+]C[C@@H]2CCN(C(C)C)C2)CC1 ZINC000685455719 1119610996 /nfs/dbraw/zinc/61/09/96/1119610996.db2.gz TXYPBLDYXBHGRS-GTPINHCMSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)[NH+](CCCN[C@H](C)C(C)(C)C(F)F)C(C)C ZINC000657901213 1119619581 /nfs/dbraw/zinc/61/95/81/1119619581.db2.gz XBXSJSVITNFFJO-CYBMUJFWSA-N 1 3 278.431 3.765 20 0 CHADHO C[C@@H](CCc1ccco1)N[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000658226167 1119705655 /nfs/dbraw/zinc/70/56/55/1119705655.db2.gz GUGDBZRHHZNLMJ-HOTGVXAUSA-N 1 3 290.451 3.597 20 0 CHADHO C[C@@H](CCc1ccco1)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000658226167 1119705658 /nfs/dbraw/zinc/70/56/58/1119705658.db2.gz GUGDBZRHHZNLMJ-HOTGVXAUSA-N 1 3 290.451 3.597 20 0 CHADHO C[C@@H](CCc1ccco1)N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000658226169 1119706429 /nfs/dbraw/zinc/70/64/29/1119706429.db2.gz GUGDBZRHHZNLMJ-JKSUJKDBSA-N 1 3 290.451 3.597 20 0 CHADHO C[C@@H](CCc1ccco1)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000658226169 1119706431 /nfs/dbraw/zinc/70/64/31/1119706431.db2.gz GUGDBZRHHZNLMJ-JKSUJKDBSA-N 1 3 290.451 3.597 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)CCc2ccccc2Cl)C[C@H]1C ZINC000531140607 1119802543 /nfs/dbraw/zinc/80/25/43/1119802543.db2.gz DKIUCFMUTWDKLI-ZBFHGGJFSA-N 1 3 294.870 3.687 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)CCc2ccccc2Cl)C[C@H]1C ZINC000531140607 1119802546 /nfs/dbraw/zinc/80/25/46/1119802546.db2.gz DKIUCFMUTWDKLI-ZBFHGGJFSA-N 1 3 294.870 3.687 20 0 CHADHO C/C(=C\c1ccccc1)C[NH2+]CCCN1CCC(C)CC1 ZINC000236701988 1119803712 /nfs/dbraw/zinc/80/37/12/1119803712.db2.gz VBWYPCZPJSJTSA-OBGWFSINSA-N 1 3 286.463 3.802 20 0 CHADHO CCc1oc2ccccc2c1CN1CC[C@H]([NH3+])[C@@H](CC)C1 ZINC000647498936 1119851067 /nfs/dbraw/zinc/85/10/67/1119851067.db2.gz UINCCRUZXXXDIM-BBRMVZONSA-N 1 3 286.419 3.554 20 0 CHADHO CC(C)C[C@@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000157526227 1119890622 /nfs/dbraw/zinc/89/06/22/1119890622.db2.gz OXWAPCSDTVMNSA-OAHLLOKOSA-N 1 3 266.473 3.808 20 0 CHADHO CC[C@H]([NH2+]C1CCN(C2CCCC2)CC1)[C@H]1CC1(C)C ZINC000414116369 1119905012 /nfs/dbraw/zinc/90/50/12/1119905012.db2.gz QRGCNSDKCMHIGR-SJORKVTESA-N 1 3 278.484 3.808 20 0 CHADHO Cc1cc(C)c(C[N@H+]2CCCC23CCN(C)CC3)cc1C ZINC000472599695 1120001491 /nfs/dbraw/zinc/00/14/91/1120001491.db2.gz NZQIJXAKIOAOIS-UHFFFAOYSA-N 1 3 286.463 3.672 20 0 CHADHO Cc1cc(C)c(C[N@@H+]2CCCC23CCN(C)CC3)cc1C ZINC000472599695 1120001494 /nfs/dbraw/zinc/00/14/94/1120001494.db2.gz NZQIJXAKIOAOIS-UHFFFAOYSA-N 1 3 286.463 3.672 20 0 CHADHO CC[NH+]1CCC(N[C@H]2CCCc3c4ccccc4[nH]c32)CC1 ZINC000204973750 1120063022 /nfs/dbraw/zinc/06/30/22/1120063022.db2.gz PYNWHOMNBXDSEH-SFHVURJKSA-N 1 3 297.446 3.619 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000623657250 1120065544 /nfs/dbraw/zinc/06/55/44/1120065544.db2.gz MDZVGOSYJRDORU-BHIYHBOVSA-N 1 3 286.463 3.644 20 0 CHADHO C[C@@H](Cc1ccc(Cl)cc1)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000623657759 1120065574 /nfs/dbraw/zinc/06/55/74/1120065574.db2.gz YGQHFTCKSTXLPU-GOEBONIOSA-N 1 3 294.870 3.593 20 0 CHADHO CCCC1CCC([NH2+][C@H]2CCC[C@H](N(C)C)C2)CC1 ZINC000715541006 1120109670 /nfs/dbraw/zinc/10/96/70/1120109670.db2.gz GUXRDCDCIKBPQN-GQGLESIBSA-N 1 3 266.473 3.808 20 0 CHADHO C[C@@H](CN(C)CC[C@@H]1CCCC[N@@H+]1C)c1ccccc1 ZINC000472666160 1120137711 /nfs/dbraw/zinc/13/77/11/1120137711.db2.gz LAEHAJZGBHVBBQ-WMZOPIPTSA-N 1 3 274.452 3.596 20 0 CHADHO C[C@@H](CN(C)CC[C@@H]1CCCC[N@H+]1C)c1ccccc1 ZINC000472666160 1120137714 /nfs/dbraw/zinc/13/77/14/1120137714.db2.gz LAEHAJZGBHVBBQ-WMZOPIPTSA-N 1 3 274.452 3.596 20 0 CHADHO C[C@@H](c1ccc(F)cc1)[N@H+](C)CC[C@@H]1CCCCN1C ZINC000472763748 1120164744 /nfs/dbraw/zinc/16/47/44/1120164744.db2.gz NIBZMXJGWWIEQP-YOEHRIQHSA-N 1 3 278.415 3.693 20 0 CHADHO C[C@@H](c1ccc(F)cc1)[N@@H+](C)CC[C@@H]1CCCCN1C ZINC000472763748 1120164747 /nfs/dbraw/zinc/16/47/47/1120164747.db2.gz NIBZMXJGWWIEQP-YOEHRIQHSA-N 1 3 278.415 3.693 20 0 CHADHO CC[NH+](CC)C[C@H]1CCN(C[C@@H](C)Cc2ccccc2)C1 ZINC000182042771 1120312175 /nfs/dbraw/zinc/31/21/75/1120312175.db2.gz FAOUDDGZQBFAMT-PKOBYXMFSA-N 1 3 288.479 3.529 20 0 CHADHO CCN(CC)C[C@H]1CC[N@H+](C[C@@H](C)Cc2ccccc2)C1 ZINC000182042771 1120312180 /nfs/dbraw/zinc/31/21/80/1120312180.db2.gz FAOUDDGZQBFAMT-PKOBYXMFSA-N 1 3 288.479 3.529 20 0 CHADHO CCN(CC)C[C@H]1CC[N@@H+](C[C@@H](C)Cc2ccccc2)C1 ZINC000182042771 1120312182 /nfs/dbraw/zinc/31/21/82/1120312182.db2.gz FAOUDDGZQBFAMT-PKOBYXMFSA-N 1 3 288.479 3.529 20 0 CHADHO C[C@@H]1CC[NH2+]CC[C@@H]1N[C@H]1CCCc2ccc(Cl)cc21 ZINC000629548988 1128914752 /nfs/dbraw/zinc/91/47/52/1128914752.db2.gz PJMHHRMLMGUKKA-DQYPLSBCSA-N 1 3 292.854 3.695 20 0 CHADHO CC(C)(C[NH2+]C1CCN(C2CCCC2)CC1)C(F)(F)F ZINC000584707030 1120416198 /nfs/dbraw/zinc/41/61/98/1120416198.db2.gz FXRKHIWWYODMMI-UHFFFAOYSA-N 1 3 292.389 3.572 20 0 CHADHO CCCC1CCC([NH2+]CCCN(CC)CC)CC1 ZINC000019985617 1120503087 /nfs/dbraw/zinc/50/30/87/1120503087.db2.gz HRTAYIAHSLFEAX-UHFFFAOYSA-N 1 3 254.462 3.667 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1csc(Cl)c1 ZINC000191166067 1120516187 /nfs/dbraw/zinc/51/61/87/1120516187.db2.gz YVPKEETZIMREKI-QWRGUYRKSA-N 1 3 284.856 3.536 20 0 CHADHO C[N@H+](CCCN1CCCC1)[C@@H]1CCCc2ccc(F)cc21 ZINC000499938083 1120554345 /nfs/dbraw/zinc/55/43/45/1120554345.db2.gz XAIUXWSBHQRMFS-GOSISDBHSA-N 1 3 290.426 3.621 20 0 CHADHO C[N@@H+](CCCN1CCCC1)[C@@H]1CCCc2ccc(F)cc21 ZINC000499938083 1120554350 /nfs/dbraw/zinc/55/43/50/1120554350.db2.gz XAIUXWSBHQRMFS-GOSISDBHSA-N 1 3 290.426 3.621 20 0 CHADHO Cc1ccc2[nH]c(C[N@@H+](C)C[C@@H]3CCCN(C)C3)cc2c1C ZINC000473142395 1120806186 /nfs/dbraw/zinc/80/61/86/1120806186.db2.gz CFFLRMBWLPHBOG-MRXNPFEDSA-N 1 3 299.462 3.558 20 0 CHADHO Cc1ccc2[nH]c(C[N@H+](C)C[C@@H]3CCCN(C)C3)cc2c1C ZINC000473142395 1120806189 /nfs/dbraw/zinc/80/61/89/1120806189.db2.gz CFFLRMBWLPHBOG-MRXNPFEDSA-N 1 3 299.462 3.558 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]C[C@H](C)c2ccccc2)C1 ZINC000249042231 1120879992 /nfs/dbraw/zinc/87/99/92/1120879992.db2.gz VATDKUSCLNFRAE-IRXDYDNUSA-N 1 3 274.452 3.500 20 0 CHADHO C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663344068 1120940423 /nfs/dbraw/zinc/94/04/23/1120940423.db2.gz NIYAYHBXDBUDFM-PVAVHDDUSA-N 1 3 278.484 3.523 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCCN(CC2CC2)C1)C1CCCCC1 ZINC000663466951 1120982736 /nfs/dbraw/zinc/98/27/36/1120982736.db2.gz BWKCXDSWMIXZNA-NVXWUHKLSA-N 1 3 278.484 3.667 20 0 CHADHO Cc1ccc([C@H](N[C@@H]2CCC[NH2+]CC2)C2CCC2)cc1 ZINC000643523164 1121005277 /nfs/dbraw/zinc/00/52/77/1121005277.db2.gz XAMOLLPCJPBSPJ-QZTJIDSGSA-N 1 3 272.436 3.568 20 0 CHADHO CC(C)[C@@H]1C[C@@H](N[C@H]2CCC[NH2+]CC2)c2ccccc21 ZINC000643523065 1121005783 /nfs/dbraw/zinc/00/57/83/1121005783.db2.gz VYROMWUHMBVLGO-JCGIZDLHSA-N 1 3 272.436 3.603 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N(C)Cc1cccc(F)c1F ZINC001167840759 1121052482 /nfs/dbraw/zinc/05/24/82/1121052482.db2.gz ILWXJVUPWWRNSR-CQSZACIVSA-N 1 3 298.421 3.907 20 0 CHADHO CN(CC[C@H]1CCCC[N@@H+]1C)[C@H]1CCCc2ccccc21 ZINC000674771516 1121179020 /nfs/dbraw/zinc/17/90/20/1121179020.db2.gz OBVJDOMEUXUQBK-MJGOQNOKSA-N 1 3 286.463 3.870 20 0 CHADHO CN(CC[C@H]1CCCC[N@H+]1C)[C@H]1CCCc2ccccc21 ZINC000674771516 1121179024 /nfs/dbraw/zinc/17/90/24/1121179024.db2.gz OBVJDOMEUXUQBK-MJGOQNOKSA-N 1 3 286.463 3.870 20 0 CHADHO CC[C@H](CN[C@@H]1C[C@@H](C)c2ccccc21)[NH+]1CCCC1 ZINC000675642525 1121331223 /nfs/dbraw/zinc/33/12/23/1121331223.db2.gz PJNXTRHCIBXHDB-IIDMSEBBSA-N 1 3 272.436 3.699 20 0 CHADHO c1ccc([C@H](CC2CC2)N[C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000675751884 1121350994 /nfs/dbraw/zinc/35/09/94/1121350994.db2.gz BMFLZDOJCFBGEN-FHWLQOOXSA-N 1 3 284.447 3.744 20 0 CHADHO c1ccc([C@H](CC2CC2)N[C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000675751884 1121351003 /nfs/dbraw/zinc/35/10/03/1121351003.db2.gz BMFLZDOJCFBGEN-FHWLQOOXSA-N 1 3 284.447 3.744 20 0 CHADHO CC[C@@H]1CCC[C@H](C[N@@H+]2CCC[C@H](N(C)C)CC2)C1 ZINC000432801294 1121366971 /nfs/dbraw/zinc/36/69/71/1121366971.db2.gz VIWFSUMFMQAXPT-IKGGRYGDSA-N 1 3 266.473 3.619 20 0 CHADHO CC[C@@H]1CCC[C@H](C[N@H+]2CCC[C@H](N(C)C)CC2)C1 ZINC000432801294 1121366981 /nfs/dbraw/zinc/36/69/81/1121366981.db2.gz VIWFSUMFMQAXPT-IKGGRYGDSA-N 1 3 266.473 3.619 20 0 CHADHO CCCC[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000512669168 1121521095 /nfs/dbraw/zinc/52/10/95/1121521095.db2.gz YZLWFGIGWQXOHV-CEXWTWQISA-N 1 3 286.463 3.677 20 0 CHADHO CCCC[C@H](CC)CC[NH2+]C[C@@H]1CCN(CC)C1 ZINC000535597493 1121744940 /nfs/dbraw/zinc/74/49/40/1121744940.db2.gz HZJFVINHLIIMQA-HOTGVXAUSA-N 1 3 254.462 3.524 20 0 CHADHO CC(C)(CCN[C@H]1C[C@H]([NH3+])c2ccccc21)C1CC1 ZINC000262128306 1129014359 /nfs/dbraw/zinc/01/43/59/1129014359.db2.gz CVIJAVPBHPCWIH-HOTGVXAUSA-N 1 3 258.409 3.547 20 0 CHADHO CN(Cc1ccoc1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001204245202 1121882979 /nfs/dbraw/zinc/88/29/79/1121882979.db2.gz FPQSCTYJIVGSNG-UHFFFAOYSA-N 1 3 298.430 3.624 20 0 CHADHO Cc1cc(C)c(/C=C\CN[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@H]23)c(C)c1 ZINC001179817265 1121913202 /nfs/dbraw/zinc/91/32/02/1121913202.db2.gz PHTVTKIWLOQGPE-UELLAIJASA-N 1 3 298.474 3.555 20 0 CHADHO Cc1cc(C)c(/C=C\CN[C@@H]2CC[C@@H]3C[N@H+](C)C[C@H]23)c(C)c1 ZINC001179817265 1121913207 /nfs/dbraw/zinc/91/32/07/1121913207.db2.gz PHTVTKIWLOQGPE-UELLAIJASA-N 1 3 298.474 3.555 20 0 CHADHO CC(C)CCCCN1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC001179924871 1121923197 /nfs/dbraw/zinc/92/31/97/1121923197.db2.gz KQBNWIOJSFRRLE-SJLPKXTDSA-N 1 3 278.484 3.761 20 0 CHADHO CC(C)CCCCN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC001179924871 1121923204 /nfs/dbraw/zinc/92/32/04/1121923204.db2.gz KQBNWIOJSFRRLE-SJLPKXTDSA-N 1 3 278.484 3.761 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)CCSC2CCCCC2)[C@H](C)C1 ZINC000501035656 1121945826 /nfs/dbraw/zinc/94/58/26/1121945826.db2.gz IPXRGOXLDFGRSG-NVXWUHKLSA-N 1 3 298.540 3.714 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)CCSC2CCCCC2)[C@H](C)C1 ZINC000501035656 1121945834 /nfs/dbraw/zinc/94/58/34/1121945834.db2.gz IPXRGOXLDFGRSG-NVXWUHKLSA-N 1 3 298.540 3.714 20 0 CHADHO Clc1ccc([C@H](NC[C@@H]2CCC[NH2+]C2)C2CCC2)cc1 ZINC000420399047 1122004501 /nfs/dbraw/zinc/00/45/01/1122004501.db2.gz HMPSPKYYSRYSBV-CXAGYDPISA-N 1 3 292.854 3.770 20 0 CHADHO CC1=C(C)C[C@H]([C@@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)CC1 ZINC001182908907 1122196116 /nfs/dbraw/zinc/19/61/16/1122196116.db2.gz DDVMSIVLEXGTAE-FGTMMUONSA-N 1 3 278.484 3.833 20 0 CHADHO C[C@@]1([NH3+])CCCN(Cc2cccc3c(F)cccc23)CC1 ZINC001205288668 1122251735 /nfs/dbraw/zinc/25/17/35/1122251735.db2.gz NGXQORWDRQBSJF-GOSISDBHSA-N 1 3 286.394 3.682 20 0 CHADHO C[C@@H]1C[C@]1([NH2+]CC[C@H]1CCCN1C)c1ccc(Cl)cc1 ZINC000503368532 1122257071 /nfs/dbraw/zinc/25/70/71/1122257071.db2.gz DMQUJXWIUMRZDG-KBRIMQKVSA-N 1 3 292.854 3.649 20 0 CHADHO C[C@H]([NH2+]C[C@H](N)C1CC1)c1ccc(-c2ccccc2)cc1 ZINC000423320768 1122284567 /nfs/dbraw/zinc/28/45/67/1122284567.db2.gz MPTVAJWURFOCEH-LIRRHRJNSA-N 1 3 280.415 3.742 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@@H](C)c2cccc(CC(C)C)c2)C1 ZINC000514104978 1122376168 /nfs/dbraw/zinc/37/61/68/1122376168.db2.gz NWEFUJBQPDIATK-WMZOPIPTSA-N 1 3 288.479 3.878 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@@H](C)c2cccc(CC(C)C)c2)C1 ZINC000514104978 1122376173 /nfs/dbraw/zinc/37/61/73/1122376173.db2.gz NWEFUJBQPDIATK-WMZOPIPTSA-N 1 3 288.479 3.878 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2cccc(CC(C)C)c2)C1 ZINC000514104978 1122376183 /nfs/dbraw/zinc/37/61/83/1122376183.db2.gz NWEFUJBQPDIATK-WMZOPIPTSA-N 1 3 288.479 3.878 20 0 CHADHO CCN(CC)C[C@H]1CC[N@H+](C[C@@H](C)C2CCCCC2)C1 ZINC001191260069 1122585383 /nfs/dbraw/zinc/58/53/83/1122585383.db2.gz ZCZAUMDDVDZVOI-IAGOWNOFSA-N 1 3 280.500 3.867 20 0 CHADHO CCN(CC)C[C@H]1CC[N@@H+](C[C@@H](C)C2CCCCC2)C1 ZINC001191260069 1122585386 /nfs/dbraw/zinc/58/53/86/1122585386.db2.gz ZCZAUMDDVDZVOI-IAGOWNOFSA-N 1 3 280.500 3.867 20 0 CHADHO CCSc1ccc([C@@H](C)[NH2+]C[C@@H](C)CN(C)C)cc1 ZINC000425932505 1122662958 /nfs/dbraw/zinc/66/29/58/1122662958.db2.gz QKTOJQWQZNNOSR-ZIAGYGMSSA-N 1 3 280.481 3.647 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@H]1CC[C@](C)(c2ccccc2)C1 ZINC000438070562 1122672557 /nfs/dbraw/zinc/67/25/57/1122672557.db2.gz FCZOJMGWNZCQFR-OALUTQOASA-N 1 3 288.479 3.817 20 0 CHADHO C[C@@H]([NH2+]C[C@H](C)CN(C)C)c1cc(Cl)cc(Cl)c1 ZINC000425947215 1122675611 /nfs/dbraw/zinc/67/56/11/1122675611.db2.gz RQTWKKWQFBPTSW-WDEREUQCSA-N 1 3 289.250 3.842 20 0 CHADHO C[N@@H+]1CCC[C@@H]1CCN1CCCC2(CCCC2)CC1 ZINC001196039693 1122904094 /nfs/dbraw/zinc/90/40/94/1122904094.db2.gz PMLOKIOYIYGKRW-MRXNPFEDSA-N 1 3 264.457 3.517 20 0 CHADHO C[N@H+]1CCC[C@@H]1CCN1CCCC2(CCCC2)CC1 ZINC001196039693 1122904097 /nfs/dbraw/zinc/90/40/97/1122904097.db2.gz PMLOKIOYIYGKRW-MRXNPFEDSA-N 1 3 264.457 3.517 20 0 CHADHO C[C@H](CC[N@H+]1CCC[C@H](CN)[C@H]1C)CC(C)(C)C ZINC001205905173 1123070282 /nfs/dbraw/zinc/07/02/82/1123070282.db2.gz ZDNHALHDCWEQCT-RBSFLKMASA-N 1 3 254.462 3.508 20 0 CHADHO C[C@H](CC[N@@H+]1CCC[C@H](CN)[C@H]1C)CC(C)(C)C ZINC001205905173 1123070276 /nfs/dbraw/zinc/07/02/76/1123070276.db2.gz ZDNHALHDCWEQCT-RBSFLKMASA-N 1 3 254.462 3.508 20 0 CHADHO CCC(C)(C)CCN1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000441400943 1123085401 /nfs/dbraw/zinc/08/54/01/1123085401.db2.gz MAVDFNACHTVGJP-RDJZCZTQSA-N 1 3 278.484 3.761 20 0 CHADHO CCC(C)(C)CCN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000441400943 1123085404 /nfs/dbraw/zinc/08/54/04/1123085404.db2.gz MAVDFNACHTVGJP-RDJZCZTQSA-N 1 3 278.484 3.761 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](C)c2cc3ccc(C)cc3o2)C1 ZINC000425924539 1123113560 /nfs/dbraw/zinc/11/35/60/1123113560.db2.gz MVCVXCHDMAEVJH-HUUCEWRRSA-N 1 3 286.419 3.734 20 0 CHADHO CC(C)C[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC001201617115 1123132106 /nfs/dbraw/zinc/13/21/06/1123132106.db2.gz DOUVRKORLQYXQN-GUDVDZBRSA-N 1 3 286.463 3.533 20 0 CHADHO CC(C)CCN1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC001201623787 1123132508 /nfs/dbraw/zinc/13/25/08/1123132508.db2.gz MMAYABAZKZUOPA-UHFFFAOYSA-N 1 3 274.452 3.629 20 0 CHADHO CC(C)CCN1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC001201623787 1123132509 /nfs/dbraw/zinc/13/25/09/1123132509.db2.gz MMAYABAZKZUOPA-UHFFFAOYSA-N 1 3 274.452 3.629 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H]2CCc3ccc(F)cc32)C1 ZINC000246922471 1123140024 /nfs/dbraw/zinc/14/00/24/1123140024.db2.gz GNRAGLSMTBIWCM-KSSFIOAISA-N 1 3 290.426 3.523 20 0 CHADHO c1ccc(C[N@@H+]2C[C@H]3CN(CC4CCCC4)CC[C@@H]3C2)cc1 ZINC001202189938 1123184774 /nfs/dbraw/zinc/18/47/74/1123184774.db2.gz GUXXHEHVYFQDPF-WOJBJXKFSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(C[N@H+]2C[C@H]3CN(CC4CCCC4)CC[C@@H]3C2)cc1 ZINC001202189938 1123184775 /nfs/dbraw/zinc/18/47/75/1123184775.db2.gz GUXXHEHVYFQDPF-WOJBJXKFSA-N 1 3 298.474 3.631 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]CC2(N)CCCC2)c2sccc21 ZINC000665246567 1123253763 /nfs/dbraw/zinc/25/37/63/1123253763.db2.gz IXAGBNNXZWLHHK-YPMHNXCESA-N 1 3 264.438 3.548 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+]CC2CCC(C)(C)CC2)C1 ZINC000311570772 1129110403 /nfs/dbraw/zinc/11/04/03/1129110403.db2.gz MJYAMUQSLJSADO-INIZCTEOSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)CC[C@@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1ccoc1 ZINC000428217986 1123283337 /nfs/dbraw/zinc/28/33/37/1123283337.db2.gz IQAQTHDFKNRVIJ-CRAIPNDOSA-N 1 3 290.451 3.831 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@H]2NCC[C@@H]([NH3+])C(C)C ZINC000665280665 1123314091 /nfs/dbraw/zinc/31/40/91/1123314091.db2.gz INWJGWNQCAJPJX-FVQBIDKESA-N 1 3 260.425 3.506 20 0 CHADHO C[C@H](CC(C)(C)C)[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000853240246 1123429152 /nfs/dbraw/zinc/42/91/52/1123429152.db2.gz NRODDDNKPPFWHZ-GDBMZVCRSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)CN1CCC([NH2+]CCc2cccc(Cl)c2)CC1 ZINC000157061805 1129121648 /nfs/dbraw/zinc/12/16/48/1129121648.db2.gz AYGZFDHLCNAOCV-UHFFFAOYSA-N 1 3 294.870 3.593 20 0 CHADHO CCN1CCC[C@@H](C[NH2+]C[C@@H](c2ccccc2)C(C)C)C1 ZINC000474604005 1123557800 /nfs/dbraw/zinc/55/78/00/1123557800.db2.gz PYMCCEIBJHDQEA-PKOBYXMFSA-N 1 3 288.479 3.748 20 0 CHADHO C[C@H](CC[NH2+]C[C@H]1C[C@@H]1c1ccccc1)N1CCCCC1 ZINC000346257929 1123676553 /nfs/dbraw/zinc/67/65/53/1123676553.db2.gz YFOACFIGSZYRNR-BHIYHBOVSA-N 1 3 286.463 3.644 20 0 CHADHO C[C@H]([NH3+])[C@@H]1CCN(Cc2cc(-c3ccccc3)cs2)C1 ZINC000346650551 1123701128 /nfs/dbraw/zinc/70/11/28/1123701128.db2.gz PQBKCOCVGWCLMW-DZGCQCFKSA-N 1 3 286.444 3.584 20 0 CHADHO C[C@@H](CC[NH2+][C@@H]1CCCc2sccc21)N1CCCCC1 ZINC000346876265 1123729018 /nfs/dbraw/zinc/72/90/18/1123729018.db2.gz JQNPUHWXVALQHM-GOEBONIOSA-N 1 3 292.492 3.980 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+]CC[C@@H](C)c2ccccc2)C1 ZINC000043534256 1123820220 /nfs/dbraw/zinc/82/02/20/1123820220.db2.gz RBZPSXXIIVDTMZ-SJORKVTESA-N 1 3 274.452 3.500 20 0 CHADHO C[C@@H](Cc1ccc(F)cc1)[NH2+]CCCN1CCCC[C@@H]1C ZINC000221815653 1124035374 /nfs/dbraw/zinc/03/53/74/1124035374.db2.gz IOPBIXIKLGPBAE-HOTGVXAUSA-N 1 3 292.442 3.611 20 0 CHADHO CC[C@H](N[C@H]1CC[NH2+]CC(C)(C)C1)c1cccc(OC)c1 ZINC000635009211 1129170034 /nfs/dbraw/zinc/17/00/34/1129170034.db2.gz GGINPNFLOWOLBZ-RDJZCZTQSA-N 1 3 290.451 3.514 20 0 CHADHO CCOc1ccc([C@@H](C)N[C@H]2CC[NH2+]CC(C)(C)C2)cc1 ZINC000635012307 1129170138 /nfs/dbraw/zinc/17/01/38/1129170138.db2.gz SILSOCFGGHJCQF-ZBFHGGJFSA-N 1 3 290.451 3.514 20 0 CHADHO CC[C@@H](NCc1cccc2c1CC[NH2+]C2)c1ccccc1F ZINC000635013075 1129170280 /nfs/dbraw/zinc/17/02/80/1129170280.db2.gz ZEKYZOZVYXJNMS-LJQANCHMSA-N 1 3 298.405 3.712 20 0 CHADHO CCCN1CC[C@H](C[NH2+]C2CCC(C(C)(C)C)CC2)C1 ZINC000525703535 1124457863 /nfs/dbraw/zinc/45/78/63/1124457863.db2.gz VSVIPIYWWXLIND-KLAILNCOSA-N 1 3 280.500 3.913 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]C[C@H](C)c2ccc(F)cc2)C1 ZINC000526118971 1124512403 /nfs/dbraw/zinc/51/24/03/1124512403.db2.gz BYFRQMNAFSGTPR-JKSUJKDBSA-N 1 3 292.442 3.639 20 0 CHADHO CC(C)CCC[NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000527354876 1124572659 /nfs/dbraw/zinc/57/26/59/1124572659.db2.gz BXCVHYBFSCWJIB-JKSUJKDBSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H]2C[C@H](C)CC[C@@H]2C)C1 ZINC000449129622 1124653414 /nfs/dbraw/zinc/65/34/14/1124653414.db2.gz CYNZLLUTJXIFBG-QZWWFDLISA-N 1 3 266.473 3.521 20 0 CHADHO C[C@H]([NH2+]CCCN1CCCC[C@H]1C)c1cccs1 ZINC000019913054 1124666064 /nfs/dbraw/zinc/66/60/64/1124666064.db2.gz WLHANWMXSINUEL-KGLIPLIRSA-N 1 3 266.454 3.663 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+][C@@H]2CCCC23CCC3)C1 ZINC000449211247 1124669344 /nfs/dbraw/zinc/66/93/44/1124669344.db2.gz RTIJFWKPDXYYEK-IAGOWNOFSA-N 1 3 278.484 3.667 20 0 CHADHO C[C@H]1CCCC[C@@H]1[NH+]1CCC(NC2CC(C)(F)C2)CC1 ZINC000449374636 1124704187 /nfs/dbraw/zinc/70/41/87/1124704187.db2.gz BGVNNBARESHDKW-PXZKZTPFSA-N 1 3 282.447 3.510 20 0 CHADHO C(C1CC2(CCC2)C1)[NH+]1CCC(N2CCCCC2)CC1 ZINC000877969624 1125109269 /nfs/dbraw/zinc/10/92/69/1125109269.db2.gz AMIIOCHLLRGQBZ-UHFFFAOYSA-N 1 3 276.468 3.517 20 0 CHADHO CCN1CC[C@H]([N@H+](C)C/C=C\c2ccccc2)C[C@@H]1C ZINC000531381985 1125213731 /nfs/dbraw/zinc/21/37/31/1125213731.db2.gz QVAVCBJWJMQQIU-QUZNCXEESA-N 1 3 272.436 3.504 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)C/C=C\c2ccccc2)C[C@@H]1C ZINC000531381985 1125213735 /nfs/dbraw/zinc/21/37/35/1125213735.db2.gz QVAVCBJWJMQQIU-QUZNCXEESA-N 1 3 272.436 3.504 20 0 CHADHO CCC(CC)(CC)C[NH2+]C[C@H]1CCCCN(C)C1 ZINC000628425666 1125244680 /nfs/dbraw/zinc/24/46/80/1125244680.db2.gz RDUOJAXVDQXDDQ-OAHLLOKOSA-N 1 3 254.462 3.524 20 0 CHADHO CS[C@H]1CC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000128318556 1125260736 /nfs/dbraw/zinc/26/07/36/1125260736.db2.gz DCOOWLLGANNVFI-RDJZCZTQSA-N 1 3 296.524 3.657 20 0 CHADHO C[NH2+]C[C@H]1CCCN([C@H](C)c2c(C)cc(C)cc2C)C1 ZINC000040592953 1125388853 /nfs/dbraw/zinc/38/88/53/1125388853.db2.gz HGZNRVQOEGSORY-IAGOWNOFSA-N 1 3 274.452 3.604 20 0 CHADHO C/C(=C\c1ccccc1)C[NH2+]C1CCN(CC2CC2)CC1 ZINC000171050197 1125400376 /nfs/dbraw/zinc/40/03/76/1125400376.db2.gz NZKOBZBUKVSYHL-DTQAZKPQSA-N 1 3 284.447 3.554 20 0 CHADHO CC[C@H]1c2ccsc2CC[N@H+]1CC[C@@H]1CCCN1C ZINC000124926133 1125443262 /nfs/dbraw/zinc/44/32/62/1125443262.db2.gz USKOMTPNBBBKMI-ZFWWWQNUSA-N 1 3 278.465 3.542 20 0 CHADHO CC[C@H]1c2ccsc2CC[N@@H+]1CC[C@@H]1CCCN1C ZINC000124926133 1125443265 /nfs/dbraw/zinc/44/32/65/1125443265.db2.gz USKOMTPNBBBKMI-ZFWWWQNUSA-N 1 3 278.465 3.542 20 0 CHADHO CCCc1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)N3C)s1 ZINC000621727545 1129186456 /nfs/dbraw/zinc/18/64/56/1129186456.db2.gz IENYVVCMVAGMQF-YIONKMFJSA-N 1 3 292.492 3.758 20 0 CHADHO CCCc1ccc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)N3C)s1 ZINC000621727545 1129186459 /nfs/dbraw/zinc/18/64/59/1129186459.db2.gz IENYVVCMVAGMQF-YIONKMFJSA-N 1 3 292.492 3.758 20 0 CHADHO CCC[N@H+](CC[C@@H]1CCCN1C)Cc1ccc(F)cc1 ZINC000348070247 1129276829 /nfs/dbraw/zinc/27/68/29/1129276829.db2.gz IUQORSYIYMACHS-KRWDZBQOSA-N 1 3 278.415 3.522 20 0 CHADHO CCC[N@@H+](CC[C@@H]1CCCN1C)Cc1ccc(F)cc1 ZINC000348070247 1129276830 /nfs/dbraw/zinc/27/68/30/1129276830.db2.gz IUQORSYIYMACHS-KRWDZBQOSA-N 1 3 278.415 3.522 20 0 CHADHO C[C@H](c1ccccc1Cl)N(C)CC1CC[NH+](C)CC1 ZINC000738312097 1129393028 /nfs/dbraw/zinc/39/30/28/1129393028.db2.gz OFAPMXVOYXYMNZ-CYBMUJFWSA-N 1 3 280.843 3.675 20 0 CHADHO CCCc1ccc(C[NH2+]C2CCN(CC(C)C)CC2)cc1 ZINC000642340034 1129414450 /nfs/dbraw/zinc/41/44/50/1129414450.db2.gz VCXCXQISAOSLCB-UHFFFAOYSA-N 1 3 288.479 3.849 20 0 CHADHO NC[C@H]1CCC[C@@H]1[NH2+]CCc1ccc(-c2ccccc2)cc1 ZINC000643467721 1129442170 /nfs/dbraw/zinc/44/21/70/1129442170.db2.gz XGGPLUBUFGTDBF-UXHICEINSA-N 1 3 294.442 3.613 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CCCCc1ccccc1 ZINC000643458316 1129442254 /nfs/dbraw/zinc/44/22/54/1129442254.db2.gz IUTOGDSVDXEMNM-OAHLLOKOSA-N 1 3 297.446 3.522 20 0 CHADHO [NH3+][C@@H]1C[C@H](NC[C@@H]2CCc3ccccc3C2)c2ccccc21 ZINC000643478083 1129442443 /nfs/dbraw/zinc/44/24/43/1129442443.db2.gz WRDNBPGQVZWDBP-XMCHAPAWSA-N 1 3 292.426 3.526 20 0 CHADHO C[C@@H](N)C[NH2+][C@H](C)c1ccc(-c2c(F)cccc2F)cc1 ZINC000643527637 1129444472 /nfs/dbraw/zinc/44/44/72/1129444472.db2.gz PWDLDQSWPWKBDT-VXGBXAGGSA-N 1 3 290.357 3.630 20 0 CHADHO Clc1ccc2c(c1)[C@H](N[C@H]1CCC[NH2+]CC1)CCCC2 ZINC000643522685 1129444922 /nfs/dbraw/zinc/44/49/22/1129444922.db2.gz RVDDNDWAKJORPK-DOTOQJQBSA-N 1 3 292.854 3.839 20 0 CHADHO Cc1ccccc1C[C@H]([NH2+][C@H]1CCNC2(CCC2)C1)C1CC1 ZINC000643547473 1129445550 /nfs/dbraw/zinc/44/55/50/1129445550.db2.gz FXSMSMJTWLXTRS-OALUTQOASA-N 1 3 298.474 3.580 20 0 CHADHO C[C@@H]1c2c(F)cccc2CCN1CCCC1CC[NH2+]CC1 ZINC000647885767 1129587137 /nfs/dbraw/zinc/58/71/37/1129587137.db2.gz OERICQDAVVGTFX-CQSZACIVSA-N 1 3 290.426 3.525 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)N1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000647970011 1129589656 /nfs/dbraw/zinc/58/96/56/1129589656.db2.gz RHIXHSKSKOHNSW-CZUORRHYSA-N 1 3 292.854 3.723 20 0 CHADHO CN1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccc3sccc3c1)C2 ZINC001169099145 1129696471 /nfs/dbraw/zinc/69/64/71/1129696471.db2.gz OCZJEEDFIJSCSJ-MUJYYYPQSA-N 1 3 286.444 3.616 20 0 CHADHO CCC[C@@H](NC1CC[NH+](CC)CC1)c1ccc(F)cc1 ZINC001169230316 1129710732 /nfs/dbraw/zinc/71/07/32/1129710732.db2.gz XWXDQPNWCLAXIP-QGZVFWFLSA-N 1 3 278.415 3.741 20 0 CHADHO C[C@H]1CCC[C@H](N2CCC([NH2+]C3CC4(CCC4)C3)CC2)C1 ZINC000652051709 1129756415 /nfs/dbraw/zinc/75/64/15/1129756415.db2.gz NSYPWXLJWLJFDA-YJBOKZPZSA-N 1 3 290.495 3.952 20 0 CHADHO CCCCCC[C@H](CCC)[NH2+][C@@H]1CCNC[C@H]1C ZINC001246212411 1131400536 /nfs/dbraw/zinc/40/05/36/1131400536.db2.gz VDILVXGMJVZWAX-OWCLPIDISA-N 1 3 254.462 3.713 20 0 CHADHO C[N@H+](CC1CCC1)C1CCN(C2CCCCC2)CC1 ZINC001202791693 1129844431 /nfs/dbraw/zinc/84/44/31/1129844431.db2.gz DJGFWYGGYFEBCB-UHFFFAOYSA-N 1 3 264.457 3.515 20 0 CHADHO C[N@@H+](CC1CCC1)C1CCN(C2CCCCC2)CC1 ZINC001202791693 1129844434 /nfs/dbraw/zinc/84/44/34/1129844434.db2.gz DJGFWYGGYFEBCB-UHFFFAOYSA-N 1 3 264.457 3.515 20 0 CHADHO CC[N@H+](CCC1CCN(C/C=C/Cl)CC1)CC1CC1 ZINC000771476281 1129981785 /nfs/dbraw/zinc/98/17/85/1129981785.db2.gz WZBJWCQDCILWOV-YCRREMRBSA-N 1 3 284.875 3.573 20 0 CHADHO CC[N@@H+](CCC1CCN(C/C=C/Cl)CC1)CC1CC1 ZINC000771476281 1129981788 /nfs/dbraw/zinc/98/17/88/1129981788.db2.gz WZBJWCQDCILWOV-YCRREMRBSA-N 1 3 284.875 3.573 20 0 CHADHO COc1cc([C@H](C)N[C@@H](C)C[C@@H](C)[NH3+])cc2ccccc21 ZINC000902514706 1130018039 /nfs/dbraw/zinc/01/80/39/1130018039.db2.gz USBCXDUTCMTHLW-RDBSUJKOSA-N 1 3 286.419 3.625 20 0 CHADHO C[C@H]([NH2+]C1C[C@@H]2CCC[C@H]2C1)[C@@H]1CCCN(C2CCC2)C1 ZINC000902948928 1130089366 /nfs/dbraw/zinc/08/93/66/1130089366.db2.gz YNPBXHZCXUDIMF-LUKYLMHMSA-N 1 3 290.495 3.808 20 0 CHADHO CC(C)[N@@H+](Cc1cccc(Cl)c1)C[C@@H](N)CC(F)F ZINC000903884134 1130206990 /nfs/dbraw/zinc/20/69/90/1130206990.db2.gz SMPWNPSANSCQQE-ZDUSSCGKSA-N 1 3 290.785 3.533 20 0 CHADHO CC(C)[N@H+](Cc1cccc(Cl)c1)C[C@@H](N)CC(F)F ZINC000903884134 1130206994 /nfs/dbraw/zinc/20/69/94/1130206994.db2.gz SMPWNPSANSCQQE-ZDUSSCGKSA-N 1 3 290.785 3.533 20 0 CHADHO Cc1c(Cl)ccc(CN2CCC[C@H](C[NH3+])[C@@H](C)C2)c1F ZINC001206036776 1130254052 /nfs/dbraw/zinc/25/40/52/1130254052.db2.gz PVYQVPFSPFEVNG-WCQYABFASA-N 1 3 298.833 3.594 20 0 CHADHO C(CN1CCC[C@H](C2CC2)C1)C[N@@H+]1CCC[C@H](C2CC2)C1 ZINC000677056886 1130285449 /nfs/dbraw/zinc/28/54/49/1130285449.db2.gz KOTPVLVEXKUJFK-OALUTQOASA-N 1 3 290.495 3.621 20 0 CHADHO C(CN1CCC[C@H](C2CC2)C1)C[N@H+]1CCC[C@H](C2CC2)C1 ZINC000677056886 1130285453 /nfs/dbraw/zinc/28/54/53/1130285453.db2.gz KOTPVLVEXKUJFK-OALUTQOASA-N 1 3 290.495 3.621 20 0 CHADHO c1ccc2c(c1)cccc2CCN[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000677237042 1130296023 /nfs/dbraw/zinc/29/60/23/1130296023.db2.gz ZFSMNINRYARVEO-MOPGFXCFSA-N 1 3 294.442 3.599 20 0 CHADHO c1ccc2c(c1)cccc2CCN[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000677237042 1130296028 /nfs/dbraw/zinc/29/60/28/1130296028.db2.gz ZFSMNINRYARVEO-MOPGFXCFSA-N 1 3 294.442 3.599 20 0 CHADHO c1cc(-c2ccc3c(c2)CC[NH2+]C3)ccc1C1=NCCC1 ZINC001240455435 1130316635 /nfs/dbraw/zinc/31/66/35/1130316635.db2.gz PGXJDJOVSPWUOW-UHFFFAOYSA-N 1 3 276.383 3.582 20 0 CHADHO Cc1ccc(C[N@@H+]2CCCC[C@@H]2CCN2CCCC2)s1 ZINC001204034328 1130329612 /nfs/dbraw/zinc/32/96/12/1130329612.db2.gz GRCJRFYFURSIHW-MRXNPFEDSA-N 1 3 292.492 3.897 20 0 CHADHO Cc1ccc(C[N@H+]2CCCC[C@@H]2CCN2CCCC2)s1 ZINC001204034328 1130329617 /nfs/dbraw/zinc/32/96/17/1130329617.db2.gz GRCJRFYFURSIHW-MRXNPFEDSA-N 1 3 292.492 3.897 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2ccccc2C2CC2)[C@H](C)C1 ZINC000678277432 1130388884 /nfs/dbraw/zinc/38/88/84/1130388884.db2.gz JHNNTKUKKZQPPB-DNVCBOLYSA-N 1 3 286.463 3.726 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2ccccc2C2CC2)[C@H](C)C1 ZINC000678277432 1130388890 /nfs/dbraw/zinc/38/88/90/1130388890.db2.gz JHNNTKUKKZQPPB-DNVCBOLYSA-N 1 3 286.463 3.726 20 0 CHADHO C[C@@H]1CCc2ccccc2[C@@H]1N[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000678609525 1130441606 /nfs/dbraw/zinc/44/16/06/1130441606.db2.gz PAZLEKOLQZSPLU-VYCZESIESA-N 1 3 284.447 3.526 20 0 CHADHO C[C@@H]1CCc2ccccc2[C@@H]1N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000678609525 1130441607 /nfs/dbraw/zinc/44/16/07/1130441607.db2.gz PAZLEKOLQZSPLU-VYCZESIESA-N 1 3 284.447 3.526 20 0 CHADHO C[C@@H]([NH2+]CC1CCCCC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000679740028 1130552893 /nfs/dbraw/zinc/55/28/93/1130552893.db2.gz UALZJBJEAYUSSD-NVXWUHKLSA-N 1 3 278.484 3.809 20 0 CHADHO c1ccc(C2(CN3CCC[C@]4(CC[NH2+]C4)C3)CCCC2)cc1 ZINC001234993469 1130699827 /nfs/dbraw/zinc/69/98/27/1130699827.db2.gz NYVRNYDMXQHHHD-LJQANCHMSA-N 1 3 298.474 3.574 20 0 CHADHO C[C@@H](CCN1CCC[C@]2(CC[NH2+]C2)C1)CC(C)(C)C ZINC001234991463 1130701678 /nfs/dbraw/zinc/70/16/78/1130701678.db2.gz HUCMWJKKJBRRKL-DOTOQJQBSA-N 1 3 266.473 3.524 20 0 CHADHO c1cc(CN2CCC[C@]3(CCC[NH2+]3)CC2)c2cccccc1-2 ZINC001235039657 1130705388 /nfs/dbraw/zinc/70/53/88/1130705388.db2.gz OZBSBTSJVLTZAJ-HXUWFJFHSA-N 1 3 294.442 3.900 20 0 CHADHO Cc1ccc([C@H](C)CCN2CCC[C@@]3(CCC[NH2+]3)CC2)o1 ZINC001235041891 1130705877 /nfs/dbraw/zinc/70/58/77/1130705877.db2.gz UPJVQLRBCLVELX-QAPCUYQASA-N 1 3 290.451 3.690 20 0 CHADHO CC(C)c1ccccc1CN1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001235041018 1130705927 /nfs/dbraw/zinc/70/59/27/1130705927.db2.gz WIYHQXGMPVKIJB-IBGZPJMESA-N 1 3 286.463 3.918 20 0 CHADHO CC/C=C\CC[N@@H+]1CC[C@@]2(c3ccccc3)CCNC[C@H]2C1 ZINC001235366862 1130737819 /nfs/dbraw/zinc/73/78/19/1130737819.db2.gz RWISRRSGLNNBJI-FPMVPNIMSA-N 1 3 298.474 3.596 20 0 CHADHO CC/C=C\CC[N@H+]1CC[C@@]2(c3ccccc3)CCNC[C@H]2C1 ZINC001235366862 1130737821 /nfs/dbraw/zinc/73/78/21/1130737821.db2.gz RWISRRSGLNNBJI-FPMVPNIMSA-N 1 3 298.474 3.596 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CC[C@@]2(C1)CNCC[C@@H]2F ZINC001235410503 1130740226 /nfs/dbraw/zinc/74/02/26/1130740226.db2.gz YILLZPCZUDEQSC-BZSNNMDCSA-N 1 3 296.474 3.783 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CC[C@@]2(C1)CNCC[C@@H]2F ZINC001235410503 1130740230 /nfs/dbraw/zinc/74/02/30/1130740230.db2.gz YILLZPCZUDEQSC-BZSNNMDCSA-N 1 3 296.474 3.783 20 0 CHADHO Clc1cc(CN2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)cs1 ZINC001235426747 1130742515 /nfs/dbraw/zinc/74/25/15/1130742515.db2.gz LCYSCFOWQQHUJU-KBPBESRZSA-N 1 3 298.883 3.613 20 0 CHADHO CC(C)=CCCC1=CC[C@H](C[N@H+](C)CCCN)CC1 ZINC001235435290 1130743143 /nfs/dbraw/zinc/74/31/43/1130743143.db2.gz HLEMNFNEBIGXLR-KRWDZBQOSA-N 1 3 264.457 3.740 20 0 CHADHO CC(C)=CCCC1=CC[C@H](C[N@@H+](C)CCCN)CC1 ZINC001235435290 1130743148 /nfs/dbraw/zinc/74/31/48/1130743148.db2.gz HLEMNFNEBIGXLR-KRWDZBQOSA-N 1 3 264.457 3.740 20 0 CHADHO CCCCC1CC[NH+](Cc2ccc3c(c2)CNC3)CC1 ZINC001235433534 1130744077 /nfs/dbraw/zinc/74/40/77/1130744077.db2.gz YOBOJOZGADFHCA-UHFFFAOYSA-N 1 3 272.436 3.692 20 0 CHADHO CCN(CCC[NH+](C)C)Cc1ccccc1-c1ccncc1 ZINC001235622683 1130758547 /nfs/dbraw/zinc/75/85/47/1130758547.db2.gz OHPVWSVWGWJZAG-UHFFFAOYSA-N 1 3 297.446 3.522 20 0 CHADHO [NH3+]C[C@H]1CCCN(Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001235677022 1130766390 /nfs/dbraw/zinc/76/63/90/1130766390.db2.gz WFDCXYUNNYMUKV-OAHLLOKOSA-N 1 3 298.405 3.663 20 0 CHADHO Cc1cccc(C)c1-c1cccc(CN2CC[C@@H](C[NH3+])C2)c1 ZINC001235748585 1130776361 /nfs/dbraw/zinc/77/63/61/1130776361.db2.gz CHTLYCYDXAMRHO-SFHVURJKSA-N 1 3 294.442 3.751 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@@H+]1CCC[C@H]1CCN ZINC001235925536 1130806517 /nfs/dbraw/zinc/80/65/17/1130806517.db2.gz TXHYIYRYYWHIDL-CVEARBPZSA-N 1 3 252.446 3.572 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@H+]1CCC[C@H]1CCN ZINC001235925536 1130806525 /nfs/dbraw/zinc/80/65/25/1130806525.db2.gz TXHYIYRYYWHIDL-CVEARBPZSA-N 1 3 252.446 3.572 20 0 CHADHO CCCCC[NH+](CCCCC)Cc1ccc2n1CCNC2 ZINC001235963960 1130820358 /nfs/dbraw/zinc/82/03/58/1130820358.db2.gz XCDZUHIYSDUUEO-UHFFFAOYSA-N 1 3 291.483 3.774 20 0 CHADHO C[NH2+]C[C@@H]1CCN(Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001236066016 1130845246 /nfs/dbraw/zinc/84/52/46/1130845246.db2.gz GLWBFPJCEISZEB-HNNXBMFYSA-N 1 3 298.405 3.534 20 0 CHADHO C[NH2+]C[C@@H]1CCN(Cc2ccccc2-c2ccccc2C)C1 ZINC001236065712 1130845546 /nfs/dbraw/zinc/84/55/46/1130845546.db2.gz CRKREEGLQRMHNC-KRWDZBQOSA-N 1 3 294.442 3.703 20 0 CHADHO c1[nH]c2ccccc2c1[C@H]1CCCN1CC[C@@H]1CCCC[NH2+]1 ZINC001236191020 1130883615 /nfs/dbraw/zinc/88/36/15/1130883615.db2.gz JBZAAJUQJQQYRF-HNAYVOBHSA-N 1 3 297.446 3.837 20 0 CHADHO CC(C)=CCC[C@H](C)CN(C)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236210533 1130888780 /nfs/dbraw/zinc/88/87/80/1130888780.db2.gz DFZMOYAUJVVPTF-HRCADAONSA-N 1 3 252.446 3.571 20 0 CHADHO Cc1sc2ccccc2c1C[N@@H+](C)[C@@H]1CCCC[C@@H]1N ZINC001236216189 1130892361 /nfs/dbraw/zinc/89/23/61/1130892361.db2.gz IWLHHYIYEQSDHY-JKSUJKDBSA-N 1 3 288.460 3.911 20 0 CHADHO Cc1sc2ccccc2c1C[N@H+](C)[C@@H]1CCCC[C@@H]1N ZINC001236216189 1130892367 /nfs/dbraw/zinc/89/23/67/1130892367.db2.gz IWLHHYIYEQSDHY-JKSUJKDBSA-N 1 3 288.460 3.911 20 0 CHADHO CC(C)(C)CC[N@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236371310 1130922582 /nfs/dbraw/zinc/92/25/82/1130922582.db2.gz KXSOOVNJWSOWPC-OAHLLOKOSA-N 1 3 266.473 3.667 20 0 CHADHO CC(C)(C)CC[N@@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236371310 1130922585 /nfs/dbraw/zinc/92/25/85/1130922585.db2.gz KXSOOVNJWSOWPC-OAHLLOKOSA-N 1 3 266.473 3.667 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](CN2CC[C@@](F)(C[NH3+])C2)CC1 ZINC001236433767 1130940838 /nfs/dbraw/zinc/94/08/38/1130940838.db2.gz IKTXJMDWUYMVND-QZTJIDSGSA-N 1 3 294.458 3.832 20 0 CHADHO C[C@]1(C[NH3+])CCN(Cc2ccc(-c3ccc(F)cc3)cc2)C1 ZINC001236603640 1130982116 /nfs/dbraw/zinc/98/21/16/1130982116.db2.gz BLAHSCUBTHNKNX-LJQANCHMSA-N 1 3 298.405 3.663 20 0 CHADHO C[C@@]1(C[NH3+])CCN(Cc2cccc(-c3ccsc3)c2)C1 ZINC001236605470 1130982971 /nfs/dbraw/zinc/98/29/71/1130982971.db2.gz VJZDFTYAQAAMMP-KRWDZBQOSA-N 1 3 286.444 3.586 20 0 CHADHO C[C@@]1(C[NH3+])CCN(Cc2ccc(-c3cccs3)cc2)C1 ZINC001236605915 1130984168 /nfs/dbraw/zinc/98/41/68/1130984168.db2.gz WXRDEAUFRLIKCL-KRWDZBQOSA-N 1 3 286.444 3.586 20 0 CHADHO CCCN(Cc1ccc(C2CCC2)cc1)C[C@H]1CC[NH2+]C1 ZINC001236843126 1131021851 /nfs/dbraw/zinc/02/18/51/1131021851.db2.gz LBBWIQDZAPNQLF-KRWDZBQOSA-N 1 3 286.463 3.776 20 0 CHADHO CCCN(Cc1ccc(C)c(Cl)c1C)C[C@@H]1CC[NH2+]C1 ZINC001236843328 1131022288 /nfs/dbraw/zinc/02/22/88/1131022288.db2.gz HNWPLSXHFZKYOM-OAHLLOKOSA-N 1 3 294.870 3.778 20 0 CHADHO CCCN(CCC[NH+](C)C)Cc1ccc(F)c2ccoc21 ZINC001236901371 1131029752 /nfs/dbraw/zinc/02/97/52/1131029752.db2.gz LOJKNERWWFDEGU-UHFFFAOYSA-N 1 3 292.398 3.736 20 0 CHADHO Cc1ccc2ccccc2c1CN1CC[C@H]2[NH2+]CCC[C@@H]2C1 ZINC001237408187 1131096325 /nfs/dbraw/zinc/09/63/25/1131096325.db2.gz ZAFWLDFHUKQROJ-YLJYHZDGSA-N 1 3 294.442 3.722 20 0 CHADHO N[C@H]1C[C@@H]([NH2+]CCSCc2ccccc2)c2ccccc21 ZINC000817896890 1131187331 /nfs/dbraw/zinc/18/73/31/1131187331.db2.gz YCHQXIQMODDGJN-ZWKOTPCHSA-N 1 3 298.455 3.654 20 0 CHADHO C[C@]1(CCN[C@H]2C[C@H]([NH3+])c3ccccc32)CC1(Cl)Cl ZINC000817935820 1131188539 /nfs/dbraw/zinc/18/85/39/1131188539.db2.gz FAIBXGITOSXONM-IHRRRGAJSA-N 1 3 299.245 3.695 20 0 CHADHO CCN1CCC[C@H](C[NH2+][C@H](C)c2nccc3ccccc32)C1 ZINC001117671529 1131191109 /nfs/dbraw/zinc/19/11/09/1131191109.db2.gz KASHBMGUUJBNRT-HZPDHXFCSA-N 1 3 297.446 3.617 20 0 CHADHO CCOc1cccc([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000817962155 1131192267 /nfs/dbraw/zinc/19/22/67/1131192267.db2.gz GOGMOHOPCCQDHL-GJZGRUSLSA-N 1 3 298.430 3.956 20 0 CHADHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccnc(Cl)c1 ZINC000817961784 1131192898 /nfs/dbraw/zinc/19/28/98/1131192898.db2.gz CCEYNFRLOJWBGH-NWDGAFQWSA-N 1 3 289.810 3.606 20 0 CHADHO CCN(CC)CCC[N@H+](C)[C@H]1CCC[C@H]1c1ccccc1 ZINC001171018911 1131429022 /nfs/dbraw/zinc/42/90/22/1131429022.db2.gz UAGUMUGEEBVRBW-OALUTQOASA-N 1 3 288.479 3.986 20 0 CHADHO CCN(CC)CCC[N@@H+](C)[C@H]1CCC[C@H]1c1ccccc1 ZINC001171018911 1131429025 /nfs/dbraw/zinc/42/90/25/1131429025.db2.gz UAGUMUGEEBVRBW-OALUTQOASA-N 1 3 288.479 3.986 20 0 CHADHO CC[NH+](CC)CCCN(C)[C@H]1CCC[C@H]1c1ccccc1 ZINC001171018911 1131429026 /nfs/dbraw/zinc/42/90/26/1131429026.db2.gz UAGUMUGEEBVRBW-OALUTQOASA-N 1 3 288.479 3.986 20 0 CHADHO Cc1cnc(CNCCCCCCC[NH+]2CCCC2)s1 ZINC000823812916 1131442788 /nfs/dbraw/zinc/44/27/88/1131442788.db2.gz RLJHRYHAIFDUDN-UHFFFAOYSA-N 1 3 295.496 3.587 20 0 CHADHO CC[C@@H]1C[C@@H](N[C@@H]2CC23CCCCC3)C[C@H](CC)[NH2+]1 ZINC001246333587 1131474385 /nfs/dbraw/zinc/47/43/85/1131474385.db2.gz KEIQKNZGPVZFFC-QKPAOTATSA-N 1 3 264.457 3.608 20 0 CHADHO CCCCCC[C@@H](CCCC)[NH2+][C@H]1C[C@@](C)(N)C1 ZINC001246461367 1131511472 /nfs/dbraw/zinc/51/14/72/1131511472.db2.gz PHXQJXMMKQJEDU-OAGGEKHMSA-N 1 3 254.462 3.985 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NCCC[C@H]2CC2(Cl)Cl)c2ccccc21 ZINC000844926067 1131608146 /nfs/dbraw/zinc/60/81/46/1131608146.db2.gz UBFNMKWFEPWGNY-ZLKJLUDKSA-N 1 3 299.245 3.695 20 0 CHADHO C[C@@H]1CC[N@@H+]([C@@H]2CCCC3(CCCCC3)C2)C[C@H]1CN ZINC001246553801 1131612719 /nfs/dbraw/zinc/61/27/19/1131612719.db2.gz UYYHFKDVZLCTJU-BRWVUGGUSA-N 1 3 278.484 3.796 20 0 CHADHO C[C@@H]1CC[N@H+]([C@@H]2CCCC3(CCCCC3)C2)C[C@H]1CN ZINC001246553801 1131612721 /nfs/dbraw/zinc/61/27/21/1131612721.db2.gz UYYHFKDVZLCTJU-BRWVUGGUSA-N 1 3 278.484 3.796 20 0 CHADHO CCCC[C@@H](CC(C)C)[N@@H+]1CCC(F)(F)[C@@H](CN)C1 ZINC001246555780 1131617558 /nfs/dbraw/zinc/61/75/58/1131617558.db2.gz HUJUTRVSUNMIPV-KBPBESRZSA-N 1 3 276.415 3.507 20 0 CHADHO CCCC[C@@H](CC(C)C)[N@H+]1CCC(F)(F)[C@@H](CN)C1 ZINC001246555780 1131617560 /nfs/dbraw/zinc/61/75/60/1131617560.db2.gz HUJUTRVSUNMIPV-KBPBESRZSA-N 1 3 276.415 3.507 20 0 CHADHO CCCCC(CCCC)[N@@H+]1CCC[C@H](CN)[C@@H]1C ZINC001246567284 1131635139 /nfs/dbraw/zinc/63/51/39/1131635139.db2.gz WXGKGZGIHYSACY-LSDHHAIUSA-N 1 3 254.462 3.795 20 0 CHADHO CCCCC(CCCC)[N@H+]1CCC[C@H](CN)[C@@H]1C ZINC001246567284 1131635141 /nfs/dbraw/zinc/63/51/41/1131635141.db2.gz WXGKGZGIHYSACY-LSDHHAIUSA-N 1 3 254.462 3.795 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@@H+]2CCC[C@](C)(F)CC2)CCN1 ZINC001246570882 1131646081 /nfs/dbraw/zinc/64/60/81/1131646081.db2.gz TZGZRIRJORJPKR-OAGGEKHMSA-N 1 3 270.436 3.511 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@](C)(F)CC2)CCN1 ZINC001246570882 1131646082 /nfs/dbraw/zinc/64/60/82/1131646082.db2.gz TZGZRIRJORJPKR-OAGGEKHMSA-N 1 3 270.436 3.511 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]C2CCN(C(C)(C)C)CC2)c(C)n1 ZINC000772950169 1131721396 /nfs/dbraw/zinc/72/13/96/1131721396.db2.gz GCQSUPQSYHXDKJ-HNNXBMFYSA-N 1 3 289.467 3.612 20 0 CHADHO CCCCCC(CCCCC)[N@@H+]1CCC2(CNC2)C1 ZINC001246631908 1131742078 /nfs/dbraw/zinc/74/20/78/1131742078.db2.gz UHIZZXCYXZXROQ-UHFFFAOYSA-N 1 3 266.473 3.811 20 0 CHADHO CCCCCC(CCCCC)[N@H+]1CCC2(CNC2)C1 ZINC001246631908 1131742087 /nfs/dbraw/zinc/74/20/87/1131742087.db2.gz UHIZZXCYXZXROQ-UHFFFAOYSA-N 1 3 266.473 3.811 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[N@@H+]1C[C@@H](CF)[C@H](C2(N)CC2)C1 ZINC001246687056 1131781408 /nfs/dbraw/zinc/78/14/08/1131781408.db2.gz CXOZSLRDWOYION-CAOSSQGBSA-N 1 3 284.463 3.600 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[N@H+]1C[C@@H](CF)[C@H](C2(N)CC2)C1 ZINC001246687056 1131781413 /nfs/dbraw/zinc/78/14/13/1131781413.db2.gz CXOZSLRDWOYION-CAOSSQGBSA-N 1 3 284.463 3.600 20 0 CHADHO CCCC[C@@H]1C[C@@H]([NH+]2CCC(C(C)C)CC2)CCN1 ZINC001246843485 1131789133 /nfs/dbraw/zinc/78/91/33/1131789133.db2.gz CSMFLXZXOGCQNT-SJORKVTESA-N 1 3 266.473 3.665 20 0 CHADHO C[C@@H]1[C@@H]([NH3+])CCCN1[C@H]1CCCC2(CCCCC2)C1 ZINC001246940568 1131825988 /nfs/dbraw/zinc/82/59/88/1131825988.db2.gz WWFJSSCGCIQVPS-PMPSAXMXSA-N 1 3 264.457 3.691 20 0 CHADHO CCCCN(C)CCC[NH2+][C@@H]1CCc2c(C)cccc2C1 ZINC001171549747 1132051431 /nfs/dbraw/zinc/05/14/31/1132051431.db2.gz FLIWVZIRBXHNJL-GOSISDBHSA-N 1 3 288.479 3.564 20 0 CHADHO C[C@H]1C[N@@H+](C2CC(C)(C)N(C)C(C)(C)C2)CCC1(F)F ZINC001171631517 1132061613 /nfs/dbraw/zinc/06/16/13/1132061613.db2.gz KJSASOULOHIOBK-LBPRGKRZSA-N 1 3 288.426 3.615 20 0 CHADHO C[C@H]1C[N@H+](C2CC(C)(C)N(C)C(C)(C)C2)CCC1(F)F ZINC001171631517 1132061619 /nfs/dbraw/zinc/06/16/19/1132061619.db2.gz KJSASOULOHIOBK-LBPRGKRZSA-N 1 3 288.426 3.615 20 0 CHADHO C[C@H]1CN(C2CC(C)(C)[NH+](C)C(C)(C)C2)CCC1(F)F ZINC001171631517 1132061627 /nfs/dbraw/zinc/06/16/27/1132061627.db2.gz KJSASOULOHIOBK-LBPRGKRZSA-N 1 3 288.426 3.615 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@H]2CCCC23CCC3)CC1(C)C ZINC001171629199 1132062129 /nfs/dbraw/zinc/06/21/29/1132062129.db2.gz PHBCKNIAKUZDKC-HNNXBMFYSA-N 1 3 278.484 3.950 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@@H]2CCc3ccccc32)CC1(C)C ZINC001171619492 1132065760 /nfs/dbraw/zinc/06/57/60/1132065760.db2.gz MSXZHGCXBAYRQT-QGZVFWFLSA-N 1 3 286.463 3.915 20 0 CHADHO C[C@H]([NH2+]C1CC(C)(C)N(C)C(C)(C)C1)c1cccc(N)c1 ZINC001171623949 1132066892 /nfs/dbraw/zinc/06/68/92/1132066892.db2.gz JRCHKIJYANHKAK-ZDUSSCGKSA-N 1 3 289.467 3.571 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@H]2CCCC(F)(F)C2)CC1(C)C ZINC001171623009 1132067824 /nfs/dbraw/zinc/06/78/24/1132067824.db2.gz GMGMYCKKAPVXHZ-LBPRGKRZSA-N 1 3 288.426 3.805 20 0 CHADHO Cc1cc(C)c(CN[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c(C)c1 ZINC001172101898 1132123385 /nfs/dbraw/zinc/12/33/85/1132123385.db2.gz ICILBGVJABUHNG-BCDXTJNWSA-N 1 3 286.463 3.717 20 0 CHADHO Cc1cc(C)c(CN[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c(C)c1 ZINC001172101898 1132123389 /nfs/dbraw/zinc/12/33/89/1132123389.db2.gz ICILBGVJABUHNG-BCDXTJNWSA-N 1 3 286.463 3.717 20 0 CHADHO Cc1cccc([C@H](C)N[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC001172100223 1132125905 /nfs/dbraw/zinc/12/59/05/1132125905.db2.gz BIYNADVETDPSBW-OWLYRPNTSA-N 1 3 272.436 3.661 20 0 CHADHO Cc1cccc([C@H](C)N[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC001172100223 1132125907 /nfs/dbraw/zinc/12/59/07/1132125907.db2.gz BIYNADVETDPSBW-OWLYRPNTSA-N 1 3 272.436 3.661 20 0 CHADHO C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H](NCc1cccc(C3CC3)c1)C2 ZINC001172107788 1132129068 /nfs/dbraw/zinc/12/90/68/1132129068.db2.gz CGPJBUIZAJUDRR-REPLKXPHSA-N 1 3 284.447 3.669 20 0 CHADHO C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H](NCc1cccc(C3CC3)c1)C2 ZINC001172107788 1132129074 /nfs/dbraw/zinc/12/90/74/1132129074.db2.gz CGPJBUIZAJUDRR-REPLKXPHSA-N 1 3 284.447 3.669 20 0 CHADHO CCC[C@@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccncc1 ZINC001172113603 1132133486 /nfs/dbraw/zinc/13/34/86/1132133486.db2.gz DSRNFHWLIDSUEK-ZJPYXAASSA-N 1 3 287.451 3.528 20 0 CHADHO CCC[C@@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccncc1 ZINC001172113603 1132133489 /nfs/dbraw/zinc/13/34/89/1132133489.db2.gz DSRNFHWLIDSUEK-ZJPYXAASSA-N 1 3 287.451 3.528 20 0 CHADHO CC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2C)c1ccc(C)o1 ZINC001172112419 1132133976 /nfs/dbraw/zinc/13/39/76/1132133976.db2.gz WDAWGHBRUBQGEU-QKPAOTATSA-N 1 3 276.424 3.644 20 0 CHADHO Cc1cc([C@@H](C)N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)ccc1F ZINC001172119445 1132134481 /nfs/dbraw/zinc/13/44/81/1132134481.db2.gz ZVYNTILIBMFXSH-DZUCGIPZSA-N 1 3 290.426 3.800 20 0 CHADHO Cc1cc([C@@H](C)N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)ccc1F ZINC001172119445 1132134485 /nfs/dbraw/zinc/13/44/85/1132134485.db2.gz ZVYNTILIBMFXSH-DZUCGIPZSA-N 1 3 290.426 3.800 20 0 CHADHO CN(Cc1cccc(Cl)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172122906 1132136433 /nfs/dbraw/zinc/13/64/33/1132136433.db2.gz VLHPFGUINVRHCQ-FVQHAEBGSA-N 1 3 292.854 3.787 20 0 CHADHO CN(Cc1cccc(Cl)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172122906 1132136435 /nfs/dbraw/zinc/13/64/35/1132136435.db2.gz VLHPFGUINVRHCQ-FVQHAEBGSA-N 1 3 292.854 3.787 20 0 CHADHO CC[C@H](C)OCC[C@@H](C)[N@H+](CCCN)C1CCCCC1 ZINC001172315211 1132156004 /nfs/dbraw/zinc/15/60/04/1132156004.db2.gz GFSZWDPFJGCECY-CVEARBPZSA-N 1 3 284.488 3.564 20 0 CHADHO CC[C@H](C)OCC[C@@H](C)[N@@H+](CCCN)C1CCCCC1 ZINC001172315211 1132156005 /nfs/dbraw/zinc/15/60/05/1132156005.db2.gz GFSZWDPFJGCECY-CVEARBPZSA-N 1 3 284.488 3.564 20 0 CHADHO CC[C@@H](CC(C)C)N1CCC([NH+](CC)CC)CC1 ZINC001172408489 1132198645 /nfs/dbraw/zinc/19/86/45/1132198645.db2.gz VAQRWVGJOQPVOM-HNNXBMFYSA-N 1 3 254.462 3.617 20 0 CHADHO CC[C@@H](CC(C)C)[NH+]1CCC(N(CC)CC)CC1 ZINC001172408489 1132198647 /nfs/dbraw/zinc/19/86/47/1132198647.db2.gz VAQRWVGJOQPVOM-HNNXBMFYSA-N 1 3 254.462 3.617 20 0 CHADHO CCCOC1CCC([NH2+]CCCN2CCCC[C@@H]2C)CC1 ZINC001173092567 1132384322 /nfs/dbraw/zinc/38/43/22/1132384322.db2.gz VEDRAZPLUIRQLF-AOCRQIFASA-N 1 3 296.499 3.578 20 0 CHADHO CCC[C@@H]1CCCC[N@@H+]1Cc1cc2c[nH]ccc-2n1 ZINC001232014558 1132410264 /nfs/dbraw/zinc/41/02/64/1132410264.db2.gz QLOJLQGVSWOLRR-OAHLLOKOSA-N 1 3 257.381 3.718 20 0 CHADHO CCC[C@@H]1CCCC[N@H+]1Cc1cc2c[nH]ccc-2n1 ZINC001232014558 1132410268 /nfs/dbraw/zinc/41/02/68/1132410268.db2.gz QLOJLQGVSWOLRR-OAHLLOKOSA-N 1 3 257.381 3.718 20 0 CHADHO C[C@H]1CC[C@H]([N@H+](C)Cc2cc3cnccc3[nH]2)CC1 ZINC001232018968 1132412993 /nfs/dbraw/zinc/41/29/93/1132412993.db2.gz UJDJFOISNDHSQG-NNUKFRKNSA-N 1 3 257.381 3.573 20 0 CHADHO C[C@H]1CC[C@H]([N@@H+](C)Cc2cc3cnccc3[nH]2)CC1 ZINC001232018968 1132412997 /nfs/dbraw/zinc/41/29/97/1132412997.db2.gz UJDJFOISNDHSQG-NNUKFRKNSA-N 1 3 257.381 3.573 20 0 CHADHO C[C@@H](CN)C[NH2+][C@@H](C)CC(c1ccccc1)c1ccccc1 ZINC001173209968 1132416868 /nfs/dbraw/zinc/41/68/68/1132416868.db2.gz HRULUHCAPBBVPF-IRXDYDNUSA-N 1 3 296.458 3.782 20 0 CHADHO CCCC[C@H](CC(C)C)[NH2+]CC[C@@H]1CCCN1C ZINC001173248764 1132418483 /nfs/dbraw/zinc/41/84/83/1132418483.db2.gz FYNWSYBACGNXFS-CVEARBPZSA-N 1 3 254.462 3.665 20 0 CHADHO CCCCC[N@H+](C)Cc1cc(F)cc(CN(C)C)c1 ZINC001232143284 1132427939 /nfs/dbraw/zinc/42/79/39/1132427939.db2.gz AMSDUDJAHTZUOU-UHFFFAOYSA-N 1 3 266.404 3.509 20 0 CHADHO CCCCC[N@@H+](C)Cc1cc(F)cc(CN(C)C)c1 ZINC001232143284 1132427945 /nfs/dbraw/zinc/42/79/45/1132427945.db2.gz AMSDUDJAHTZUOU-UHFFFAOYSA-N 1 3 266.404 3.509 20 0 CHADHO CCC[N@H+](Cc1cc(F)cc(CN(C)C)c1)[C@@H](C)CC ZINC001232143465 1132428669 /nfs/dbraw/zinc/42/86/69/1132428669.db2.gz FFPNKGAHHSFNRW-AWEZNQCLSA-N 1 3 280.431 3.898 20 0 CHADHO CCC[N@@H+](Cc1cc(F)cc(CN(C)C)c1)[C@@H](C)CC ZINC001232143465 1132428672 /nfs/dbraw/zinc/42/86/72/1132428672.db2.gz FFPNKGAHHSFNRW-AWEZNQCLSA-N 1 3 280.431 3.898 20 0 CHADHO CCC(CC)N1CCC([NH2+][C@H]2CC[C@@H](CC)C2)CC1 ZINC001173270182 1132434985 /nfs/dbraw/zinc/43/49/85/1132434985.db2.gz BAZOCPQWCXWKLU-ZBFHGGJFSA-N 1 3 266.473 3.808 20 0 CHADHO Cc1cnccc1Nc1ccc(CC[NH+]2CCCCC2)cc1 ZINC001174539028 1132900206 /nfs/dbraw/zinc/90/02/06/1132900206.db2.gz YKMJSUKOZPJCLI-UHFFFAOYSA-N 1 3 295.430 3.584 20 0 CHADHO Cc1nc2ccc(Nc3ccc([C@@H]4CC[NH2+]C4)cc3)cc2[nH]1 ZINC001159776258 1132908021 /nfs/dbraw/zinc/90/80/21/1132908021.db2.gz CSBMSSKLPNGCAK-CQSZACIVSA-N 1 3 292.386 3.692 20 0 CHADHO CCC[NH+]1C[C@H]2CN(Cc3cccc4ccccc43)C[C@@H]2C1 ZINC001203989074 1133395563 /nfs/dbraw/zinc/39/55/63/1133395563.db2.gz SAVLQXYVRLAOEG-OALUTQOASA-N 1 3 294.442 3.613 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1cccs1 ZINC001204015420 1133400020 /nfs/dbraw/zinc/40/00/20/1133400020.db2.gz AVKROKPBBIPTNB-LSDHHAIUSA-N 1 3 278.465 3.587 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1cccs1 ZINC001204015420 1133400022 /nfs/dbraw/zinc/40/00/22/1133400022.db2.gz AVKROKPBBIPTNB-LSDHHAIUSA-N 1 3 278.465 3.587 20 0 CHADHO Cc1ccc(CN2CCCC[C@H]2C[C@@H]2CCC[N@H+]2C)cc1 ZINC001204174590 1133415069 /nfs/dbraw/zinc/41/50/69/1133415069.db2.gz YLBKMACTAUGNBK-OALUTQOASA-N 1 3 286.463 3.834 20 0 CHADHO Cc1ccc(CN2CCCC[C@H]2C[C@@H]2CCC[N@@H+]2C)cc1 ZINC001204174590 1133415072 /nfs/dbraw/zinc/41/50/72/1133415072.db2.gz YLBKMACTAUGNBK-OALUTQOASA-N 1 3 286.463 3.834 20 0 CHADHO Cc1ccc(C[N@H+]2CCCC[C@H]2C[C@@H]2CCCN2C)cc1 ZINC001204174590 1133415074 /nfs/dbraw/zinc/41/50/74/1133415074.db2.gz YLBKMACTAUGNBK-OALUTQOASA-N 1 3 286.463 3.834 20 0 CHADHO Cc1ccc(C[N@@H+]2CCCC[C@H]2C[C@@H]2CCCN2C)cc1 ZINC001204174590 1133415079 /nfs/dbraw/zinc/41/50/79/1133415079.db2.gz YLBKMACTAUGNBK-OALUTQOASA-N 1 3 286.463 3.834 20 0 CHADHO CC[NH+]1CCC(CC2CCN(Cc3ccoc3)CC2)CC1 ZINC001204244594 1133424481 /nfs/dbraw/zinc/42/44/81/1133424481.db2.gz MLUYMAIWCDVCJI-UHFFFAOYSA-N 1 3 290.451 3.614 20 0 CHADHO CC(C)(C)N(CC[C@@H]1CCCC[NH2+]1)Cc1ccccc1 ZINC001204604463 1133466295 /nfs/dbraw/zinc/46/62/95/1133466295.db2.gz PWJMDQNGOSKLSU-KRWDZBQOSA-N 1 3 274.452 3.819 20 0 CHADHO C[NH2+]C[C@@H]1CCCN(Cc2c(C)ccc3ccccc32)C1 ZINC001205009588 1133517141 /nfs/dbraw/zinc/51/71/41/1133517141.db2.gz YCVLFYLUUVNHNT-INIZCTEOSA-N 1 3 282.431 3.580 20 0 CHADHO C[NH2+]C[C@H]1CCCN(Cc2c(C)sc3ccccc32)C1 ZINC001205009245 1133517286 /nfs/dbraw/zinc/51/72/86/1133517286.db2.gz KGVFCVFUIJSEGI-CQSZACIVSA-N 1 3 288.460 3.641 20 0 CHADHO [NH3+][C@@H]1CCCN(Cc2ccc(-c3ccc(F)cc3)cc2)CC1 ZINC001205102620 1133530040 /nfs/dbraw/zinc/53/00/40/1133530040.db2.gz URTRJSUCYMNABP-LJQANCHMSA-N 1 3 298.405 3.806 20 0 CHADHO CC(C)(C)c1ccc(CN2CCC[C@](C)([NH3+])CC2)cc1 ZINC001205264329 1133551663 /nfs/dbraw/zinc/55/16/63/1133551663.db2.gz KNPCEEOGUJUVNQ-SFHVURJKSA-N 1 3 274.452 3.687 20 0 CHADHO CCCC[NH+]1CCC(N(C)Cc2cccc3[nH]ccc32)CC1 ZINC001205304382 1133556696 /nfs/dbraw/zinc/55/66/96/1133556696.db2.gz BCNHBQCLBLVNRH-UHFFFAOYSA-N 1 3 299.462 3.864 20 0 CHADHO Cc1ccc2ccccc2c1C[N@H+]1CC[C@@H](C)[C@@H](CN)C1 ZINC001205305951 1133558382 /nfs/dbraw/zinc/55/83/82/1133558382.db2.gz USISBSITRAFKHO-PBHICJAKSA-N 1 3 282.431 3.565 20 0 CHADHO Cc1ccc2ccccc2c1C[N@@H+]1CC[C@@H](C)[C@@H](CN)C1 ZINC001205305951 1133558385 /nfs/dbraw/zinc/55/83/85/1133558385.db2.gz USISBSITRAFKHO-PBHICJAKSA-N 1 3 282.431 3.565 20 0 CHADHO Cc1cc(F)cc(CN2CC[C@H](C)[C@@H](C[NH3+])CC2)c1Cl ZINC001205654552 1133599972 /nfs/dbraw/zinc/59/99/72/1133599972.db2.gz XFADOIHNWFZTNI-WCQYABFASA-N 1 3 298.833 3.594 20 0 CHADHO CCSc1ccccc1CN1CCCC[C@](C)(C[NH3+])C1 ZINC001206580505 1133722245 /nfs/dbraw/zinc/72/22/45/1133722245.db2.gz DCCMLXIVUZCBHD-QGZVFWFLSA-N 1 3 292.492 3.750 20 0 CHADHO FC1CC[NH+](C2CCN(CCC3CCCCC3)CC2)CC1 ZINC001207262643 1133784039 /nfs/dbraw/zinc/78/40/39/1133784039.db2.gz PKGINPAGRDIJRI-UHFFFAOYSA-N 1 3 296.474 3.855 20 0 CHADHO CC[C@H]1c2ccccc2CCN1CC(C)(C)C[NH+](C)C ZINC001207287819 1133788816 /nfs/dbraw/zinc/78/88/16/1133788816.db2.gz GMPVJYFVMBSKSF-KRWDZBQOSA-N 1 3 274.452 3.584 20 0 CHADHO CN(C)CC(C)(C)C[NH+]1CCC(c2ccccc2F)CC1 ZINC001207285882 1133789174 /nfs/dbraw/zinc/78/91/74/1133789174.db2.gz PNSOGISAELGCFZ-UHFFFAOYSA-N 1 3 292.442 3.593 20 0 CHADHO C[C@@H](CCN1CCC([NH+]2CCC2)CC1)CC(C)(C)C ZINC001208663399 1133924122 /nfs/dbraw/zinc/92/41/22/1133924122.db2.gz JXGNDLQQSVGAEJ-HNNXBMFYSA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@@H+]1CCC[C@@]12CCCNC2 ZINC001222232517 1135211368 /nfs/dbraw/zinc/21/13/68/1135211368.db2.gz VVAFFQJRHOLYCZ-QZTJIDSGSA-N 1 3 278.484 3.977 20 0 CHADHO c1ccc(CCCCC[N@@H+]2CCC[C@]23CCCNC3)cc1 ZINC001222237372 1135212636 /nfs/dbraw/zinc/21/26/36/1135212636.db2.gz HFXAPTURTQILEI-IBGZPJMESA-N 1 3 286.463 3.617 20 0 CHADHO c1ccc(CCCCC[N@H+]2CCC[C@]23CCCNC3)cc1 ZINC001222237372 1135212639 /nfs/dbraw/zinc/21/26/39/1135212639.db2.gz HFXAPTURTQILEI-IBGZPJMESA-N 1 3 286.463 3.617 20 0 CHADHO CC1(CN2CCC3(CCCC[NH2+]3)CC2)CCCCC1 ZINC001222287344 1135218223 /nfs/dbraw/zinc/21/82/23/1135218223.db2.gz HLPKTGHBTCMMLI-UHFFFAOYSA-N 1 3 264.457 3.565 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@@H+]1CC[C@@]2(C1)CCCCN2 ZINC001222421720 1135239518 /nfs/dbraw/zinc/23/95/18/1135239518.db2.gz OYTLDTBPVZUVCA-DLBZAZTESA-N 1 3 264.457 3.587 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@H+]1CC[C@@]2(C1)CCCCN2 ZINC001222421720 1135239523 /nfs/dbraw/zinc/23/95/23/1135239523.db2.gz OYTLDTBPVZUVCA-DLBZAZTESA-N 1 3 264.457 3.587 20 0 CHADHO c1ccc(-c2cccc(CN3CC[C@H]4C[NH2+]CC[C@H]43)c2)cc1 ZINC001222620419 1135256567 /nfs/dbraw/zinc/25/65/67/1135256567.db2.gz RJIQQKZBGMBSED-VQTJNVASSA-N 1 3 292.426 3.537 20 0 CHADHO c1ccc(-c2cccc(C[N@@H+]3CC[C@H]4CNCC[C@H]43)c2)cc1 ZINC001222620419 1135256572 /nfs/dbraw/zinc/25/65/72/1135256572.db2.gz RJIQQKZBGMBSED-VQTJNVASSA-N 1 3 292.426 3.537 20 0 CHADHO c1ccc(-c2cccc(C[N@H+]3CC[C@H]4CNCC[C@H]43)c2)cc1 ZINC001222620419 1135256575 /nfs/dbraw/zinc/25/65/75/1135256575.db2.gz RJIQQKZBGMBSED-VQTJNVASSA-N 1 3 292.426 3.537 20 0 CHADHO CCC(C)(C)c1ccc(CN2CC[C@H]3C[NH2+]CC[C@H]32)cc1 ZINC001222619969 1135256606 /nfs/dbraw/zinc/25/66/06/1135256606.db2.gz BXHQEFXNQFIKRA-FUHWJXTLSA-N 1 3 286.463 3.558 20 0 CHADHO CC[C@H](N[C@H]1CCC[C@H]([NH+](C)C)C1)c1cccc(C)c1 ZINC000353525784 529671015 /nfs/dbraw/zinc/67/10/15/529671015.db2.gz ZEWIBWPEGSGPNQ-BZSNNMDCSA-N 1 3 274.452 3.909 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)c1cccc(C)c1 ZINC000353525784 529671017 /nfs/dbraw/zinc/67/10/17/529671017.db2.gz ZEWIBWPEGSGPNQ-BZSNNMDCSA-N 1 3 274.452 3.909 20 0 CHADHO CCC[C@H](NCc1ccc(C[NH3+])cc1)c1ccccc1 ZINC000574159376 334997099 /nfs/dbraw/zinc/99/70/99/334997099.db2.gz NEPOALBEYWGFJK-SFHVURJKSA-N 1 3 268.404 3.776 20 0 CHADHO COc1cccc([C@H](C)NCc2ccc(C[NH+](C)C)cc2)c1 ZINC000171129806 335056243 /nfs/dbraw/zinc/05/62/43/335056243.db2.gz IQHRLVNSWQRGEP-HNNXBMFYSA-N 1 3 298.430 3.608 20 0 CHADHO CSC1(C[NH2+][C@@H](C)c2sccc2C)CCN(C)CC1 ZINC000353606345 533511570 /nfs/dbraw/zinc/51/15/70/533511570.db2.gz DSJDEODCKNUNAK-ZDUSSCGKSA-N 1 3 298.521 3.535 20 0 CHADHO C[N@H+](CCCN[C@@H]1CCc2ccccc21)Cc1ccccc1 ZINC000020827445 171273978 /nfs/dbraw/zinc/27/39/78/171273978.db2.gz LFZPLXNZMQWMDU-HXUWFJFHSA-N 1 3 294.442 3.786 20 0 CHADHO C[N@@H+](CCCN[C@@H]1CCc2ccccc21)Cc1ccccc1 ZINC000020827445 171273980 /nfs/dbraw/zinc/27/39/80/171273980.db2.gz LFZPLXNZMQWMDU-HXUWFJFHSA-N 1 3 294.442 3.786 20 0 CHADHO CCN(CC)CCC[NH2+][C@H]1C[C@H](C)CC(C)(C)C1 ZINC000021009378 171285784 /nfs/dbraw/zinc/28/57/84/171285784.db2.gz BHFCHRYQDUYFIO-GJZGRUSLSA-N 1 3 254.462 3.523 20 0 CHADHO CC(C)CC(CC(C)C)[NH2+]CCCN1CCCC1 ZINC000021044519 171294149 /nfs/dbraw/zinc/29/41/49/171294149.db2.gz LSZGHUZUGIALBI-UHFFFAOYSA-N 1 3 254.462 3.523 20 0 CHADHO C[C@H]1CN(Cc2cccc(-c3ccccc3)c2)CC[C@@H]1[NH3+] ZINC000347058572 226008385 /nfs/dbraw/zinc/00/83/85/226008385.db2.gz WRDJPWPKNGNSAB-KXBFYZLASA-N 1 3 280.415 3.523 20 0 CHADHO C[C@H]([NH3+])[C@H]1CCCN(Cc2cccc(-c3ccccc3)c2)C1 ZINC000347045665 226026671 /nfs/dbraw/zinc/02/66/71/226026671.db2.gz NVFQACYZBBMNPR-JXFKEZNVSA-N 1 3 294.442 3.913 20 0 CHADHO Cc1cccc2c1ncc(C)c2NCC(C)(C)[NH+](C)C ZINC000302566847 227866043 /nfs/dbraw/zinc/86/60/43/227866043.db2.gz OYJCOZSTOUFTBB-UHFFFAOYSA-N 1 3 271.408 3.604 20 0 CHADHO CCc1ccc([C@H](CC)NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000322973139 260112496 /nfs/dbraw/zinc/11/24/96/260112496.db2.gz YZOONMLALYTORT-IPQPSQTFSA-N 1 3 286.463 3.915 20 0 CHADHO CCc1ccc([C@H](CC)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000322973139 260112498 /nfs/dbraw/zinc/11/24/98/260112498.db2.gz YZOONMLALYTORT-IPQPSQTFSA-N 1 3 286.463 3.915 20 0 CHADHO CCc1ccc([C@@H](CC)NC[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000037648977 260115614 /nfs/dbraw/zinc/11/56/14/260115614.db2.gz VWTAWAUVHPHEBN-QFBILLFUSA-N 1 3 286.463 3.774 20 0 CHADHO CCc1ccc([C@@H](CC)NC[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000037648977 260115616 /nfs/dbraw/zinc/11/56/16/260115616.db2.gz VWTAWAUVHPHEBN-QFBILLFUSA-N 1 3 286.463 3.774 20 0 CHADHO CCc1ccc([C@@H](CC)NC[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000037648979 260115683 /nfs/dbraw/zinc/11/56/83/260115683.db2.gz VWTAWAUVHPHEBN-VQIMIIECSA-N 1 3 286.463 3.774 20 0 CHADHO CCc1ccc([C@@H](CC)NC[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000037648979 260115684 /nfs/dbraw/zinc/11/56/84/260115684.db2.gz VWTAWAUVHPHEBN-VQIMIIECSA-N 1 3 286.463 3.774 20 0 CHADHO CC1(C)CCC([NH2+]C2CCN(c3ccncc3)CC2)CC1 ZINC000079676775 260177064 /nfs/dbraw/zinc/17/70/64/260177064.db2.gz INMZZJMONFGVBT-UHFFFAOYSA-N 1 3 287.451 3.609 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCc2c1cccc2F)CN1CCCCC1 ZINC000211628093 260307661 /nfs/dbraw/zinc/30/76/61/260307661.db2.gz DKVXLPJLJZCKDC-RDTXWAMCSA-N 1 3 290.426 3.525 20 0 CHADHO FC(F)c1ccc(CN2CCC([C@@H]3CCC[NH2+]3)CC2)cc1 ZINC000131520842 260403740 /nfs/dbraw/zinc/40/37/40/260403740.db2.gz DVRNCMFUGBXIBQ-INIZCTEOSA-N 1 3 294.389 3.588 20 0 CHADHO Cc1ccc([C@H](C)NC2CC[NH+](C(C)C)CC2)c(C)c1 ZINC000020189232 262233156 /nfs/dbraw/zinc/23/31/56/262233156.db2.gz NVLPNQNFNNIYLR-INIZCTEOSA-N 1 3 274.452 3.827 20 0 CHADHO C[C@@H]1CC[C@@H]([NH2+]C2CC(C)(C)NC(C)(C)C2)[C@@H](C)C1 ZINC000221691156 262290961 /nfs/dbraw/zinc/29/09/61/262290961.db2.gz QVYHVTOYWVOMMG-VNHYZAJKSA-N 1 3 266.473 3.710 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCCCC1)c1ccc(Cl)cc1 ZINC000021014551 262373831 /nfs/dbraw/zinc/37/38/31/262373831.db2.gz IVIVTXYQQIXQBS-CQSZACIVSA-N 1 3 280.843 3.867 20 0 CHADHO [NH3+][C@@H]1CCC[C@H]2CN(Cc3ccc(-c4ccccc4)o3)C[C@H]21 ZINC000414671227 263029567 /nfs/dbraw/zinc/02/95/67/263029567.db2.gz NLEQZFIRDKOCOD-CGTJXYLNSA-N 1 3 296.414 3.506 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CNCc2ccc(Cl)s2)cc1 ZINC000414801387 263051190 /nfs/dbraw/zinc/05/11/90/263051190.db2.gz ACVZYJNYSDQRNE-SNVBAGLBSA-N 1 3 280.824 3.711 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H]([NH2+][C@H]2CCCC[C@H]2CN)C1 ZINC000414803403 263051494 /nfs/dbraw/zinc/05/14/94/263051494.db2.gz NUSNOUACSVVXGH-WNHJNPCNSA-N 1 3 286.463 3.604 20 0 CHADHO CC1(c2ccccc2)CCC([NH2+][C@H]2CCC[C@H]2CN)CC1 ZINC000414807065 263052158 /nfs/dbraw/zinc/05/21/58/263052158.db2.gz QRJLICGQVIIAEB-BARLLCKDSA-N 1 3 286.463 3.604 20 0 CHADHO CCC([NH3+])(CC)CN[C@@H]1CCC[C@H]1c1ccc(F)cc1 ZINC000414813864 263053259 /nfs/dbraw/zinc/05/32/59/263053259.db2.gz URHDBDUTEDCLAO-JKSUJKDBSA-N 1 3 278.415 3.569 20 0 CHADHO CCC([NH3+])(CC)CN[C@@H](C)CC(C)(C)c1ccccc1 ZINC000414815870 263053950 /nfs/dbraw/zinc/05/39/50/263053950.db2.gz YPEQXEYTNRIGLQ-HNNXBMFYSA-N 1 3 276.468 3.850 20 0 CHADHO Clc1ccc([C@@H]2CCC[C@H]2[NH2+]C[C@@H]2CCCNC2)cc1 ZINC000414822780 263055232 /nfs/dbraw/zinc/05/52/32/263055232.db2.gz COPPJEVEVZPULR-XOKHGSTOSA-N 1 3 292.854 3.565 20 0 CHADHO C[C@@H]1C[C@@H](NC2C[C@H]3CC[C@@H](C2)[NH2+]3)C[C@@H](c2ccccc2)C1 ZINC000414822926 263055493 /nfs/dbraw/zinc/05/54/93/263055493.db2.gz CZTJCCGBIZRVLN-LADDQWPMSA-N 1 3 298.474 3.831 20 0 CHADHO Fc1cc(-c2ccccc2)ccc1CNCC[C@H]1CC[NH2+]C1 ZINC000414832258 263056598 /nfs/dbraw/zinc/05/65/98/263056598.db2.gz OGMZPBHINWCHKR-OAHLLOKOSA-N 1 3 298.405 3.582 20 0 CHADHO C[C@@H](Cc1ccc(Cl)cc1)NCC1([NH3+])CCCCC1 ZINC000414847022 263063340 /nfs/dbraw/zinc/06/33/40/263063340.db2.gz UJENCLYHJGINML-ZDUSSCGKSA-N 1 3 280.843 3.522 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2CCCNCC2)C[C@@H](c2ccccc2)C1 ZINC000414910701 263117252 /nfs/dbraw/zinc/11/72/52/263117252.db2.gz FXKIRCRTTZYGMD-WNHJNPCNSA-N 1 3 286.463 3.691 20 0 CHADHO CC1(c2ccccc2)CCC([NH2+][C@H]2CCCNCC2)CC1 ZINC000414919936 263124532 /nfs/dbraw/zinc/12/45/32/263124532.db2.gz WDOGYMNZHQABNI-VIQWUECVSA-N 1 3 286.463 3.619 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2c2ccccc2Cl)CCN1 ZINC000414946373 263155209 /nfs/dbraw/zinc/15/52/09/263155209.db2.gz JMBJDJNTWGAHOH-GKLJAUDBSA-N 1 3 292.854 3.706 20 0 CHADHO C[C@@H]1C[C@H](N[C@@H]2CCC[C@@H]2c2ccccc2Cl)CC[NH2+]1 ZINC000414946373 263155210 /nfs/dbraw/zinc/15/52/10/263155210.db2.gz JMBJDJNTWGAHOH-GKLJAUDBSA-N 1 3 292.854 3.706 20 0 CHADHO C[C@H]1CNCC[C@H]1[NH2+]CC1CCC(c2ccccc2)CC1 ZINC000414948423 263156334 /nfs/dbraw/zinc/15/63/34/263156334.db2.gz YDVMSHOMKZGEKX-NHFHULPWSA-N 1 3 286.463 3.548 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2CCc2ccccc2)CCN1 ZINC000414960697 263165999 /nfs/dbraw/zinc/16/59/99/263165999.db2.gz YHVXFMAVXMLDIP-QXCFHYIPSA-N 1 3 286.463 3.518 20 0 CHADHO Cc1ccccc1-c1cccc(C[NH2+][C@H]2CCNC[C@@H]2C)c1 ZINC000414966365 263169396 /nfs/dbraw/zinc/16/93/96/263169396.db2.gz WNYNWNJSMFKRQN-JXFKEZNVSA-N 1 3 294.442 3.750 20 0 CHADHO CC(C)(C)c1ccc(C[NH2+][C@H]2CCNCC2(C)C)s1 ZINC000414970123 263171460 /nfs/dbraw/zinc/17/14/60/263171460.db2.gz JZWGHSCRTXLVJL-ZDUSSCGKSA-N 1 3 280.481 3.523 20 0 CHADHO CC(C)CN1CCC[C@@H](C[NH2+][C@H](C2CC2)C2CCC2)C1 ZINC000453178869 263199256 /nfs/dbraw/zinc/19/92/56/263199256.db2.gz UFJZRCNPVNRYQE-YJBOKZPZSA-N 1 3 278.484 3.523 20 0 CHADHO C[C@@H](CCCC[NH3+])NCc1cc(Cl)ccc1Cl ZINC000415017487 263255643 /nfs/dbraw/zinc/25/56/43/263255643.db2.gz RZHDPBHVRSDPJM-JTQLQIEISA-N 1 3 275.223 3.601 20 0 CHADHO FC(F)c1ccc(CN2CCCC[C@@H]2[C@H]2CC[NH2+]C2)cc1 ZINC000415034771 263257213 /nfs/dbraw/zinc/25/72/13/263257213.db2.gz DBMGOTMTJCXNAY-JKSUJKDBSA-N 1 3 294.389 3.588 20 0 CHADHO Cc1cc(CN[C@@H](CCC[NH3+])c2ccccc2)ccc1F ZINC000415060366 263258601 /nfs/dbraw/zinc/25/86/01/263258601.db2.gz WMSCIHHFNDGXKE-SFHVURJKSA-N 1 3 286.394 3.704 20 0 CHADHO Cc1ccc(CN[C@H](CCC[NH3+])c2ccccc2)cc1F ZINC000415059624 263258617 /nfs/dbraw/zinc/25/86/17/263258617.db2.gz VDWGYJUHFBOZKK-GOSISDBHSA-N 1 3 286.394 3.704 20 0 CHADHO Cc1ccc(CN[C@@H](CCC[NH3+])c2ccccc2)cc1F ZINC000415059625 263258630 /nfs/dbraw/zinc/25/86/30/263258630.db2.gz VDWGYJUHFBOZKK-SFHVURJKSA-N 1 3 286.394 3.704 20 0 CHADHO Cc1cc(CN[C@H](CCC[NH3+])c2ccccc2)ccc1F ZINC000415060364 263258895 /nfs/dbraw/zinc/25/88/95/263258895.db2.gz WMSCIHHFNDGXKE-GOSISDBHSA-N 1 3 286.394 3.704 20 0 CHADHO Clc1ccc([C@H]2CCC[C@H]2[NH2+]CCCNC2CC2)cc1 ZINC000415064641 263259853 /nfs/dbraw/zinc/25/98/53/263259853.db2.gz DFSDOSIQBHRNAF-IAGOWNOFSA-N 1 3 292.854 3.708 20 0 CHADHO CC[C@@H]([NH2+]C1CCN(CC(C)C)CC1)c1cccc(F)c1 ZINC000187744062 263268099 /nfs/dbraw/zinc/26/80/99/263268099.db2.gz GQJRILYEMRYXAY-GOSISDBHSA-N 1 3 292.442 3.987 20 0 CHADHO CC(C)c1ccc2c(c1)[C@H](N[C@@H]1CC[N@H+](C)[C@H](C)C1)CC2 ZINC000187801656 263268626 /nfs/dbraw/zinc/26/86/26/263268626.db2.gz CEULMMXWUAALBF-LSBZLQRGSA-N 1 3 286.463 3.870 20 0 CHADHO CC(C)c1ccc2c(c1)[C@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)CC2 ZINC000187801656 263268627 /nfs/dbraw/zinc/26/86/27/263268627.db2.gz CEULMMXWUAALBF-LSBZLQRGSA-N 1 3 286.463 3.870 20 0 CHADHO Cc1ccccc1CN[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415094474 263272137 /nfs/dbraw/zinc/27/21/37/263272137.db2.gz XQDRYMQOCZPIJB-OALUTQOASA-N 1 3 280.415 3.578 20 0 CHADHO C[C@H](N[C@@H]1CCCC[C@H]1C[NH3+])c1ccc(Cl)s1 ZINC000251500387 264278728 /nfs/dbraw/zinc/27/87/28/264278728.db2.gz FTHRTAIJYPNNSH-GARJFASQSA-N 1 3 272.845 3.570 20 0 CHADHO CC(C)[C@H](N[C@H]1CCC[NH2+]CC1)c1ccc(Cl)cc1 ZINC000128998258 264312546 /nfs/dbraw/zinc/31/25/46/264312546.db2.gz AOBDKMZULPIMOG-HOTGVXAUSA-N 1 3 280.843 3.769 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000348240488 265147356 /nfs/dbraw/zinc/14/73/56/265147356.db2.gz IBIXIGBDIHYSNH-NEWSRXKRSA-N 1 3 286.463 3.500 20 0 CHADHO CCC[C@@H]([NH2+]CCCN1CCCC1)c1ccsc1 ZINC000191188501 265167217 /nfs/dbraw/zinc/16/72/17/265167217.db2.gz ASMNIANBSWJLIH-OAHLLOKOSA-N 1 3 266.454 3.665 20 0 CHADHO CCC[C@H]([NH2+]CCCN1CCCC1)c1ccsc1 ZINC000191188487 265167514 /nfs/dbraw/zinc/16/75/14/265167514.db2.gz ASMNIANBSWJLIH-HNNXBMFYSA-N 1 3 266.454 3.665 20 0 CHADHO CC(C)[NH2+]CCCN[C@H]1C[C@H](c2ccccc2)C1(C)C ZINC000580062377 327687154 /nfs/dbraw/zinc/68/71/54/327687154.db2.gz QCDASIZLFUVKQI-SJORKVTESA-N 1 3 274.452 3.546 20 0 CHADHO CC(C)Cc1ccc([C@H](C)[NH2+][C@H]2CCNC[C@H]2C)cc1 ZINC000261683803 328006143 /nfs/dbraw/zinc/00/61/43/328006143.db2.gz GZCPOIBJENGWCQ-VKJFTORMSA-N 1 3 274.452 3.534 20 0 CHADHO CC1CCN(CCC[NH2+][C@@H](c2ccccc2)C2CC2)CC1 ZINC000041075345 328026711 /nfs/dbraw/zinc/02/67/11/328026711.db2.gz LSVUXKJAWAUQPO-IBGZPJMESA-N 1 3 286.463 3.849 20 0 CHADHO C[C@H](CN[C@H](c1ccccc1)C1CC1)C[NH+]1CCCCC1 ZINC000041075780 328026744 /nfs/dbraw/zinc/02/67/44/328026744.db2.gz VTOQODKQPKJNRK-VQIMIIECSA-N 1 3 286.463 3.849 20 0 CHADHO C[C@H](C[NH2+][C@H](c1ccccc1)C1CC1)CN1CCCCC1 ZINC000041075780 328026745 /nfs/dbraw/zinc/02/67/45/328026745.db2.gz VTOQODKQPKJNRK-VQIMIIECSA-N 1 3 286.463 3.849 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+][C@H](c1ccccc1)C(C)(C)C ZINC000534019179 328032984 /nfs/dbraw/zinc/03/29/84/328032984.db2.gz LHIMOLRRRIFXSE-IAGOWNOFSA-N 1 3 274.452 3.848 20 0 CHADHO C[N@@H+]1CCC[C@@H]1CCN[C@H](c1ccccc1)C(C)(C)C ZINC000534019179 328032985 /nfs/dbraw/zinc/03/29/85/328032985.db2.gz LHIMOLRRRIFXSE-IAGOWNOFSA-N 1 3 274.452 3.848 20 0 CHADHO C[N@H+]1CCC[C@@H]1CCN[C@H](c1ccccc1)C(C)(C)C ZINC000534019179 328032986 /nfs/dbraw/zinc/03/29/86/328032986.db2.gz LHIMOLRRRIFXSE-IAGOWNOFSA-N 1 3 274.452 3.848 20 0 CHADHO CN1CCC[C@H]1CC[NH2+][C@@H](c1ccccc1)C(C)(C)C ZINC000534019180 328033029 /nfs/dbraw/zinc/03/30/29/328033029.db2.gz LHIMOLRRRIFXSE-IRXDYDNUSA-N 1 3 274.452 3.848 20 0 CHADHO C[N@@H+]1CCC[C@H]1CCN[C@@H](c1ccccc1)C(C)(C)C ZINC000534019180 328033030 /nfs/dbraw/zinc/03/30/30/328033030.db2.gz LHIMOLRRRIFXSE-IRXDYDNUSA-N 1 3 274.452 3.848 20 0 CHADHO C[N@H+]1CCC[C@H]1CCN[C@@H](c1ccccc1)C(C)(C)C ZINC000534019180 328033031 /nfs/dbraw/zinc/03/30/31/328033031.db2.gz LHIMOLRRRIFXSE-IRXDYDNUSA-N 1 3 274.452 3.848 20 0 CHADHO CCC([NH3+])(CC)CN[C@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC000414802885 328231518 /nfs/dbraw/zinc/23/15/18/328231518.db2.gz BYINDHPFDSKCMY-SJORKVTESA-N 1 3 274.452 3.738 20 0 CHADHO Cc1cccc([C@H](N[C@H]2CCC[NH2+]CC2)C(C)(C)C)c1 ZINC000415082804 328302556 /nfs/dbraw/zinc/30/25/56/328302556.db2.gz OVYWXPYBAFSJFY-IRXDYDNUSA-N 1 3 274.452 3.814 20 0 CHADHO C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1ccc(CN(C)C)cc1 ZINC000531944501 328323518 /nfs/dbraw/zinc/32/35/18/328323518.db2.gz XVQYUVTZQLQNGJ-HUUCEWRRSA-N 1 3 274.452 3.663 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000049553712 328371879 /nfs/dbraw/zinc/37/18/79/328371879.db2.gz FTBVPXWFXXJXPH-HUUCEWRRSA-N 1 3 274.452 3.556 20 0 CHADHO CN1CCC[C@H]2C[N@H+](Cc3cccc4ccccc43)CC[C@@H]21 ZINC000531988604 328382730 /nfs/dbraw/zinc/38/27/30/328382730.db2.gz LLLHCOHOUZQLPK-ICSRJNTNSA-N 1 3 294.442 3.756 20 0 CHADHO CN1CCC[C@H]2C[N@@H+](Cc3cccc4ccccc43)CC[C@@H]21 ZINC000531988604 328382731 /nfs/dbraw/zinc/38/27/31/328382731.db2.gz LLLHCOHOUZQLPK-ICSRJNTNSA-N 1 3 294.442 3.756 20 0 CHADHO C[N@@H+]1CCC[C@H]2CN(Cc3cccc4ccccc43)CC[C@@H]21 ZINC000531988604 328382733 /nfs/dbraw/zinc/38/27/33/328382733.db2.gz LLLHCOHOUZQLPK-ICSRJNTNSA-N 1 3 294.442 3.756 20 0 CHADHO C[N@H+]1CCC[C@H]2CN(Cc3cccc4ccccc43)CC[C@@H]21 ZINC000531988604 328382734 /nfs/dbraw/zinc/38/27/34/328382734.db2.gz LLLHCOHOUZQLPK-ICSRJNTNSA-N 1 3 294.442 3.756 20 0 CHADHO CC(C)(C[NH2+][C@@H]1CCC[C@H](N)C1)Cc1cccc(Cl)c1 ZINC000568249314 326980521 /nfs/dbraw/zinc/98/05/21/326980521.db2.gz NLPFKLZMDNSYIY-JKSUJKDBSA-N 1 3 294.870 3.768 20 0 CHADHO CC[NH+](CC)CC1CCN(Cc2ccc(F)c(C)c2)CC1 ZINC000506863945 332781320 /nfs/dbraw/zinc/78/13/20/332781320.db2.gz YQRVXVJLPOOBCR-UHFFFAOYSA-N 1 3 292.442 3.688 20 0 CHADHO CC[N@H+](CCCN1CCCC1)Cc1cc(C)sc1C ZINC000558422022 327093155 /nfs/dbraw/zinc/09/31/55/327093155.db2.gz GZOAQJJSEZXFGF-UHFFFAOYSA-N 1 3 280.481 3.673 20 0 CHADHO CC[N@@H+](CCCN1CCCC1)Cc1cc(C)sc1C ZINC000558422022 327093156 /nfs/dbraw/zinc/09/31/56/327093156.db2.gz GZOAQJJSEZXFGF-UHFFFAOYSA-N 1 3 280.481 3.673 20 0 CHADHO CCN(C[C@H]1CCC[NH2+]C1)[C@H](C)c1cc2ccccc2o1 ZINC000261594991 327141074 /nfs/dbraw/zinc/14/10/74/327141074.db2.gz CBARAJXPEPIUGS-CABCVRRESA-N 1 3 286.419 3.815 20 0 CHADHO CC[NH+](CC)C[C@@H]1CCN([C@H]2C=CCCCCC2)C1 ZINC000559105654 327141261 /nfs/dbraw/zinc/14/12/61/327141261.db2.gz GGYKWJKXNQANIX-IRXDYDNUSA-N 1 3 264.457 3.539 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+]([C@H]2C=CCCCCC2)C1 ZINC000559105654 327141262 /nfs/dbraw/zinc/14/12/62/327141262.db2.gz GGYKWJKXNQANIX-IRXDYDNUSA-N 1 3 264.457 3.539 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+]([C@H]2C=CCCCCC2)C1 ZINC000559105654 327141263 /nfs/dbraw/zinc/14/12/63/327141263.db2.gz GGYKWJKXNQANIX-IRXDYDNUSA-N 1 3 264.457 3.539 20 0 CHADHO CO[C@@H](C)[C@@H](C)NC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449340187 327164241 /nfs/dbraw/zinc/16/42/41/327164241.db2.gz VNXOQSAKAAWGON-CABCVRRESA-N 1 3 298.515 3.679 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@H]2Cc2ccccc2)C1 ZINC000564470828 327197006 /nfs/dbraw/zinc/19/70/06/327197006.db2.gz PWDGWJCFCVVAQU-ZSYWTGECSA-N 1 3 286.463 3.647 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@@H]1N[C@@H](c1cccs1)C1CCCC1 ZINC000261600063 327258409 /nfs/dbraw/zinc/25/84/09/327258409.db2.gz PTJFUDZUCOZZGI-IVMMDQJWSA-N 1 3 278.465 3.567 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H](c1cccs1)C1CCCC1 ZINC000261600063 327258411 /nfs/dbraw/zinc/25/84/11/327258411.db2.gz PTJFUDZUCOZZGI-IVMMDQJWSA-N 1 3 278.465 3.567 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN([C@H]2C=CCCCCC2)C1 ZINC000559796365 327262074 /nfs/dbraw/zinc/26/20/74/327262074.db2.gz SGAFGVHDJFABLI-SJORKVTESA-N 1 3 264.457 3.539 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN([C@H]2C=CCCCCC2)C1 ZINC000559796365 327262075 /nfs/dbraw/zinc/26/20/75/327262075.db2.gz SGAFGVHDJFABLI-SJORKVTESA-N 1 3 264.457 3.539 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+]([C@H]2C=CCCCCC2)C1 ZINC000559796365 327262076 /nfs/dbraw/zinc/26/20/76/327262076.db2.gz SGAFGVHDJFABLI-SJORKVTESA-N 1 3 264.457 3.539 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+]([C@H]2C=CCCCCC2)C1 ZINC000559796365 327262077 /nfs/dbraw/zinc/26/20/77/327262077.db2.gz SGAFGVHDJFABLI-SJORKVTESA-N 1 3 264.457 3.539 20 0 CHADHO CC1(C)CC[C@H]1[NH2+]CC1CCN(Cc2cccs2)CC1 ZINC000560245691 327293096 /nfs/dbraw/zinc/29/30/96/327293096.db2.gz HUCQHLDWPCAHLH-MRXNPFEDSA-N 1 3 292.492 3.738 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](CC(C(C)C)C(C)C)C1 ZINC000560258255 327294842 /nfs/dbraw/zinc/29/48/42/327294842.db2.gz VFFVHLXFUPRPNX-INIZCTEOSA-N 1 3 268.489 3.578 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](CC(C(C)C)C(C)C)C1 ZINC000560258255 327294844 /nfs/dbraw/zinc/29/48/44/327294844.db2.gz VFFVHLXFUPRPNX-INIZCTEOSA-N 1 3 268.489 3.578 20 0 CHADHO C[NH+]1CCC([C@H]2CCN(Cc3cc(Cl)cs3)C2)CC1 ZINC000583348769 327313444 /nfs/dbraw/zinc/31/34/44/327313444.db2.gz DRGYNBVIRHELHS-ZDUSSCGKSA-N 1 3 298.883 3.565 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCCC[C@H]2c2ccccc2)C1 ZINC000566482115 327392858 /nfs/dbraw/zinc/39/28/58/327392858.db2.gz MMDGCUFEHJFTMF-RDGPPVDQSA-N 1 3 286.463 3.820 20 0 CHADHO CCCOc1ccc([C@H](C)NCc2ccc(C[NH3+])cc2)cc1 ZINC000569847140 327551506 /nfs/dbraw/zinc/55/15/06/327551506.db2.gz CSDGMDUQLRCWEW-HNNXBMFYSA-N 1 3 298.430 3.785 20 0 CHADHO C[C@@H]1C[C@H](N[C@H]2CCCc3c(Cl)cccc32)CC[N@@H+]1C ZINC000542662803 329068342 /nfs/dbraw/zinc/06/83/42/329068342.db2.gz LLAXWOFCNRUDHE-XNJGSVPQSA-N 1 3 292.854 3.790 20 0 CHADHO C[C@@H]1C[C@H](N[C@H]2CCCc3c(Cl)cccc32)CC[N@H+]1C ZINC000542662803 329068344 /nfs/dbraw/zinc/06/83/44/329068344.db2.gz LLAXWOFCNRUDHE-XNJGSVPQSA-N 1 3 292.854 3.790 20 0 CHADHO Cc1c2ccccc2oc1C[NH2+][C@@H]1CCN(C)[C@@H]2CCC[C@H]21 ZINC000583709258 329093571 /nfs/dbraw/zinc/09/35/71/329093571.db2.gz SNPMIYVZCOHQNF-GVDBMIGSSA-N 1 3 298.430 3.704 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@@H](c2ccccc2)C1)[C@@H]1CCCNC1 ZINC000582600294 329113993 /nfs/dbraw/zinc/11/39/93/329113993.db2.gz OMVWTSBWRDODDV-JCHJZTRSSA-N 1 3 286.463 3.691 20 0 CHADHO CC[C@@H]1CCC[C@H](C[NH2+]C[C@@H]2CCN(C(C)C)C2)C1 ZINC000394505772 329124358 /nfs/dbraw/zinc/12/43/58/329124358.db2.gz GIRWECUMJCKKRF-IKGGRYGDSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)(C[NH2+][C@H]1CC[C@@H]1C(C)(C)C)CN1CCCC1 ZINC000571868517 329925115 /nfs/dbraw/zinc/92/51/15/329925115.db2.gz OCLRANONQXBTQB-GJZGRUSLSA-N 1 3 266.473 3.523 20 0 CHADHO CCc1ccc([C@@H](CC)NCc2ccc(C[NH3+])cc2)cc1 ZINC000572121663 329946347 /nfs/dbraw/zinc/94/63/47/329946347.db2.gz HZEFVQNIZKCLOW-LJQANCHMSA-N 1 3 282.431 3.949 20 0 CHADHO CN(C)Cc1ccc(C[NH2+]C2CC(C(C)(C)C)C2)cc1 ZINC000572182767 329952801 /nfs/dbraw/zinc/95/28/01/329952801.db2.gz NXQJSDLCBHNSSQ-UHFFFAOYSA-N 1 3 274.452 3.663 20 0 CHADHO CC[C@H](CN[C@H]1C[C@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000422710951 330151405 /nfs/dbraw/zinc/15/14/05/330151405.db2.gz GNNUPHJZSCMJTA-CCKFTAQKSA-N 1 3 280.415 3.915 20 0 CHADHO CC[C@H](CN[C@H]1C[C@@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000422710961 330151425 /nfs/dbraw/zinc/15/14/25/330151425.db2.gz GNNUPHJZSCMJTA-ZMYBRWDISA-N 1 3 280.415 3.915 20 0 CHADHO CC[C@H](Cc1ccccc1)N[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422713776 330151760 /nfs/dbraw/zinc/15/17/60/330151760.db2.gz QCPGGXJQSHCQPV-ATZDWAIDSA-N 1 3 280.415 3.742 20 0 CHADHO CC[C@@H](Cc1ccccc1)[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000422717954 330152036 /nfs/dbraw/zinc/15/20/36/330152036.db2.gz WGBZGMZKWQLLKI-PBHICJAKSA-N 1 3 297.446 3.521 20 0 CHADHO Cc1ccccc1[C@@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)C(C)C ZINC000422718933 330152112 /nfs/dbraw/zinc/15/21/12/330152112.db2.gz YCNYQTLYVCFQHN-ONYGOOLBSA-N 1 3 272.436 3.565 20 0 CHADHO C[C@H](N[C@H]1CCC[NH2+]CC1)c1ccc2ccccc2c1 ZINC000422746646 330152970 /nfs/dbraw/zinc/15/29/70/330152970.db2.gz NZXLYESHWBGTIB-KSSFIOAISA-N 1 3 268.404 3.633 20 0 CHADHO Cc1ccc([C@@H](C)C[NH2+][C@H](C)c2ccc(CN)nc2C)cc1 ZINC000422760668 330153948 /nfs/dbraw/zinc/15/39/48/330153948.db2.gz LCDDUKBESJDTNY-LSDHHAIUSA-N 1 3 297.446 3.611 20 0 CHADHO CC(C)(CN[C@H]1C[C@@H]([NH3+])c2ccccc21)c1cccc(F)c1 ZINC000422762878 330154055 /nfs/dbraw/zinc/15/40/55/330154055.db2.gz OOTURZMRTPIGCN-MSOLQXFVSA-N 1 3 298.405 3.838 20 0 CHADHO Cc1ccc(CN[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC000422763954 330154079 /nfs/dbraw/zinc/15/40/79/330154079.db2.gz PDDBSMNDUCUHGR-MOPGFXCFSA-N 1 3 280.415 3.578 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](C)c1cccc2ccccc21 ZINC000422773210 330154334 /nfs/dbraw/zinc/15/43/34/330154334.db2.gz ZLVZVVPNXHAEAV-IHRRRGAJSA-N 1 3 256.393 3.616 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC[C@H]1CCC[C@@H](C)C1 ZINC000422744495 330155326 /nfs/dbraw/zinc/15/53/26/330155326.db2.gz KCKOCKHLYNVJBM-IJEWVQPXSA-N 1 3 289.467 3.716 20 0 CHADHO [NH3+][C@@H]1C[C@H](N[C@@H]2CC[C@H]3CCC[C@H]3C2)c2ccccc21 ZINC000422795438 330155711 /nfs/dbraw/zinc/15/57/11/330155711.db2.gz VOOJUKYMQNXDAZ-FOOXYVKASA-N 1 3 270.420 3.690 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H](C)c1ccc(-c2cccnc2)cc1 ZINC000422831987 330156860 /nfs/dbraw/zinc/15/68/60/330156860.db2.gz XDLISNUFIKMQEG-RRFJBIMHSA-N 1 3 283.419 3.525 20 0 CHADHO Fc1cccc([C@H](N[C@@H]2CCC[NH2+]CC2)C2CCCC2)c1 ZINC000422879351 330158779 /nfs/dbraw/zinc/15/87/79/330158779.db2.gz VETIXEKFLCLOBT-QZTJIDSGSA-N 1 3 290.426 3.789 20 0 CHADHO C[C@H]([NH3+])[C@H](Cc1ccccc1)N[C@H]1C[C@@H]1C1CCCCC1 ZINC000422917531 330160224 /nfs/dbraw/zinc/16/02/24/330160224.db2.gz GDBWDDZVPHVDBF-VLQPXKRTSA-N 1 3 286.463 3.503 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+]CC1(Cc2ccccc2)CCC1 ZINC000422927918 330160772 /nfs/dbraw/zinc/16/07/72/330160772.db2.gz HUOYCGNOWHAJRD-ROUUACIJSA-N 1 3 286.463 3.507 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C(CC(C)C)CC(C)C ZINC000422938320 330161540 /nfs/dbraw/zinc/16/15/40/330161540.db2.gz DQCFFQRYGBOWHI-HNNXBMFYSA-N 1 3 291.483 3.960 20 0 CHADHO Cc1ccccc1C1(CN[C@@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC000422901432 330162203 /nfs/dbraw/zinc/16/22/03/330162203.db2.gz KTRPITIBBBDHJZ-RTBURBONSA-N 1 3 292.426 3.761 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC000422989886 330162962 /nfs/dbraw/zinc/16/29/62/330162962.db2.gz MKTHQGBHYXQWJL-QEFXCSQDSA-N 1 3 274.452 3.602 20 0 CHADHO CC[C@H](CSc1ccc(C)c(C)c1)N[C@H](C)C[C@@H](C)[NH3+] ZINC000422998458 330163521 /nfs/dbraw/zinc/16/35/21/330163521.db2.gz CUJMENDVHPAKEA-BZUAXINKSA-N 1 3 294.508 3.890 20 0 CHADHO CC[C@H](CSc1ccc(C)c(C)c1)[NH2+][C@H](C)C[C@@H](C)N ZINC000422998458 330163522 /nfs/dbraw/zinc/16/35/22/330163522.db2.gz CUJMENDVHPAKEA-BZUAXINKSA-N 1 3 294.508 3.890 20 0 CHADHO [NH3+][C@H]1C[C@H](NC2(Cc3ccccc3)CCC2)c2ccccc21 ZINC000422956429 330164100 /nfs/dbraw/zinc/16/41/00/330164100.db2.gz LEPGZXWLVBGTLC-OALUTQOASA-N 1 3 292.426 3.886 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC(C)(C)C1CCCC1 ZINC000423007314 330165099 /nfs/dbraw/zinc/16/50/99/330165099.db2.gz XMLZOAPBYVMCPT-ZDUSSCGKSA-N 1 3 289.467 3.716 20 0 CHADHO CC(C)c1cccc(CN[C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)c1 ZINC000423056982 330167810 /nfs/dbraw/zinc/16/78/10/330167810.db2.gz YPEMSHDHBSKSRX-GBESFXJTSA-N 1 3 286.463 3.820 20 0 CHADHO NC[C@@H]1CCC[C@@H]1[NH2+]C1CCC2(CCCCC2)CC1 ZINC000423066511 330168245 /nfs/dbraw/zinc/16/82/45/330168245.db2.gz DXLOJGFJAFRUDQ-HOCLYGCPSA-N 1 3 264.457 3.597 20 0 CHADHO CC(C)[C@H]1C[C@@H](N[C@H]2CCC[NH2+]CC2)c2ccccc21 ZINC000423089784 330169002 /nfs/dbraw/zinc/16/90/02/330169002.db2.gz VYROMWUHMBVLGO-BMGDILEWSA-N 1 3 272.436 3.603 20 0 CHADHO CC(C)[C@H]1C[C@@H](N[C@H](C)C[C@@H](C)[NH3+])c2ccccc21 ZINC000423088329 330169242 /nfs/dbraw/zinc/16/92/42/330169242.db2.gz RMNTUERPGLUAFA-BQGCOEIASA-N 1 3 260.425 3.586 20 0 CHADHO CC(C)[C@H](C[NH2+][C@@H](C)C[C@H](C)N)c1ccc(Cl)cc1 ZINC000423099075 330170106 /nfs/dbraw/zinc/17/01/06/330170106.db2.gz AGAJPGMJBCBPHB-XEZPLFJOSA-N 1 3 282.859 3.795 20 0 CHADHO CC[C@H]1CC[C@H](N[C@@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC000423121635 330171018 /nfs/dbraw/zinc/17/10/18/330171018.db2.gz AXQCVHODRQQNKQ-BQGCOEIASA-N 1 3 258.409 3.690 20 0 CHADHO [NH3+][C@@H]1C[C@H](NC[C@@H]2CCCCC(F)(F)C2)c2ccccc21 ZINC000423128135 330171563 /nfs/dbraw/zinc/17/15/63/330171563.db2.gz KFLUDEXVDIGROG-WQVCFCJDSA-N 1 3 294.389 3.936 20 0 CHADHO C=Cc1ccc(CCN[C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000423133288 330171954 /nfs/dbraw/zinc/17/19/54/330171954.db2.gz CRWUBTXESCFLQH-XUVXKRRUSA-N 1 3 298.474 3.773 20 0 CHADHO C=Cc1ccc(CC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCCN2)cc1 ZINC000423133288 330171955 /nfs/dbraw/zinc/17/19/55/330171955.db2.gz CRWUBTXESCFLQH-XUVXKRRUSA-N 1 3 298.474 3.773 20 0 CHADHO CC(C)(C)C1CC([NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCCN2)C1 ZINC000423140403 330172351 /nfs/dbraw/zinc/17/23/51/330172351.db2.gz YCHITEXXISTQEL-SWHNLWLKSA-N 1 3 278.484 3.712 20 0 CHADHO C[C@@H]1CCNCC[C@@H]1[NH2+]C[C@H]1CCC[C@H]1c1ccccc1 ZINC000423159377 330173779 /nfs/dbraw/zinc/17/37/79/330173779.db2.gz OYIDKJAXJVIXFE-YSHGAJCASA-N 1 3 286.463 3.548 20 0 CHADHO Clc1cccc([C@@H]2CCC[C@H]([NH2+]C3CCNCC3)C2)c1 ZINC000423171156 330174600 /nfs/dbraw/zinc/17/46/00/330174600.db2.gz ZNNQMAWIYKTMJY-PBHICJAKSA-N 1 3 292.854 3.708 20 0 CHADHO [NH3+]C1(CN[C@@H]2CC[C@@H](c3ccccc3)C2)CCCCC1 ZINC000423175315 330174731 /nfs/dbraw/zinc/17/47/31/330174731.db2.gz DQNLMUVRCGYNDT-IAGOWNOFSA-N 1 3 272.436 3.574 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000423177689 330175121 /nfs/dbraw/zinc/17/51/21/330175121.db2.gz HMLKCMKILAOAHE-CAVOSLQRSA-N 1 3 280.843 3.692 20 0 CHADHO CC(C)[C@H](NCCC[NH3+])c1ccc(Cl)c(Cl)c1 ZINC000423182763 330175426 /nfs/dbraw/zinc/17/54/26/330175426.db2.gz HDGBDWARRRMYFF-ZDUSSCGKSA-N 1 3 275.223 3.629 20 0 CHADHO NCCC[NH2+][C@H]1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000423195484 330176260 /nfs/dbraw/zinc/17/62/60/330176260.db2.gz SQQJHGKPVNJSOD-HOTGVXAUSA-N 1 3 280.843 3.695 20 0 CHADHO Clc1ccc([C@@H](CC2CC2)NC[C@@H]2CCC[NH2+]C2)cc1 ZINC000423205613 330177116 /nfs/dbraw/zinc/17/71/16/330177116.db2.gz FEUJEEPQEKUUCF-RHSMWYFYSA-N 1 3 292.854 3.770 20 0 CHADHO C[C@H](NC[C@@H]1CCC[NH2+]C1)c1cc2ccccc2s1 ZINC000423217453 330178688 /nfs/dbraw/zinc/17/86/88/330178688.db2.gz UFSAIZFZFCULQD-QWHCGFSZSA-N 1 3 274.433 3.552 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCNC1)c1cc2ccccc2s1 ZINC000423217453 330178689 /nfs/dbraw/zinc/17/86/89/330178689.db2.gz UFSAIZFZFCULQD-QWHCGFSZSA-N 1 3 274.433 3.552 20 0 CHADHO CCCc1ccc([C@H](C)N[C@H](C)[C@@H]2CCC[NH2+]C2)cc1 ZINC000423217826 330179108 /nfs/dbraw/zinc/17/91/08/330179108.db2.gz QOLZODTYEFCQNU-HDMKZQKVSA-N 1 3 274.452 3.678 20 0 CHADHO Clc1ccc2c(c1)[C@@H](NC[C@@H]1CCC[NH2+]C1)CCCC2 ZINC000423221221 330179425 /nfs/dbraw/zinc/17/94/25/330179425.db2.gz ZJPOBPFXRJRIER-DYVFJYSZSA-N 1 3 292.854 3.697 20 0 CHADHO C[C@@H]([NH2+]CC[C@H](C)N)C(c1ccccc1)c1ccccc1 ZINC000423225465 330179943 /nfs/dbraw/zinc/17/99/43/330179943.db2.gz MWWDZSDMCQKJCJ-JKSUJKDBSA-N 1 3 282.431 3.534 20 0 CHADHO C[C@@H](NCC[C@H](C)[NH3+])C(c1ccccc1)c1ccccc1 ZINC000423225465 330179945 /nfs/dbraw/zinc/17/99/45/330179945.db2.gz MWWDZSDMCQKJCJ-JKSUJKDBSA-N 1 3 282.431 3.534 20 0 CHADHO C[C@H]([NH3+])CCN[C@@H](C)c1ccc(OCc2ccccc2)cc1 ZINC000423240882 330181699 /nfs/dbraw/zinc/18/16/99/330181699.db2.gz XPKZGVZETRELDC-HOTGVXAUSA-N 1 3 298.430 3.654 20 0 CHADHO Fc1ccc([C@H](NCC[C@@H]2CC[NH2+]C2)c2ccccc2)cc1 ZINC000423243019 330181973 /nfs/dbraw/zinc/18/19/73/330181973.db2.gz GBDLMWUVMAFVJI-HNAYVOBHSA-N 1 3 298.405 3.504 20 0 CHADHO C[C@H]([NH2+]CC(C)(C)N)c1ccc(-c2ccccc2)s1 ZINC000423287417 330186127 /nfs/dbraw/zinc/18/61/27/330186127.db2.gz MDSLAUXVSCGJER-LBPRGKRZSA-N 1 3 274.433 3.803 20 0 CHADHO Cc1ccc([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)s1 ZINC000423290528 330186939 /nfs/dbraw/zinc/18/69/39/330186939.db2.gz DINJSDCUVPLYOA-STQMWFEESA-N 1 3 274.433 3.927 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@H]2CCc3ccc(F)cc32)cc1 ZINC000423293808 330188133 /nfs/dbraw/zinc/18/81/33/330188133.db2.gz SCHGVZCEXGJJFH-SGTLLEGYSA-N 1 3 284.378 3.623 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@H]2CCCc3ccc(O)cc32)cc1 ZINC000423295168 330188399 /nfs/dbraw/zinc/18/83/99/330188399.db2.gz WHDIJLGFUAVOIL-DJJJIMSYSA-N 1 3 296.414 3.579 20 0 CHADHO Cc1ccc([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000423296586 330188454 /nfs/dbraw/zinc/18/84/54/330188454.db2.gz ZLZVMQFBOMZFHU-HUUCEWRRSA-N 1 3 268.404 3.866 20 0 CHADHO CCCC[C@@H](CN)[NH2+][C@H](C)c1cc2cccc(OC)c2o1 ZINC000423297042 330188726 /nfs/dbraw/zinc/18/87/26/330188726.db2.gz IMTROVPGDQJSPE-OCCSQVGLSA-N 1 3 290.407 3.610 20 0 CHADHO CC(C)[C@H](NC[C@@H](C)C[NH3+])c1ccc(C(F)(F)F)cc1 ZINC000423310613 330189538 /nfs/dbraw/zinc/18/95/38/330189538.db2.gz SCGLXJBMRFOUEP-FZMZJTMJSA-N 1 3 288.357 3.587 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H](N)C1CC1)c1ccc(Cl)c(Cl)c1 ZINC000423312263 330189562 /nfs/dbraw/zinc/18/95/62/330189562.db2.gz DBCHQZOMPMEGQW-ZIAGYGMSSA-N 1 3 287.234 3.771 20 0 CHADHO CC[C@@H]([NH2+]C[C@H](N)C1CC1)c1ccc2cc(OC)ccc2c1 ZINC000423322669 330190666 /nfs/dbraw/zinc/19/06/66/330190666.db2.gz OCYWLUSFEYXLJO-RBUKOAKNSA-N 1 3 298.430 3.626 20 0 CHADHO C[C@@H]([NH2+]CC1(N)CCC1)c1ccccc1C(C)(C)C ZINC000423323404 330190758 /nfs/dbraw/zinc/19/07/58/330190758.db2.gz JJHIRQAMMVICSC-CYBMUJFWSA-N 1 3 260.425 3.516 20 0 CHADHO Clc1ccc([C@@H]2CCC[C@H](NC[C@@H]3CC[NH2+]C3)C2)cc1 ZINC000423328498 330190879 /nfs/dbraw/zinc/19/08/79/330190879.db2.gz DSJPOHXDZQHUDP-UNEWFSDZSA-N 1 3 292.854 3.565 20 0 CHADHO C[C@H]([NH2+]CC1(N)CCC1)c1ccc(-c2ccccc2)s1 ZINC000423327920 330191046 /nfs/dbraw/zinc/19/10/46/330191046.db2.gz NHLZPTBNDCHULC-ZDUSSCGKSA-N 1 3 286.444 3.947 20 0 CHADHO Cc1cccc([C@@H](NCCCC[NH3+])c2cccc(F)c2)c1 ZINC000423334951 330191610 /nfs/dbraw/zinc/19/16/10/330191610.db2.gz SXUMMNBXKYUEHF-GOSISDBHSA-N 1 3 286.394 3.552 20 0 CHADHO C[C@H](NCC1=CC[NH2+]CC1)c1cc(Cl)cc(Cl)c1 ZINC000423344488 330192253 /nfs/dbraw/zinc/19/22/53/330192253.db2.gz MXFGKFFNTCZJHS-JTQLQIEISA-N 1 3 285.218 3.564 20 0 CHADHO CCC[C@H]([NH2+][C@H]1CCC[C@@H](N)C1)C1CCCCC1 ZINC000423363723 330194244 /nfs/dbraw/zinc/19/42/44/330194244.db2.gz AGKKMXZKUSUKNC-PMPSAXMXSA-N 1 3 252.446 3.595 20 0 CHADHO CCOc1ccc([C@H](C)NCc2ccc3c(c2)C[NH2+]C3)cc1 ZINC000423364347 330194448 /nfs/dbraw/zinc/19/44/48/330194448.db2.gz VPHGOMWDNBIPDH-AWEZNQCLSA-N 1 3 296.414 3.539 20 0 CHADHO c1ccc([C@@H]2CCC[C@@H]2[NH2+]Cc2ccc3c(c2)CNC3)cc1 ZINC000423366028 330194534 /nfs/dbraw/zinc/19/45/34/330194534.db2.gz BLORQOFQQRKUQP-PMACEKPBSA-N 1 3 292.426 3.716 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@H](CC2CC2)c2ccc(Cl)cc2)CCN1 ZINC000423367825 330194590 /nfs/dbraw/zinc/19/45/90/330194590.db2.gz AQPVXLBDOJAQDM-OAUYIBNBSA-N 1 3 292.854 3.911 20 0 CHADHO CC(C)Cc1cccc([C@H](C)[NH2+][C@@H]2CCN[C@@H](C)C2)c1 ZINC000423372979 330195281 /nfs/dbraw/zinc/19/52/81/330195281.db2.gz GMUPCYMBSPODKK-RLFYNMQTSA-N 1 3 274.452 3.676 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@@H]1CCN[C@H](C)C1 ZINC000423371410 330195286 /nfs/dbraw/zinc/19/52/86/330195286.db2.gz FLUWRUMQWXQEBX-LBTNJELSSA-N 1 3 297.446 3.584 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CCN[C@H](C)C1)[C@H](C)c1ccc(Cl)cc1 ZINC000423371321 330195407 /nfs/dbraw/zinc/19/54/07/330195407.db2.gz FJBKJGVCICUFBS-OQMKEHIESA-N 1 3 280.843 3.562 20 0 CHADHO C[C@@H](N[C@@H]1CC[NH2+][C@H](C)C1)[C@H](C)c1ccc(Cl)cc1 ZINC000423371321 330195408 /nfs/dbraw/zinc/19/54/08/330195408.db2.gz FJBKJGVCICUFBS-OQMKEHIESA-N 1 3 280.843 3.562 20 0 CHADHO CC(C)Cc1cccc([C@H](C)[NH2+][C@H]2CCN[C@H](C)C2)c1 ZINC000423372981 330195423 /nfs/dbraw/zinc/19/54/23/330195423.db2.gz GMUPCYMBSPODKK-VKJFTORMSA-N 1 3 274.452 3.676 20 0 CHADHO C[C@H](N[C@H]1CC[NH2+]C[C@H]1C)c1ccc(F)c2ccccc21 ZINC000423397655 330196031 /nfs/dbraw/zinc/19/60/31/330196031.db2.gz OIIUREAGEDVUPK-VBHSOAQHSA-N 1 3 286.394 3.628 20 0 CHADHO C[C@H]([NH2+][C@H]1CCNC[C@H]1C)c1ccc(F)c2ccccc21 ZINC000423397655 330196032 /nfs/dbraw/zinc/19/60/32/330196032.db2.gz OIIUREAGEDVUPK-VBHSOAQHSA-N 1 3 286.394 3.628 20 0 CHADHO Cc1cccc([C@@H](C)NCc2ccc3c(c2)C[NH2+]C3)c1C ZINC000423400441 330196044 /nfs/dbraw/zinc/19/60/44/330196044.db2.gz VJANOBDEWHQQCT-OAHLLOKOSA-N 1 3 280.415 3.757 20 0 CHADHO CC(C)C[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1cccs1 ZINC000423403707 330196224 /nfs/dbraw/zinc/19/62/24/330196224.db2.gz XDXBOAFLSMLQQA-IHRRRGAJSA-N 1 3 266.454 3.695 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H](c2ccc(F)cc2)C2CCCC2)CCN1 ZINC000423401770 330196230 /nfs/dbraw/zinc/19/62/30/330196230.db2.gz XIPOHZGCHYUAKK-XWIAVFTESA-N 1 3 290.426 3.787 20 0 CHADHO CC(C)C[C@H](N[C@@H]1CCC[C@@H]([NH3+])C1)c1cccs1 ZINC000423403709 330196261 /nfs/dbraw/zinc/19/62/61/330196261.db2.gz XDXBOAFLSMLQQA-MCIONIFRSA-N 1 3 266.454 3.695 20 0 CHADHO C[C@@H]1C[C@H]([NH2+]C2CCC3(CCCCC3)CC2)CCN1 ZINC000423385767 330199553 /nfs/dbraw/zinc/19/95/53/330199553.db2.gz RBEFRMXVSPCQOP-GDBMZVCRSA-N 1 3 264.457 3.610 20 0 CHADHO CC(C)[C@@H](CSc1ccccc1)[NH2+][C@@H]1CCN[C@H](C)C1 ZINC000423384659 330199579 /nfs/dbraw/zinc/19/95/79/330199579.db2.gz QGSJHDWNUBFZAA-BFYDXBDKSA-N 1 3 292.492 3.533 20 0 CHADHO CC(C)[C@@H](CSc1ccccc1)N[C@@H]1CC[NH2+][C@H](C)C1 ZINC000423384659 330199581 /nfs/dbraw/zinc/19/95/81/330199581.db2.gz QGSJHDWNUBFZAA-BFYDXBDKSA-N 1 3 292.492 3.533 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@@H]1CCCCc2ccc(Cl)cc21 ZINC000423384465 330199642 /nfs/dbraw/zinc/19/96/42/330199642.db2.gz FZRUGERXVRNKBJ-CSMYWGQOSA-N 1 3 292.854 3.695 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@@H]1N[C@@H](c1ccc(F)cc1)C1CCCC1 ZINC000423391290 330200371 /nfs/dbraw/zinc/20/03/71/330200371.db2.gz KSBOUJTXOGFOBD-JEBQAFNWSA-N 1 3 290.426 3.645 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H](c1ccc(F)cc1)C1CCCC1 ZINC000423391290 330200372 /nfs/dbraw/zinc/20/03/72/330200372.db2.gz KSBOUJTXOGFOBD-JEBQAFNWSA-N 1 3 290.426 3.645 20 0 CHADHO CCCCOc1ccc([C@H](C)[NH2+][C@@H]2CCNC[C@@H]2C)cc1 ZINC000423392703 330200607 /nfs/dbraw/zinc/20/06/07/330200607.db2.gz LTMVCKVZZBXQKR-RLFYNMQTSA-N 1 3 290.451 3.514 20 0 CHADHO C[C@H](N)[C@H](C)[NH2+][C@@H](c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000423437090 330201428 /nfs/dbraw/zinc/20/14/28/330201428.db2.gz FWELDSOYEOEGOY-UINNMSKDSA-N 1 3 287.234 3.770 20 0 CHADHO CCC[C@H]([NH2+][C@@H](C)[C@H](C)N)c1ccc(Cl)cc1 ZINC000423454140 330203414 /nfs/dbraw/zinc/20/34/14/330203414.db2.gz YQSKOLCZQHUZHW-MJVIPROJSA-N 1 3 254.805 3.507 20 0 CHADHO CC[C@H](N)C[NH2+][C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423455767 330203543 /nfs/dbraw/zinc/20/35/43/330203543.db2.gz CUDCFYSZYOROPA-LSDHHAIUSA-N 1 3 266.816 3.508 20 0 CHADHO CC[C@@H]([NH3+])CN[C@@H](C)C(c1ccccc1)c1ccccc1 ZINC000423457424 330203728 /nfs/dbraw/zinc/20/37/28/330203728.db2.gz FQBQHDSRGPQIFC-MAUKXSAKSA-N 1 3 282.431 3.534 20 0 CHADHO CC[C@H](NCCC[C@@H]1CCC[NH2+]1)c1ccc(F)cc1F ZINC000423476192 330205743 /nfs/dbraw/zinc/20/57/43/330205743.db2.gz IOUKIFJHROYYSE-BBRMVZONSA-N 1 3 282.378 3.538 20 0 CHADHO CCC[C@@H]([NH2+]C[C@H](N)CC)c1ccc(Cl)cc1 ZINC000423486004 330206934 /nfs/dbraw/zinc/20/69/34/330206934.db2.gz ZJBMOBAWOMNXRT-ZIAGYGMSSA-N 1 3 254.805 3.508 20 0 CHADHO C[C@H](N[C@H](CCC[NH3+])c1ccccc1)c1cccc(O)c1 ZINC000423496458 330207921 /nfs/dbraw/zinc/20/79/21/330207921.db2.gz DXBPIBNUNNFKIN-KBXCAEBGSA-N 1 3 284.403 3.523 20 0 CHADHO C[C@H](N[C@@H](CCC[NH3+])c1ccccc1)c1ccccc1F ZINC000423505661 330208749 /nfs/dbraw/zinc/20/87/49/330208749.db2.gz ORIUBUMSTFAZTR-KSSFIOAISA-N 1 3 286.394 3.957 20 0 CHADHO C[C@@H](CC(C)(C)C)[NH2+]CC1(N)C2CC3CC(C2)CC1C3 ZINC000423527053 330210273 /nfs/dbraw/zinc/21/02/73/330210273.db2.gz LZCZITUWEVVHLG-UCRBLCQZSA-N 1 3 278.484 3.554 20 0 CHADHO CC1CC[NH+](Cc2ccc(CNCC3(F)CC3)cc2)CC1 ZINC000527223023 330237981 /nfs/dbraw/zinc/23/79/81/330237981.db2.gz JVXQTTAIMPHCIY-UHFFFAOYSA-N 1 3 290.426 3.510 20 0 CHADHO C[C@@H]([NH2+]C1CCN(CC2CCCC2)CC1)[C@@H]1C[C@H]1C1CC1 ZINC000527647297 330269202 /nfs/dbraw/zinc/26/92/02/330269202.db2.gz BCRGTOGBPPDTHM-CCKFTAQKSA-N 1 3 290.495 3.665 20 0 CHADHO CC(C)c1cccc([C@H](C)N[C@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC000527864596 330285477 /nfs/dbraw/zinc/28/54/77/330285477.db2.gz JLSOBHCONSWPNG-VKJFTORMSA-N 1 3 274.452 3.943 20 0 CHADHO CC(C)c1cccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@H](C)C2)c1 ZINC000527864596 330285478 /nfs/dbraw/zinc/28/54/78/330285478.db2.gz JLSOBHCONSWPNG-VKJFTORMSA-N 1 3 274.452 3.943 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](c2cccc(C)c2)C(C)C)C1 ZINC000527855134 330288766 /nfs/dbraw/zinc/28/87/66/330288766.db2.gz ZRGNHGFMXAGESC-SJLPKXTDSA-N 1 3 274.452 3.624 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H](c2cccc(C)c2)C(C)C)C1 ZINC000527855134 330288767 /nfs/dbraw/zinc/28/87/67/330288767.db2.gz ZRGNHGFMXAGESC-SJLPKXTDSA-N 1 3 274.452 3.624 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H](c2cccc(C)c2)C(C)C)C1 ZINC000527855134 330288768 /nfs/dbraw/zinc/28/87/68/330288768.db2.gz ZRGNHGFMXAGESC-SJLPKXTDSA-N 1 3 274.452 3.624 20 0 CHADHO CC[NH+](CC)CCCNC1CC(c2ccccc2C)C1 ZINC000036842397 330292578 /nfs/dbraw/zinc/29/25/78/330292578.db2.gz ZTEAJQGWQYPTPK-UHFFFAOYSA-N 1 3 274.452 3.563 20 0 CHADHO CCN(CC)CCC[NH2+]C1CC(c2ccccc2C)C1 ZINC000036842397 330292579 /nfs/dbraw/zinc/29/25/79/330292579.db2.gz ZTEAJQGWQYPTPK-UHFFFAOYSA-N 1 3 274.452 3.563 20 0 CHADHO CC[C@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccc(Cl)cc1 ZINC000044534523 330330090 /nfs/dbraw/zinc/33/00/90/330330090.db2.gz GLGNASSGKSZMHC-BBRMVZONSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1 ZINC000044534523 330330091 /nfs/dbraw/zinc/33/00/91/330330091.db2.gz GLGNASSGKSZMHC-BBRMVZONSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@@H]([NH2+][C@@H]1CCCC[C@H]1N)c1ccc(Cl)cc1 ZINC000424289219 330334320 /nfs/dbraw/zinc/33/43/20/330334320.db2.gz BQKLZBNIZNWLKQ-RBSFLKMASA-N 1 3 266.816 3.651 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)[N@@H+]1CC[C@@H]2[C@H](CCCN2C)C1 ZINC000445438170 330347861 /nfs/dbraw/zinc/34/78/61/330347861.db2.gz FCSCDFJSSWCHEI-CDHQVMDDSA-N 1 3 298.474 3.652 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)[N@H+]1CC[C@@H]2[C@H](CCCN2C)C1 ZINC000445438170 330347862 /nfs/dbraw/zinc/34/78/62/330347862.db2.gz FCSCDFJSSWCHEI-CDHQVMDDSA-N 1 3 298.474 3.652 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)N1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000445438170 330347863 /nfs/dbraw/zinc/34/78/63/330347863.db2.gz FCSCDFJSSWCHEI-CDHQVMDDSA-N 1 3 298.474 3.652 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000445438170 330347864 /nfs/dbraw/zinc/34/78/64/330347864.db2.gz FCSCDFJSSWCHEI-CDHQVMDDSA-N 1 3 298.474 3.652 20 0 CHADHO C1CC1[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCCN2)C1 ZINC000424370040 330348326 /nfs/dbraw/zinc/34/83/26/330348326.db2.gz DFRRQRIMFJSBGM-RHQZKXFESA-N 1 3 290.495 3.856 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1ccc(Cl)c(F)c1 ZINC000212707056 330367036 /nfs/dbraw/zinc/36/70/36/330367036.db2.gz VSHSALITIJWGSH-NWDGAFQWSA-N 1 3 296.817 3.614 20 0 CHADHO CC(C)=CCC[C@H](C)[NH2+]CCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000162848977 330650728 /nfs/dbraw/zinc/65/07/28/330650728.db2.gz KHQMYOCUKDKFKP-BZSNNMDCSA-N 1 3 296.499 3.600 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H]1CC[C@H](c2ccccc2)C1 ZINC000436276933 330672909 /nfs/dbraw/zinc/67/29/09/330672909.db2.gz VSONNHYLKDJVBV-ZWKOTPCHSA-N 1 3 274.452 3.644 20 0 CHADHO CCC[NH+]1CCC(CN[C@H](C)c2cc(C)oc2C)CC1 ZINC000447536191 330868656 /nfs/dbraw/zinc/86/86/56/330868656.db2.gz LOAVQROBGGKVND-CQSZACIVSA-N 1 3 278.440 3.669 20 0 CHADHO C[C@H](CC(C)(C)C)[NH2+]C1CCN(C2CCCC2)CC1 ZINC000449183681 330904455 /nfs/dbraw/zinc/90/44/55/330904455.db2.gz LEMZUNRHYZGXDF-CQSZACIVSA-N 1 3 266.473 3.808 20 0 CHADHO CN(C)Cc1cccc(C[NH2+][C@H]2CCCC23CCC3)c1 ZINC000449218847 330906987 /nfs/dbraw/zinc/90/69/87/330906987.db2.gz LJDQVAUGHANPOY-KRWDZBQOSA-N 1 3 272.436 3.561 20 0 CHADHO CN(C)Cc1cccc(C[NH2+][C@@H]2CCCC23CCC3)c1 ZINC000449218848 330907112 /nfs/dbraw/zinc/90/71/12/330907112.db2.gz LJDQVAUGHANPOY-QGZVFWFLSA-N 1 3 272.436 3.561 20 0 CHADHO CC/C=C/CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000453317463 331115698 /nfs/dbraw/zinc/11/56/98/331115698.db2.gz KSWKDQZITLHNKO-AHAITQMDSA-N 1 3 284.447 3.738 20 0 CHADHO CC/C=C/CN[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000453317463 331115699 /nfs/dbraw/zinc/11/56/99/331115699.db2.gz KSWKDQZITLHNKO-AHAITQMDSA-N 1 3 284.447 3.738 20 0 CHADHO C[C@@H]1CCCC[C@H]1N1CCC([NH2+][C@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000459779020 331300472 /nfs/dbraw/zinc/30/04/72/331300472.db2.gz WPRKKWGJXSZFOC-VKSUQKOCSA-N 1 3 290.495 3.808 20 0 CHADHO C[C@@H]1CCCC[C@@H]1N1CCC([NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000459779017 331300576 /nfs/dbraw/zinc/30/05/76/331300576.db2.gz WPRKKWGJXSZFOC-FDMITFGQSA-N 1 3 290.495 3.808 20 0 CHADHO C[C@H]1C[C@@H](NCc2ccc(C3CCCC3)cc2)CC[N@@H+]1C ZINC000462780438 331328752 /nfs/dbraw/zinc/32/87/52/331328752.db2.gz WJYPSCOHQAUVGD-KXBFYZLASA-N 1 3 286.463 3.917 20 0 CHADHO C[C@H]1C[C@@H](NCc2ccc(C3CCCC3)cc2)CC[N@H+]1C ZINC000462780438 331328753 /nfs/dbraw/zinc/32/87/53/331328753.db2.gz WJYPSCOHQAUVGD-KXBFYZLASA-N 1 3 286.463 3.917 20 0 CHADHO CCN1CC[C@@H](C[NH2+]Cc2ccc(C3CCCC3)cc2)C1 ZINC000462799864 331329599 /nfs/dbraw/zinc/32/95/99/331329599.db2.gz YTPUTBLTDVNIIE-KRWDZBQOSA-N 1 3 286.463 3.776 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@H]1C[C@@H](c2ccccc2)C1(C)C ZINC000463538154 331349275 /nfs/dbraw/zinc/34/92/75/331349275.db2.gz AAWJMBDVOPZSIN-ROUUACIJSA-N 1 3 288.479 3.889 20 0 CHADHO CC(C)[N@H+](C)CCCN[C@H]1C[C@@H](c2ccccc2)C1(C)C ZINC000463538154 331349276 /nfs/dbraw/zinc/34/92/76/331349276.db2.gz AAWJMBDVOPZSIN-ROUUACIJSA-N 1 3 288.479 3.889 20 0 CHADHO CC(C)[N@@H+](C)CCCN[C@H]1C[C@@H](c2ccccc2)C1(C)C ZINC000463538154 331349277 /nfs/dbraw/zinc/34/92/77/331349277.db2.gz AAWJMBDVOPZSIN-ROUUACIJSA-N 1 3 288.479 3.889 20 0 CHADHO C[C@@H]1CC[C@H](C[NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000475567562 331637846 /nfs/dbraw/zinc/63/78/46/331637846.db2.gz CZXPNOHPHAWIND-CVEARBPZSA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)C[NH+]1CCC(N[C@@H]2CS[C@H](C(C)(C)C)C2)CC1 ZINC000488429055 332007344 /nfs/dbraw/zinc/00/73/44/332007344.db2.gz IJQJISPOGAMWMU-HOTGVXAUSA-N 1 3 298.540 3.617 20 0 CHADHO CN(CCCc1cccc(F)c1)CC[C@@H]1CCCC[N@@H+]1C ZINC000490105330 332081560 /nfs/dbraw/zinc/08/15/60/332081560.db2.gz XWUXZWDKUBCPBE-SFHVURJKSA-N 1 3 292.442 3.565 20 0 CHADHO CN(CCCc1cccc(F)c1)CC[C@@H]1CCCC[N@H+]1C ZINC000490105330 332081561 /nfs/dbraw/zinc/08/15/61/332081561.db2.gz XWUXZWDKUBCPBE-SFHVURJKSA-N 1 3 292.442 3.565 20 0 CHADHO C[C@@H]1CCC[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000513074750 333002889 /nfs/dbraw/zinc/00/28/89/333002889.db2.gz JEZIIEMNWLYRLZ-NVXWUHKLSA-N 1 3 278.484 3.952 20 0 CHADHO C[C@@H]1CCC[N@H+](CCCCNc2ccnc3ccccc32)C1 ZINC000517653936 333104926 /nfs/dbraw/zinc/10/49/26/333104926.db2.gz NICKOCQYEFIQAO-MRXNPFEDSA-N 1 3 297.446 3.581 20 0 CHADHO C[C@@H]1CCC[N@@H+](CCCCNc2ccnc3ccccc32)C1 ZINC000517653936 333104928 /nfs/dbraw/zinc/10/49/28/333104928.db2.gz NICKOCQYEFIQAO-MRXNPFEDSA-N 1 3 297.446 3.581 20 0 CHADHO C[C@H]1CCC[N@H+](CCCCNc2ccnc3ccccc32)C1 ZINC000517653935 333104968 /nfs/dbraw/zinc/10/49/68/333104968.db2.gz NICKOCQYEFIQAO-INIZCTEOSA-N 1 3 297.446 3.581 20 0 CHADHO C[C@H]1CCC[N@@H+](CCCCNc2ccnc3ccccc32)C1 ZINC000517653935 333104970 /nfs/dbraw/zinc/10/49/70/333104970.db2.gz NICKOCQYEFIQAO-INIZCTEOSA-N 1 3 297.446 3.581 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC12CCCC2)[C@H]1CCCN(C2CCC2)C1 ZINC000189217537 333186262 /nfs/dbraw/zinc/18/62/62/333186262.db2.gz SOGJDBMKPTUXFA-XYJFISCASA-N 1 3 290.495 3.952 20 0 CHADHO C[C@@H]1CCCC[N@@H+]1CCCCNc1ccnc2ccccc21 ZINC000521935841 333224126 /nfs/dbraw/zinc/22/41/26/333224126.db2.gz HPCGHUFTLBFONJ-MRXNPFEDSA-N 1 3 297.446 3.723 20 0 CHADHO C[C@@H]1CCCC[N@H+]1CCCCNc1ccnc2ccccc21 ZINC000521935841 333224128 /nfs/dbraw/zinc/22/41/28/333224128.db2.gz HPCGHUFTLBFONJ-MRXNPFEDSA-N 1 3 297.446 3.723 20 0 CHADHO C[C@H](NCC1(C)CC[NH+](C)CC1)c1ccccc1Cl ZINC000227496968 333283672 /nfs/dbraw/zinc/28/36/72/333283672.db2.gz MQSRDCMZTFNPHV-ZDUSSCGKSA-N 1 3 280.843 3.723 20 0 CHADHO C[C@H](CCc1ccccc1)N[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227535449 333285328 /nfs/dbraw/zinc/28/53/28/333285328.db2.gz WURXXCRRAWZQEW-ZMYBRWDISA-N 1 3 280.415 3.742 20 0 CHADHO CC[C@@H]1CCC[C@H](N[C@@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000227541342 333285583 /nfs/dbraw/zinc/28/55/83/333285583.db2.gz FDUKQACTUBBZMR-DLTLXFJOSA-N 1 3 258.409 3.690 20 0 CHADHO Cc1ccc(C[C@H](C)N[C@H]2C[C@@H]([NH3+])c3ccccc32)s1 ZINC000227541152 333285628 /nfs/dbraw/zinc/28/56/28/333285628.db2.gz QUWDZANNGMCOQL-JECHBYEQSA-N 1 3 286.444 3.722 20 0 CHADHO CC(C)[N@H+](C)CCCNC1CC(c2cccc(Cl)c2)C1 ZINC000228812967 333297143 /nfs/dbraw/zinc/29/71/43/333297143.db2.gz NASRLGBWCYIMOF-UHFFFAOYSA-N 1 3 294.870 3.906 20 0 CHADHO CC(C)[N@@H+](C)CCCNC1CC(c2cccc(Cl)c2)C1 ZINC000228812967 333297144 /nfs/dbraw/zinc/29/71/44/333297144.db2.gz NASRLGBWCYIMOF-UHFFFAOYSA-N 1 3 294.870 3.906 20 0 CHADHO CC(C)N(C)CCC[NH2+]C1CC(c2cccc(Cl)c2)C1 ZINC000228812967 333297146 /nfs/dbraw/zinc/29/71/46/333297146.db2.gz NASRLGBWCYIMOF-UHFFFAOYSA-N 1 3 294.870 3.906 20 0 CHADHO CN(C)CC[C@H]([NH2+]Cc1ccccc1Cl)C(C)(C)C ZINC000523863173 333348356 /nfs/dbraw/zinc/34/83/56/333348356.db2.gz KURJSFKDTKSSSE-HNNXBMFYSA-N 1 3 282.859 3.796 20 0 CHADHO CC(C)C1CCC([NH2+]C[C@H](C)CN2CCCC2)CC1 ZINC000062078965 333542113 /nfs/dbraw/zinc/54/21/13/333542113.db2.gz BNIYXJGRGOVOGV-GTPINHCMSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@@H]([NH2+]CCC(C)(C)C)c1ccc(OCCN(C)C)cc1 ZINC000539093272 333657506 /nfs/dbraw/zinc/65/75/06/333657506.db2.gz KHTYXLKDLXGWLL-OAHLLOKOSA-N 1 3 292.467 3.714 20 0 CHADHO CC[NH+]1CCC(CCNCc2ccc([C@H]3C[C@H]3C)o2)CC1 ZINC000174551803 335158631 /nfs/dbraw/zinc/15/86/31/335158631.db2.gz CJLUQDQKMVRIDI-PBHICJAKSA-N 1 3 290.451 3.615 20 0 CHADHO CC[C@@H]1CCC[C@@H]([NH2+]C2CC(C)(C)NC(C)(C)C2)C1 ZINC000071107008 333843545 /nfs/dbraw/zinc/84/35/45/333843545.db2.gz ZUHFDUWMYDYERL-ZIAGYGMSSA-N 1 3 266.473 3.854 20 0 CHADHO Cc1cccc(C)c1[C@@H](C)NC1CC[NH+](C(C)C)CC1 ZINC000546228534 334020784 /nfs/dbraw/zinc/02/07/84/334020784.db2.gz WSGGJPMUJSIBDE-MRXNPFEDSA-N 1 3 274.452 3.827 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)CCc2ccccc2Cl)[C@@H](C)C1 ZINC000245420255 334191858 /nfs/dbraw/zinc/19/18/58/334191858.db2.gz HJPLCBBLVXQASX-WMLDXEAASA-N 1 3 294.870 3.545 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)CCc2ccccc2Cl)[C@@H](C)C1 ZINC000245420255 334191859 /nfs/dbraw/zinc/19/18/59/334191859.db2.gz HJPLCBBLVXQASX-WMLDXEAASA-N 1 3 294.870 3.545 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H]2c3ccccc3C[C@H]2C)C1 ZINC000247059350 334274710 /nfs/dbraw/zinc/27/47/10/334274710.db2.gz PMMKVJYJQKVAGS-GPMSIDNRSA-N 1 3 286.463 3.630 20 0 CHADHO CC(C)[N@@H+]1CCC[C@H](CN[C@H]2c3ccccc3C[C@H]2C)C1 ZINC000247059350 334274712 /nfs/dbraw/zinc/27/47/12/334274712.db2.gz PMMKVJYJQKVAGS-GPMSIDNRSA-N 1 3 286.463 3.630 20 0 CHADHO CC(C)[N@H+]1CCC[C@H](CN[C@H]2c3ccccc3C[C@H]2C)C1 ZINC000247059350 334274713 /nfs/dbraw/zinc/27/47/13/334274713.db2.gz PMMKVJYJQKVAGS-GPMSIDNRSA-N 1 3 286.463 3.630 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+](CC(C(C)C)C(C)C)C1 ZINC000551806889 334262478 /nfs/dbraw/zinc/26/24/78/334262478.db2.gz YUQSYAMOAKUGAX-MRXNPFEDSA-N 1 3 268.489 3.578 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+](CC(C(C)C)C(C)C)C1 ZINC000551806889 334262480 /nfs/dbraw/zinc/26/24/80/334262480.db2.gz YUQSYAMOAKUGAX-MRXNPFEDSA-N 1 3 268.489 3.578 20 0 CHADHO CSc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)cc1 ZINC000247133908 334276151 /nfs/dbraw/zinc/27/61/51/334276151.db2.gz QMASYLVWXKDCTG-NUEKZKHPSA-N 1 3 292.492 3.932 20 0 CHADHO CSc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H](N(C)C)C2)cc1 ZINC000247133885 334276164 /nfs/dbraw/zinc/27/61/64/334276164.db2.gz QMASYLVWXKDCTG-CWRNSKLLSA-N 1 3 292.492 3.932 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H](C)C2CCCCC2)C1 ZINC000246878152 334271144 /nfs/dbraw/zinc/27/11/44/334271144.db2.gz CPGXIRYLKOORBA-CVEARBPZSA-N 1 3 266.473 3.665 20 0 CHADHO CC[C@H](c1ccccc1)[N@@H+]1CC[C@H]2[C@H](CCCN2C)C1 ZINC000247975888 334292732 /nfs/dbraw/zinc/29/27/32/334292732.db2.gz HUYHVOSHDQWKSS-KURKYZTESA-N 1 3 272.436 3.554 20 0 CHADHO CC[C@H](c1ccccc1)[N@H+]1CC[C@H]2[C@H](CCCN2C)C1 ZINC000247975888 334292734 /nfs/dbraw/zinc/29/27/34/334292734.db2.gz HUYHVOSHDQWKSS-KURKYZTESA-N 1 3 272.436 3.554 20 0 CHADHO CCCc1ccc(CN(C)[C@@H]2CC[N@H+](CC)C[C@@H]2C)cc1 ZINC000552290851 334313864 /nfs/dbraw/zinc/31/38/64/334313864.db2.gz VFEFOFBALJRALA-QFBILLFUSA-N 1 3 288.479 3.801 20 0 CHADHO CCCc1ccc(CN(C)[C@@H]2CC[N@@H+](CC)C[C@@H]2C)cc1 ZINC000552290851 334313865 /nfs/dbraw/zinc/31/38/65/334313865.db2.gz VFEFOFBALJRALA-QFBILLFUSA-N 1 3 288.479 3.801 20 0 CHADHO C[C@H]1CCCCN1CCC[NH2+][C@H]1CCc2ccccc21 ZINC000251574179 334364721 /nfs/dbraw/zinc/36/47/21/334364721.db2.gz AULFMTJKMCQIKL-YJBOKZPZSA-N 1 3 272.436 3.528 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](C)c2ccc3c(c2)CCCC3)C1 ZINC000252440349 334379976 /nfs/dbraw/zinc/37/99/76/334379976.db2.gz ZZFBGADWBLBXJW-HZPDHXFCSA-N 1 3 286.463 3.558 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](C)c2ccc3c(c2)CCCC3)C1 ZINC000252440349 334379977 /nfs/dbraw/zinc/37/99/77/334379977.db2.gz ZZFBGADWBLBXJW-HZPDHXFCSA-N 1 3 286.463 3.558 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](C)c2ccc3c(c2)CCCC3)C1 ZINC000252440349 334379978 /nfs/dbraw/zinc/37/99/78/334379978.db2.gz ZZFBGADWBLBXJW-HZPDHXFCSA-N 1 3 286.463 3.558 20 0 CHADHO CC1(C)CC([NH2+][C@H]2CCN3CCC[C@H]3C2)CC(C)(C)C1 ZINC000252738718 334388254 /nfs/dbraw/zinc/38/82/54/334388254.db2.gz FUTFEHPYXNAEFT-HOCLYGCPSA-N 1 3 278.484 3.808 20 0 CHADHO CC[NH2+]CCCN[C@H](c1cccs1)C1CCCC1 ZINC000565651901 334583891 /nfs/dbraw/zinc/58/38/91/334583891.db2.gz UAABJXVKIMLYHM-HNNXBMFYSA-N 1 3 266.454 3.569 20 0 CHADHO [NH3+]Cc1ccc(CN[C@H]2CCc3ccc(Cl)cc32)cc1 ZINC000567049320 334676360 /nfs/dbraw/zinc/67/63/60/334676360.db2.gz NFYGQHRNMCJWQC-KRWDZBQOSA-N 1 3 286.806 3.576 20 0 CHADHO C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000576536942 335216820 /nfs/dbraw/zinc/21/68/20/335216820.db2.gz JLQPOGAGWINSQL-QDGKJQRMSA-N 1 3 298.474 3.675 20 0 CHADHO CCN(CC)CCC[N@@H+]1CC[C@H](c2cccc(C)c2)C1 ZINC000576719565 335240108 /nfs/dbraw/zinc/24/01/08/335240108.db2.gz BYEWQAOSMJTQRL-SFHVURJKSA-N 1 3 274.452 3.516 20 0 CHADHO CCN(CC)CCC[N@H+]1CC[C@H](c2cccc(C)c2)C1 ZINC000576719565 335240110 /nfs/dbraw/zinc/24/01/10/335240110.db2.gz BYEWQAOSMJTQRL-SFHVURJKSA-N 1 3 274.452 3.516 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000576907769 335262860 /nfs/dbraw/zinc/26/28/60/335262860.db2.gz PMDLPKKTKMKIQQ-QRQLOZEOSA-N 1 3 286.463 3.643 20 0 CHADHO N[C@H]1CCC[C@@H]([NH2+]C2(Cc3ccc(Cl)cc3)CCC2)C1 ZINC000577232260 335327687 /nfs/dbraw/zinc/32/76/87/335327687.db2.gz YCMSTZVPJQPFKW-JKSUJKDBSA-N 1 3 292.854 3.665 20 0 CHADHO [NH3+][C@H]1CCC[C@@H](NC2(Cc3ccc(Cl)cc3)CCC2)C1 ZINC000577232260 335327689 /nfs/dbraw/zinc/32/76/89/335327689.db2.gz YCMSTZVPJQPFKW-JKSUJKDBSA-N 1 3 292.854 3.665 20 0 CHADHO C[NH+](C)Cc1ccc(CNCc2ccc3[nH]ccc3c2)cc1 ZINC000578905750 335688285 /nfs/dbraw/zinc/68/82/85/335688285.db2.gz GKOQHDABEFTTGZ-UHFFFAOYSA-N 1 3 293.414 3.519 20 0 CHADHO C[C@H](CC[NH2+][C@@H]1CCC[C@H](N(C)C)C1)c1ccccc1 ZINC000194493250 336027104 /nfs/dbraw/zinc/02/71/04/336027104.db2.gz GOUXCNCLAUXLJV-NXHRZFHOSA-N 1 3 274.452 3.643 20 0 CHADHO C[C@H](CC(C)(C)C)[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCCN1 ZINC000384682124 336129246 /nfs/dbraw/zinc/12/92/46/336129246.db2.gz UQEAOUUYLDWFMH-QKPAOTATSA-N 1 3 266.473 3.712 20 0 CHADHO C[C@H](c1cccc2ccccc21)N1CC[C@@H]2[NH2+]CC[C@H]2C1 ZINC000386687371 336177195 /nfs/dbraw/zinc/17/71/95/336177195.db2.gz KNQOGGBYOBBQSR-ALKREAHSSA-N 1 3 280.415 3.585 20 0 CHADHO C[NH+](C)CCCC(C)(C)NCc1sccc1Cl ZINC000387291006 336191147 /nfs/dbraw/zinc/19/11/47/336191147.db2.gz IDVFHBCRWYUYLT-UHFFFAOYSA-N 1 3 274.861 3.612 20 0 CHADHO CC(C)(C)N1CCC([NH2+]Cc2cccc3[nH]ccc32)CC1 ZINC000070938949 518708363 /nfs/dbraw/zinc/70/83/63/518708363.db2.gz LCWBFOGIESFHKZ-UHFFFAOYSA-N 1 3 285.435 3.520 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H](C)c2cccs2)C1 ZINC000125785981 519676506 /nfs/dbraw/zinc/67/65/06/519676506.db2.gz GOSYTVGMNNQIAY-KBPBESRZSA-N 1 3 266.454 3.519 20 0 CHADHO CC1(C)CCC[C@H](N[C@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000227542680 520357380 /nfs/dbraw/zinc/35/73/80/520357380.db2.gz ZCRDWJINJBTUDJ-MAZHCROVSA-N 1 3 258.409 3.690 20 0 CHADHO CC[NH+](CC)Cc1ccc(CN[C@@H](C)c2cccnc2)cc1 ZINC000120578860 520750742 /nfs/dbraw/zinc/75/07/42/520750742.db2.gz SBHHFADZKPRTMM-INIZCTEOSA-N 1 3 297.446 3.774 20 0 CHADHO CCC[C@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccccc1 ZINC000037649492 521158570 /nfs/dbraw/zinc/15/85/70/521158570.db2.gz FWZMQBHBZBPWAT-YJBOKZPZSA-N 1 3 272.436 3.602 20 0 CHADHO CCC[C@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccccc1 ZINC000037649492 521158578 /nfs/dbraw/zinc/15/85/78/521158578.db2.gz FWZMQBHBZBPWAT-YJBOKZPZSA-N 1 3 272.436 3.602 20 0 CHADHO CCN1CC[C@H]([N@H+](C)Cc2cnc3ccccc3c2)C[C@H]1C ZINC000337133581 521720844 /nfs/dbraw/zinc/72/08/44/521720844.db2.gz AZFCAPFYUQYMER-QAPCUYQASA-N 1 3 297.446 3.539 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)Cc2cnc3ccccc3c2)C[C@H]1C ZINC000337133581 521720845 /nfs/dbraw/zinc/72/08/45/521720845.db2.gz AZFCAPFYUQYMER-QAPCUYQASA-N 1 3 297.446 3.539 20 0 CHADHO CCSc1cccc(CN(C)[C@H]2CC[N@H+](C)C[C@H]2C)c1 ZINC000290354469 521757368 /nfs/dbraw/zinc/75/73/68/521757368.db2.gz GIAODDJZMFAWTG-PBHICJAKSA-N 1 3 292.492 3.571 20 0 CHADHO CCSc1cccc(CN(C)[C@H]2CC[N@@H+](C)C[C@H]2C)c1 ZINC000290354469 521757378 /nfs/dbraw/zinc/75/73/78/521757378.db2.gz GIAODDJZMFAWTG-PBHICJAKSA-N 1 3 292.492 3.571 20 0 CHADHO C[NH2+]C[C@@H]1CCN([C@@H](C)c2ccc(C(C)(C)C)cc2)C1 ZINC000221277005 522057207 /nfs/dbraw/zinc/05/72/07/522057207.db2.gz ZQYGNDAMHTVBMV-GJZGRUSLSA-N 1 3 274.452 3.586 20 0 CHADHO [NH3+]CC[C@@H]1CCCCN1Cc1cc2ccccc2s1 ZINC000352546707 534647862 /nfs/dbraw/zinc/64/78/62/534647862.db2.gz ZHZUYUYTLCJEGC-AWEZNQCLSA-N 1 3 274.433 3.605 20 0 CHADHO Cc1cc(C(C)(C)C)cc(C)c1CN1CCC([NH3+])CC1 ZINC000036753844 524199504 /nfs/dbraw/zinc/19/95/04/524199504.db2.gz PIQFOTMHUMFBQM-UHFFFAOYSA-N 1 3 274.452 3.524 20 0 CHADHO C[C@H](CCc1ccccc1)N[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000157275442 524250141 /nfs/dbraw/zinc/25/01/41/524250141.db2.gz WURXXCRRAWZQEW-CCKFTAQKSA-N 1 3 280.415 3.742 20 0 CHADHO Fc1cc(C[NH2+]C2CCN(C3CCC3)CC2)ccc1Cl ZINC000299337791 526296714 /nfs/dbraw/zinc/29/67/14/526296714.db2.gz NKRMRMXAOWNPCE-UHFFFAOYSA-N 1 3 296.817 3.586 20 0 CHADHO Cc1oc2ccccc2c1CN(C)[C@H]1CC[N@@H+](C)C[C@H]1C ZINC000290395756 526785610 /nfs/dbraw/zinc/78/56/10/526785610.db2.gz JBEVLEWOYNJBDR-DYVFJYSZSA-N 1 3 286.419 3.513 20 0 CHADHO Cc1oc2ccccc2c1CN(C)[C@H]1CC[N@H+](C)C[C@H]1C ZINC000290395756 526785614 /nfs/dbraw/zinc/78/56/14/526785614.db2.gz JBEVLEWOYNJBDR-DYVFJYSZSA-N 1 3 286.419 3.513 20 0 CHADHO [NH3+][C@H]1C[C@@H](NC2CCC(C(F)(F)F)CC2)c2ccccc21 ZINC000157357618 527417472 /nfs/dbraw/zinc/41/74/72/527417472.db2.gz WWXYPTORGMWHKU-RLNQVHQUSA-N 1 3 298.352 3.842 20 0 CHADHO C[C@H](N[C@H]1CCC[NH2+]CC1)c1cccc2ccccc21 ZINC000133580323 1125475609 /nfs/dbraw/zinc/47/56/09/1125475609.db2.gz NMVUHZHQIPSGTL-HOCLYGCPSA-N 1 3 268.404 3.633 20 0 CHADHO C(C[N@@H+]1CCCC[C@@]12CCCNC2)C1CCCCC1 ZINC000257703048 1131445556 /nfs/dbraw/zinc/44/55/56/1131445556.db2.gz LRSHSBAEWHLKIJ-KRWDZBQOSA-N 1 3 264.457 3.565 20 0 CHADHO C(C[N@H+]1CCCC[C@@]12CCCNC2)C1CCCCC1 ZINC000257703048 1131445559 /nfs/dbraw/zinc/44/55/59/1131445559.db2.gz LRSHSBAEWHLKIJ-KRWDZBQOSA-N 1 3 264.457 3.565 20 0 CHADHO CC[C@@H]1CC[C@H](C)C[C@@H]1[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000430722600 1118765068 /nfs/dbraw/zinc/76/50/68/1118765068.db2.gz QRTDRHYQPMWSCY-FJIDUMEYSA-N 1 3 280.500 3.911 20 0 CHADHO CC(C)CC(CC(C)C)[N@@H+]1CCC[C@]2(CCCNC2)C1 ZINC000228079883 1120732896 /nfs/dbraw/zinc/73/28/96/1120732896.db2.gz CLRHIHRGDZXQPE-SFHVURJKSA-N 1 3 280.500 3.913 20 0 CHADHO CC(C)CC(CC(C)C)[N@H+]1CCC[C@]2(CCCNC2)C1 ZINC000228079883 1120732901 /nfs/dbraw/zinc/73/29/01/1120732901.db2.gz CLRHIHRGDZXQPE-SFHVURJKSA-N 1 3 280.500 3.913 20 0 CHADHO CCC[C@@H](N[C@@H]1CCC[NH2+]CC1)c1ccc(Cl)cc1 ZINC000643467039 1120996008 /nfs/dbraw/zinc/99/60/08/1120996008.db2.gz QCUWROCOGDXYPY-HZPDHXFCSA-N 1 3 280.843 3.913 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CC[C@H](C)[C@H](CN)C1 ZINC001205296219 1122274548 /nfs/dbraw/zinc/27/45/48/1122274548.db2.gz JGMBHJSSQWDJAZ-YESZJQIVSA-N 1 3 266.473 3.676 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CC[C@H](C)[C@H](CN)C1 ZINC001205296219 1122274551 /nfs/dbraw/zinc/27/45/51/1122274551.db2.gz JGMBHJSSQWDJAZ-YESZJQIVSA-N 1 3 266.473 3.676 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](C[C@@H](C)C2CCCCC2)C1 ZINC001191260071 1122585846 /nfs/dbraw/zinc/58/58/46/1122585846.db2.gz ZCZAUMDDVDZVOI-SJORKVTESA-N 1 3 280.500 3.867 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](C[C@@H](C)C2CCCCC2)C1 ZINC001191260071 1122585849 /nfs/dbraw/zinc/58/58/49/1122585849.db2.gz ZCZAUMDDVDZVOI-SJORKVTESA-N 1 3 280.500 3.867 20 0 CHADHO CCN(CC)CCC[NH2+][C@H]1CCC[C@@H]1CCC(C)C ZINC001193495413 1122693287 /nfs/dbraw/zinc/69/32/87/1122693287.db2.gz AZPLDLXUPVQERE-SJORKVTESA-N 1 3 268.489 3.913 20 0 CHADHO CCCN1C[C@@H]2C[N@@H+](C[C@H](C)CCC=C(C)C)C[C@@H]2C1 ZINC001201496809 1123110447 /nfs/dbraw/zinc/11/04/47/1123110447.db2.gz RTZCVKFNVUUWGM-KURKYZTESA-N 1 3 278.484 3.643 20 0 CHADHO CCCN1C[C@@H]2C[N@H+](C[C@H](C)CCC=C(C)C)C[C@@H]2C1 ZINC001201496809 1123110450 /nfs/dbraw/zinc/11/04/50/1123110450.db2.gz RTZCVKFNVUUWGM-KURKYZTESA-N 1 3 278.484 3.643 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@@H](C)c1cccc(C2CC2)c1 ZINC000665281605 1123314556 /nfs/dbraw/zinc/31/45/56/1123314556.db2.gz HNTGBEGALAGNHS-SUMWQHHRSA-N 1 3 260.425 3.588 20 0 CHADHO COc1c(C)cc([C@H](C)NCC[C@@H]([NH3+])C(C)C)cc1Cl ZINC000854230468 1123478740 /nfs/dbraw/zinc/47/87/40/1123478740.db2.gz QVPSCJPEPDRVSA-SWLSCSKDSA-N 1 3 298.858 3.681 20 0 CHADHO CN1CCCC[C@H]1CC[N@H+](C)C[C@@H]1CCCCC1(F)F ZINC000450439371 1125026923 /nfs/dbraw/zinc/02/69/23/1125026923.db2.gz MLWOKNKTYPXDHW-GJZGRUSLSA-N 1 3 288.426 3.618 20 0 CHADHO CN1CCCC[C@H]1CC[N@@H+](C)C[C@@H]1CCCCC1(F)F ZINC000450439371 1125026933 /nfs/dbraw/zinc/02/69/33/1125026933.db2.gz MLWOKNKTYPXDHW-GJZGRUSLSA-N 1 3 288.426 3.618 20 0 CHADHO CCC(C)(C)C1CCC([NH2+][C@@H](C(C)C)C2CNC2)CC1 ZINC001246513351 1131538722 /nfs/dbraw/zinc/53/87/22/1131538722.db2.gz DCZFYSARHUTYKF-JCYILVPMSA-N 1 3 280.500 3.815 20 0 CHADHO CCCCCC1CCC(N2CC[C@@](C)([NH3+])C2)CC1 ZINC001246531612 1131562027 /nfs/dbraw/zinc/56/20/27/1131562027.db2.gz RGAYZCIFYXTPKS-UYSNPLJNSA-N 1 3 252.446 3.549 20 0 CHADHO C[C@@H]1CCCC[N@@H+](C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001171631732 1132062955 /nfs/dbraw/zinc/06/29/55/1132062955.db2.gz MNGDHOKUASAJIY-CQSZACIVSA-N 1 3 266.473 3.760 20 0 CHADHO C[C@@H]1CCCC[N@H+](C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001171631732 1132062964 /nfs/dbraw/zinc/06/29/64/1132062964.db2.gz MNGDHOKUASAJIY-CQSZACIVSA-N 1 3 266.473 3.760 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@@H]2CCC[C@@H](F)C2)CC1(C)C ZINC001171614242 1132065901 /nfs/dbraw/zinc/06/59/01/1132065901.db2.gz VTLGZNROJWHVGZ-CHWSQXEVSA-N 1 3 270.436 3.508 20 0 CHADHO CCCC[C@H](CC(C)C)[NH+]1C[C@H]2CN(CCC)C[C@@H]2C1 ZINC001173259087 1132427377 /nfs/dbraw/zinc/42/73/77/1132427377.db2.gz FMQYMULNCJAZFP-KZNAEPCWSA-N 1 3 280.500 3.865 20 0 CHADHO CCSC[C@H](C)[NH2+]C1CCN(C[C@H]2CC=CCC2)CC1 ZINC001173297300 1132445958 /nfs/dbraw/zinc/44/59/58/1132445958.db2.gz CZHQZZIGLBJTHX-HOTGVXAUSA-N 1 3 296.524 3.538 20 0 CHADHO CCSC[C@H](C)NC1CC[NH+](C[C@H]2CC=CCC2)CC1 ZINC001173297300 1132445962 /nfs/dbraw/zinc/44/59/62/1132445962.db2.gz CZHQZZIGLBJTHX-HOTGVXAUSA-N 1 3 296.524 3.538 20 0 CHADHO CC(C)(C[NH2+][C@@H]1CCCCC1(C)C)CN1CCCC1 ZINC001205645430 1133598582 /nfs/dbraw/zinc/59/85/82/1133598582.db2.gz HHFAKFIGKKGQQQ-OAHLLOKOSA-N 1 3 266.473 3.667 20 0 CHADHO CC/C=C\CCCCC[N@@H+]1C[C@H](CN)CC[C@H]1C ZINC001206761317 1133743358 /nfs/dbraw/zinc/74/33/58/1133743358.db2.gz WTBZLPRLEXPXDY-MSNYOWOLSA-N 1 3 252.446 3.572 20 0 CHADHO CC/C=C\CCCCC[N@H+]1C[C@H](CN)CC[C@H]1C ZINC001206761317 1133743364 /nfs/dbraw/zinc/74/33/64/1133743364.db2.gz WTBZLPRLEXPXDY-MSNYOWOLSA-N 1 3 252.446 3.572 20 0 CHADHO C[C@@H](NCc1cccc(C[NH+](C)C)c1)c1ccc(F)cc1 ZINC000119597083 1125536724 /nfs/dbraw/zinc/53/67/24/1125536724.db2.gz IIERMLQGGZBIFP-CQSZACIVSA-N 1 3 286.394 3.738 20 0 CHADHO CC1(C[NH2+]C2CCN(C3CCCC3)CC2)CCCC1 ZINC000089555490 1129239545 /nfs/dbraw/zinc/23/95/45/1129239545.db2.gz OGRABKZXXANSLP-UHFFFAOYSA-N 1 3 264.457 3.563 20 0 CHADHO Cc1ccc(CN[C@@H](CC[NH+](C)C)C(C)(C)C)s1 ZINC000116379068 1125644370 /nfs/dbraw/zinc/64/43/70/1125644370.db2.gz QPWFFOUOLKOYQK-AWEZNQCLSA-N 1 3 268.470 3.513 20 0 CHADHO Cc1ccc([C@@H](C)NCCCC[N@@H+]2CCCC[C@H]2C)o1 ZINC000246976807 1125652186 /nfs/dbraw/zinc/65/21/86/1125652186.db2.gz JKMCDQOPGSZGCJ-GDBMZVCRSA-N 1 3 278.440 3.893 20 0 CHADHO Cc1ccc([C@@H](C)NCCCC[N@H+]2CCCC[C@H]2C)o1 ZINC000246976807 1125652189 /nfs/dbraw/zinc/65/21/89/1125652189.db2.gz JKMCDQOPGSZGCJ-GDBMZVCRSA-N 1 3 278.440 3.893 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1ccccc1 ZINC000247069037 1125652655 /nfs/dbraw/zinc/65/26/55/1125652655.db2.gz MWMRQLSHIJQYBL-BBWFWOEESA-N 1 3 260.425 3.600 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](C)c2sc(C(C)C)nc2C)C1 ZINC000246932849 1125655001 /nfs/dbraw/zinc/65/50/01/1125655001.db2.gz HGLRBDIOBWQSAX-OCCSQVGLSA-N 1 3 295.496 3.567 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1ccc(OC)cc1 ZINC000247181448 1125655458 /nfs/dbraw/zinc/65/54/58/1125655458.db2.gz TYGSQPNSNKVXHS-NUJGCVRESA-N 1 3 290.451 3.609 20 0 CHADHO C[C@]1(C[NH3+])CCN(Cc2ccc(-c3ccccc3)s2)C1 ZINC000261739360 1125741014 /nfs/dbraw/zinc/74/10/14/1125741014.db2.gz PBNIVVVHSJCDQJ-QGZVFWFLSA-N 1 3 286.444 3.586 20 0 CHADHO CCc1ccc([C@H](N[C@@H]2CC[NH2+]C[C@@H]2C)C(C)C)cc1 ZINC000261734472 1125741551 /nfs/dbraw/zinc/74/15/51/1125741551.db2.gz LKSXSNNRUOBIRR-BMGDILEWSA-N 1 3 274.452 3.534 20 0 CHADHO CCc1ccc([C@H]([NH2+][C@@H]2CCNC[C@@H]2C)C(C)C)cc1 ZINC000261734472 1125741556 /nfs/dbraw/zinc/74/15/56/1125741556.db2.gz LKSXSNNRUOBIRR-BMGDILEWSA-N 1 3 274.452 3.534 20 0 CHADHO CC[N@H+](CC[C@H]1CCCN1C)Cc1ccc(Cl)cc1 ZINC000348041598 1129276128 /nfs/dbraw/zinc/27/61/28/1129276128.db2.gz HVUZBLDYKZSTOW-MRXNPFEDSA-N 1 3 280.843 3.646 20 0 CHADHO CC[N@@H+](CC[C@H]1CCCN1C)Cc1ccc(Cl)cc1 ZINC000348041598 1129276130 /nfs/dbraw/zinc/27/61/30/1129276130.db2.gz HVUZBLDYKZSTOW-MRXNPFEDSA-N 1 3 280.843 3.646 20 0 CHADHO [NH3+][C@H]1CCC[C@H](NCc2cc(-c3ccccc3)cs2)C1 ZINC000414933427 1129206614 /nfs/dbraw/zinc/20/66/14/1129206614.db2.gz WWNRUBAJVLJXEM-HOTGVXAUSA-N 1 3 286.444 3.775 20 0 CHADHO CC1=C(c2ccco2)C[N@H+](CC[C@H]2CCCCN2C)CC1 ZINC000338342112 1126735654 /nfs/dbraw/zinc/73/56/54/1126735654.db2.gz FKCNUSQPFCAJQA-MRXNPFEDSA-N 1 3 288.435 3.633 20 0 CHADHO CC1=C(c2ccco2)C[N@@H+](CC[C@H]2CCCCN2C)CC1 ZINC000338342112 1126735659 /nfs/dbraw/zinc/73/56/59/1126735659.db2.gz FKCNUSQPFCAJQA-MRXNPFEDSA-N 1 3 288.435 3.633 20 0 CHADHO C[C@@H]1CCC[C@@H](C[NH2+]C2CCN(C(C)(C)C)CC2)[C@H]1C ZINC000481988401 1126736637 /nfs/dbraw/zinc/73/66/37/1126736637.db2.gz FPCILKNWZGMYKM-PMPSAXMXSA-N 1 3 280.500 3.911 20 0 CHADHO CCCc1cccc(CN(C)[C@@H]2CC[N@H+](CC)C[C@H]2C)c1 ZINC000481999837 1126737374 /nfs/dbraw/zinc/73/73/74/1126737374.db2.gz HVWKXTCYOTUHEK-VQIMIIECSA-N 1 3 288.479 3.801 20 0 CHADHO CCCc1cccc(CN(C)[C@@H]2CC[N@@H+](CC)C[C@H]2C)c1 ZINC000481999837 1126737377 /nfs/dbraw/zinc/73/73/77/1126737377.db2.gz HVWKXTCYOTUHEK-VQIMIIECSA-N 1 3 288.479 3.801 20 0 CHADHO CCCc1cccc(CN(C)[C@H]2CC[N@H+](CC)C[C@H]2C)c1 ZINC000481999833 1126737876 /nfs/dbraw/zinc/73/78/76/1126737876.db2.gz HVWKXTCYOTUHEK-APWZRJJASA-N 1 3 288.479 3.801 20 0 CHADHO CCCc1cccc(CN(C)[C@H]2CC[N@@H+](CC)C[C@H]2C)c1 ZINC000481999833 1126737878 /nfs/dbraw/zinc/73/78/78/1126737878.db2.gz HVWKXTCYOTUHEK-APWZRJJASA-N 1 3 288.479 3.801 20 0 CHADHO COc1ccccc1[C@@H](C)[NH2+][C@@H](CCN(C)C)C(C)(C)C ZINC000483179180 1126770700 /nfs/dbraw/zinc/77/07/00/1126770700.db2.gz BOMODMIUIKXZLM-PBHICJAKSA-N 1 3 292.467 3.712 20 0 CHADHO CC(C)c1nc(CC[NH2+]C[C@@H](N)CCC(C)(C)C)cs1 ZINC000904366403 1126850878 /nfs/dbraw/zinc/85/08/78/1126850878.db2.gz JRPVLKAFYHIGFK-ZDUSSCGKSA-N 1 3 297.512 3.552 20 0 CHADHO CCC[C@@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)c1cccnc1 ZINC000185357818 1126899621 /nfs/dbraw/zinc/89/96/21/1126899621.db2.gz RJWFYQCKLYMQBD-FUHWJXTLSA-N 1 3 289.467 3.633 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]C[C@@H](C)c2ccccc2)C1 ZINC000194423015 1126974904 /nfs/dbraw/zinc/97/49/04/1126974904.db2.gz VATDKUSCLNFRAE-SJORKVTESA-N 1 3 274.452 3.500 20 0 CHADHO Cc1cccnc1[C@@H]([NH2+]CC[C@H]1CCCCN1C)C(C)C ZINC000268098217 1127011756 /nfs/dbraw/zinc/01/17/56/1127011756.db2.gz KDRVOOSMYALLOP-SJORKVTESA-N 1 3 289.467 3.551 20 0 CHADHO Cc1ccc([C@H](C)NC2CC[NH+](C3CCC3)CC2)cc1 ZINC000269057721 1127033514 /nfs/dbraw/zinc/03/35/14/1127033514.db2.gz XCQVKPUZRDUJQZ-HNNXBMFYSA-N 1 3 272.436 3.663 20 0 CHADHO Cc1ccsc1[C@@H](C)NC1CC[NH+](C2CCC2)CC1 ZINC000268978058 1127030835 /nfs/dbraw/zinc/03/08/35/1127030835.db2.gz HEOINEGHUMQWFF-CYBMUJFWSA-N 1 3 278.465 3.724 20 0 CHADHO Cc1ccsc1[C@H](C)NC1CC[NH+](C2CCC2)CC1 ZINC000268978059 1127030868 /nfs/dbraw/zinc/03/08/68/1127030868.db2.gz HEOINEGHUMQWFF-ZDUSSCGKSA-N 1 3 278.465 3.724 20 0 CHADHO C[C@@H](Cc1ccc(Cl)cc1)[NH2+][C@@H]1CCNC2(CCC2)C1 ZINC000666995324 1127139138 /nfs/dbraw/zinc/13/91/38/1127139138.db2.gz KCYYUWKOCLODKL-XJKSGUPXSA-N 1 3 292.854 3.535 20 0 CHADHO CC(C)C[C@H](C)C[C@@H](C)[NH2+][C@H]1CCNC2(CCC2)C1 ZINC000666995558 1127139289 /nfs/dbraw/zinc/13/92/89/1127139289.db2.gz RGQUOKCMPIMMDA-XHSDSOJGSA-N 1 3 266.473 3.712 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@@H]2N[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000349806003 1127162279 /nfs/dbraw/zinc/16/22/79/1127162279.db2.gz XINAOCNJDDSVBN-AOIWGVFYSA-N 1 3 298.474 3.897 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@@H]2N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000349806003 1127162282 /nfs/dbraw/zinc/16/22/82/1127162282.db2.gz XINAOCNJDDSVBN-AOIWGVFYSA-N 1 3 298.474 3.897 20 0 CHADHO C[C@H](NCc1ccc(C[NH3+])cc1)c1ccc(Cl)s1 ZINC000572483721 1127201076 /nfs/dbraw/zinc/20/10/76/1127201076.db2.gz OQQFNKMQCJPIRK-JTQLQIEISA-N 1 3 280.824 3.711 20 0 CHADHO CC(C)C(CN1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)C(C)C ZINC000572489931 1127201551 /nfs/dbraw/zinc/20/15/51/1127201551.db2.gz JUHCEHRWOYNVDA-QFBILLFUSA-N 1 3 292.511 3.863 20 0 CHADHO CC(C)C(CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)C(C)C ZINC000572489931 1127201554 /nfs/dbraw/zinc/20/15/54/1127201554.db2.gz JUHCEHRWOYNVDA-QFBILLFUSA-N 1 3 292.511 3.863 20 0 CHADHO C[C@@H](NCc1ccc(C[NH3+])cc1)c1cccc(Cl)c1 ZINC000573724170 1127327623 /nfs/dbraw/zinc/32/76/23/1127327623.db2.gz UKKUKCSFGVHNDB-GFCCVEGCSA-N 1 3 274.795 3.650 20 0 CHADHO C[C@H](NCc1ccc(C[NH3+])cc1)c1cccc(Cl)c1 ZINC000573724171 1127327797 /nfs/dbraw/zinc/32/77/97/1127327797.db2.gz UKKUKCSFGVHNDB-LBPRGKRZSA-N 1 3 274.795 3.650 20 0 CHADHO C[C@H]1C[C@H](NC2CC[NH+](C3CCC3)CC2)c2ccccc21 ZINC000289221471 1127377259 /nfs/dbraw/zinc/37/72/59/1127377259.db2.gz LHGKUXFFZPJLRO-LIRRHRJNSA-N 1 3 284.447 3.841 20 0 CHADHO C[C@@H](c1ccc(F)c(Cl)c1)N1CCC2(C1)CC[NH2+]CC2 ZINC000358517961 1127425150 /nfs/dbraw/zinc/42/51/50/1127425150.db2.gz QOUMHVLGCYLKIY-LBPRGKRZSA-N 1 3 296.817 3.616 20 0 CHADHO C[C@@H]1CCC[C@@H]([NH+]2CCC(N[C@H]3CCCSC3)CC2)C1 ZINC000358780889 1127434372 /nfs/dbraw/zinc/43/43/72/1127434372.db2.gz YDBDJXCLSSDJEZ-HYVNUMGLSA-N 1 3 296.524 3.515 20 0 CHADHO C[C@@H]1CCC[C@@H](N2CCC([NH2+][C@H]3CCCSC3)CC2)C1 ZINC000358780889 1127434375 /nfs/dbraw/zinc/43/43/75/1127434375.db2.gz YDBDJXCLSSDJEZ-HYVNUMGLSA-N 1 3 296.524 3.515 20 0 CHADHO CC[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc(C)c1 ZINC000295845827 1129219604 /nfs/dbraw/zinc/21/96/04/1129219604.db2.gz ATPOCOQFUXODEK-HQSKLWIPSA-N 1 3 272.436 3.661 20 0 CHADHO CC[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(C)c1 ZINC000295845827 1129219607 /nfs/dbraw/zinc/21/96/07/1129219607.db2.gz ATPOCOQFUXODEK-HQSKLWIPSA-N 1 3 272.436 3.661 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H]2CC[C@H](C)c3ccccc32)C1 ZINC000360235270 1127493147 /nfs/dbraw/zinc/49/31/47/1127493147.db2.gz TXDYPMKRGJCQSE-FCEWJHQRSA-N 1 3 286.463 3.947 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H]2CC[C@H](C)c3ccccc32)C1 ZINC000360235270 1127493149 /nfs/dbraw/zinc/49/31/49/1127493149.db2.gz TXDYPMKRGJCQSE-FCEWJHQRSA-N 1 3 286.463 3.947 20 0 CHADHO CC(C)[N@H+](C)CC1CCN(c2ccnc3ccccc32)CC1 ZINC000601505418 1127529709 /nfs/dbraw/zinc/52/97/09/1127529709.db2.gz MKAIVLPNYVSUQA-UHFFFAOYSA-N 1 3 297.446 3.791 20 0 CHADHO CC(C)[N@@H+](C)CC1CCN(c2ccnc3ccccc32)CC1 ZINC000601505418 1127529710 /nfs/dbraw/zinc/52/97/10/1127529710.db2.gz MKAIVLPNYVSUQA-UHFFFAOYSA-N 1 3 297.446 3.791 20 0 CHADHO C[C@H](N[C@@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(C2CC2)c1 ZINC000294564011 1127582965 /nfs/dbraw/zinc/58/29/65/1127582965.db2.gz BNRKQKMMCICLMK-SUNYJGFJSA-N 1 3 272.436 3.697 20 0 CHADHO C[C@H](N[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(C2CC2)c1 ZINC000294564011 1127582969 /nfs/dbraw/zinc/58/29/69/1127582969.db2.gz BNRKQKMMCICLMK-SUNYJGFJSA-N 1 3 272.436 3.697 20 0 CHADHO CC[C@H](N[C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(C)cc1 ZINC000361970966 1127603968 /nfs/dbraw/zinc/60/39/68/1127603968.db2.gz JPTLQFVIQXLPOJ-SQNIBIBYSA-N 1 3 274.452 3.909 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)c1ccc(C)cc1 ZINC000361970966 1127603970 /nfs/dbraw/zinc/60/39/70/1127603970.db2.gz JPTLQFVIQXLPOJ-SQNIBIBYSA-N 1 3 274.452 3.909 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@H+](C)CC2CCCCC2)c1 ZINC001232146194 1127623139 /nfs/dbraw/zinc/62/31/39/1127623139.db2.gz LBOPUCDWGUFIPJ-UHFFFAOYSA-N 1 3 292.442 3.899 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@@H+](C)CC2CCCCC2)c1 ZINC001232146194 1127623141 /nfs/dbraw/zinc/62/31/41/1127623141.db2.gz LBOPUCDWGUFIPJ-UHFFFAOYSA-N 1 3 292.442 3.899 20 0 CHADHO CC[C@H]([NH2+]C1CCN(CC(C)C)CC1)c1ccsc1 ZINC000295814310 1127653209 /nfs/dbraw/zinc/65/32/09/1127653209.db2.gz CWYAVAKLZZOBPC-INIZCTEOSA-N 1 3 280.481 3.909 20 0 CHADHO CC[C@H]([NH2+]C1CCN(CC2CC2)CC1)c1ccsc1 ZINC000295950180 1127657881 /nfs/dbraw/zinc/65/78/81/1127657881.db2.gz LLKGUISWSJYLTA-INIZCTEOSA-N 1 3 278.465 3.663 20 0 CHADHO c1cc(CN2CCC23CCC3)cc(C[NH+]2CCCCC2)c1 ZINC000411307740 1127854762 /nfs/dbraw/zinc/85/47/62/1127854762.db2.gz HVMRQSCUSIOPDI-UHFFFAOYSA-N 1 3 284.447 3.801 20 0 CHADHO CCc1ccc(CN2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000539895811 1127952224 /nfs/dbraw/zinc/95/22/24/1127952224.db2.gz XNLIIBRCDHBQDC-AZUAARDMSA-N 1 3 298.474 3.698 20 0 CHADHO CCc1ccc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000539895811 1127952226 /nfs/dbraw/zinc/95/22/26/1127952226.db2.gz XNLIIBRCDHBQDC-AZUAARDMSA-N 1 3 298.474 3.698 20 0 CHADHO CCC(C)(C)c1ccc(CN[C@H]2CC[N@H+](C)C[C@@H]2C)cc1 ZINC000540153088 1127964646 /nfs/dbraw/zinc/96/46/46/1127964646.db2.gz DTVBQEIJHIQFOQ-YJBOKZPZSA-N 1 3 288.479 3.804 20 0 CHADHO CCC(C)(C)c1ccc(CN[C@H]2CC[N@@H+](C)C[C@@H]2C)cc1 ZINC000540153088 1127964650 /nfs/dbraw/zinc/96/46/50/1127964650.db2.gz DTVBQEIJHIQFOQ-YJBOKZPZSA-N 1 3 288.479 3.804 20 0 CHADHO CC[N@@H+]1CC[C@H](NCc2csc3ccccc23)[C@H](C)C1 ZINC000540195231 1127968890 /nfs/dbraw/zinc/96/88/90/1127968890.db2.gz OXNLTJCMIXMZAY-CJNGLKHVSA-N 1 3 288.460 3.721 20 0 CHADHO CC[N@H+]1CC[C@H](NCc2csc3ccccc23)[C@H](C)C1 ZINC000540195231 1127968894 /nfs/dbraw/zinc/96/88/94/1127968894.db2.gz OXNLTJCMIXMZAY-CJNGLKHVSA-N 1 3 288.460 3.721 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](c2ccc(C)o2)C2CCCC2)C1 ZINC000540475303 1127979945 /nfs/dbraw/zinc/97/99/45/1127979945.db2.gz MLAVUTAKUITNTG-YJBOKZPZSA-N 1 3 290.451 3.751 20 0 CHADHO C[C@H](C[NH2+]CCCN1CCCC1)c1cccc(Cl)c1 ZINC000470193220 1128066322 /nfs/dbraw/zinc/06/63/22/1128066322.db2.gz DSKMVEWKCKHXKT-CQSZACIVSA-N 1 3 280.843 3.519 20 0 CHADHO CCCCCC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000151867930 1128080428 /nfs/dbraw/zinc/08/04/28/1128080428.db2.gz GGJKESMJVXUZNX-UHFFFAOYSA-N 1 3 266.473 3.953 20 0 CHADHO CCC[C@H](CC)[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001257251552 1128093877 /nfs/dbraw/zinc/09/38/77/1128093877.db2.gz RSXOVTLPLOARAP-ZDUSSCGKSA-N 1 3 254.462 3.806 20 0 CHADHO CCC[C@@H](NCC1CC[NH+](C)CC1)c1ncccc1Cl ZINC000924962714 1128118101 /nfs/dbraw/zinc/11/81/01/1128118101.db2.gz GAQMERFUWYQLOG-OAHLLOKOSA-N 1 3 295.858 3.508 20 0 CHADHO [NH3+]CCC[C@@H](N[C@H]1CCOc2ccccc21)c1ccccc1 ZINC000925510184 1128130417 /nfs/dbraw/zinc/13/04/17/1128130417.db2.gz UDDZTVAXESSBMF-MSOLQXFVSA-N 1 3 296.414 3.580 20 0 CHADHO c1ccc(C2CC([NH2+][C@H]3CCNC[C@H]3C3CCCC3)C2)cc1 ZINC000925604106 1128134183 /nfs/dbraw/zinc/13/41/83/1128134183.db2.gz HOCFQPMSIDEAIE-GUMHCPJTSA-N 1 3 298.474 3.691 20 0 CHADHO c1ccc(C2CC([NH2+][C@@H]3CCNC[C@H]3C3CCCC3)C2)cc1 ZINC000925604105 1128134476 /nfs/dbraw/zinc/13/44/76/1128134476.db2.gz HOCFQPMSIDEAIE-GHBBCFCZSA-N 1 3 298.474 3.691 20 0 CHADHO C[C@H](NCCC(C)(C)[NH3+])c1ccc(-c2ccncc2)cc1 ZINC000925742647 1128140534 /nfs/dbraw/zinc/14/05/34/1128140534.db2.gz WFFHYEYIJGYGOV-AWEZNQCLSA-N 1 3 283.419 3.527 20 0 CHADHO CCC1([NH3+])CCN([C@@H](C)c2cccc(C)c2C)CC1 ZINC000925755066 1128140552 /nfs/dbraw/zinc/14/05/52/1128140552.db2.gz BGFWSXLOSHUMBP-HNNXBMFYSA-N 1 3 260.425 3.568 20 0 CHADHO CC(C)CCN1CCC([NH2+]C[C@@H]2CCCC2(F)F)CC1 ZINC000926524521 1128178731 /nfs/dbraw/zinc/17/87/31/1128178731.db2.gz OHICDDGPUIWFIY-AWEZNQCLSA-N 1 3 288.426 3.522 20 0 CHADHO C[C@@H]1C[C@@H](C)CN(CCC[NH2+]C2CCCCCC2)C1 ZINC000559870896 1128238290 /nfs/dbraw/zinc/23/82/90/1128238290.db2.gz PBUDEJHUWUSNGQ-HZPDHXFCSA-N 1 3 266.473 3.667 20 0 CHADHO CCCC[C@H](CCC)[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000715232735 1128290366 /nfs/dbraw/zinc/29/03/66/1128290366.db2.gz ACJDYXHOCILAMT-ARFHVFGLSA-N 1 3 254.462 3.808 20 0 CHADHO CC(C)=CCC[C@@H](C)CN1CCCC[C@]12CCC[NH2+]C2 ZINC001235174166 1128311746 /nfs/dbraw/zinc/31/17/46/1128311746.db2.gz SJCMMJHHGIEZIN-QZTJIDSGSA-N 1 3 278.484 3.977 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@@H+]1CCCC[C@]12CCCNC2 ZINC001235174166 1128311749 /nfs/dbraw/zinc/31/17/49/1128311749.db2.gz SJCMMJHHGIEZIN-QZTJIDSGSA-N 1 3 278.484 3.977 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@H+]1CCCC[C@]12CCCNC2 ZINC001235174166 1128311751 /nfs/dbraw/zinc/31/17/51/1128311751.db2.gz SJCMMJHHGIEZIN-QZTJIDSGSA-N 1 3 278.484 3.977 20 0 CHADHO CC1(CN2CCCC[C@@]23CCC[NH2+]C3)CCCCC1 ZINC001235173816 1128312684 /nfs/dbraw/zinc/31/26/84/1128312684.db2.gz RMGJHAYTIYINEO-KRWDZBQOSA-N 1 3 264.457 3.565 20 0 CHADHO CC1(C[N@@H+]2CCCC[C@@]23CCCNC3)CCCCC1 ZINC001235173816 1128312688 /nfs/dbraw/zinc/31/26/88/1128312688.db2.gz RMGJHAYTIYINEO-KRWDZBQOSA-N 1 3 264.457 3.565 20 0 CHADHO CC1(C[N@H+]2CCCC[C@@]23CCCNC3)CCCCC1 ZINC001235173816 1128312693 /nfs/dbraw/zinc/31/26/93/1128312693.db2.gz RMGJHAYTIYINEO-KRWDZBQOSA-N 1 3 264.457 3.565 20 0 CHADHO CCc1ccc(C[NH2+]C[C@H]2CCCN(C(C)C)C2)s1 ZINC001649175653 1128330949 /nfs/dbraw/zinc/33/09/49/1128330949.db2.gz NLFIGABBFZBRBV-CQSZACIVSA-N 1 3 280.481 3.521 20 0 CHADHO Cc1ccc(C)c([C@@H](C)NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1 ZINC000037103446 1128413874 /nfs/dbraw/zinc/41/38/74/1128413874.db2.gz KHZXEXSNKYPFTO-MGNMYUMUSA-N 1 3 272.436 3.579 20 0 CHADHO Cc1ccc(C)c([C@@H](C)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1 ZINC000037103446 1128413875 /nfs/dbraw/zinc/41/38/75/1128413875.db2.gz KHZXEXSNKYPFTO-MGNMYUMUSA-N 1 3 272.436 3.579 20 0 CHADHO CN(C)[C@@H]1CCC[N@H+](C[C@H]2CCCC(C)(C)C2)CC1 ZINC000562417907 1128401051 /nfs/dbraw/zinc/40/10/51/1128401051.db2.gz SXALCOLOPQEAPK-JKSUJKDBSA-N 1 3 266.473 3.619 20 0 CHADHO CN(C)[C@@H]1CCC[N@@H+](C[C@H]2CCCC(C)(C)C2)CC1 ZINC000562417907 1128401054 /nfs/dbraw/zinc/40/10/54/1128401054.db2.gz SXALCOLOPQEAPK-JKSUJKDBSA-N 1 3 266.473 3.619 20 0 CHADHO CCC[NH+]1CCC(N[C@H](c2ccc(C)cc2)C2CC2)CC1 ZINC000037236878 1128425608 /nfs/dbraw/zinc/42/56/08/1128425608.db2.gz OWNLJUGBQAUCBZ-LJQANCHMSA-N 1 3 286.463 3.910 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2)C1 ZINC000037644043 1128433833 /nfs/dbraw/zinc/43/38/33/1128433833.db2.gz UIGCVVUXCZETGX-JKSUJKDBSA-N 1 3 282.431 3.832 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H](C)c2ccc3ccccc3c2)C1 ZINC000037644043 1128433836 /nfs/dbraw/zinc/43/38/36/1128433836.db2.gz UIGCVVUXCZETGX-JKSUJKDBSA-N 1 3 282.431 3.832 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H](C)c2ccc3ccccc3c2)C1 ZINC000037644043 1128433837 /nfs/dbraw/zinc/43/38/37/1128433837.db2.gz UIGCVVUXCZETGX-JKSUJKDBSA-N 1 3 282.431 3.832 20 0 CHADHO Cc1ccc([C@H](C)NC[C@H](C)C[NH+]2CCCC2)cc1C ZINC000062077625 1128436321 /nfs/dbraw/zinc/43/63/21/1128436321.db2.gz CEJNJRLZPKKRFX-YOEHRIQHSA-N 1 3 274.452 3.686 20 0 CHADHO CC(C)C1CCC([NH2+]C[C@@H](C)CN2CCCC2)CC1 ZINC000062078964 1128437253 /nfs/dbraw/zinc/43/72/53/1128437253.db2.gz BNIYXJGRGOVOGV-KLAILNCOSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@H](N[C@@H](CC[NH+](C)C)C(C)(C)C)c1cccs1 ZINC000125890090 1128455849 /nfs/dbraw/zinc/45/58/49/1128455849.db2.gz OHJYFKSDQWJIDW-JSGCOSHPSA-N 1 3 268.470 3.765 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCc1ccc(F)c(-c2cccs2)c1 ZINC000564084359 1128492969 /nfs/dbraw/zinc/49/29/69/1128492969.db2.gz JXAZRTWVXKETIK-RYUDHWBXSA-N 1 3 292.423 3.770 20 0 CHADHO C[NH+](C)CC[C@@H](NCc1ccc2[nH]ccc2c1)C(C)(C)C ZINC000565218905 1128521359 /nfs/dbraw/zinc/52/13/59/1128521359.db2.gz SXVVUOGREUBBSI-QGZVFWFLSA-N 1 3 287.451 3.624 20 0 CHADHO C[C@@H](CCN1CCCCCC1)[NH+]1CCCCCC1 ZINC000470957585 1128614660 /nfs/dbraw/zinc/61/46/60/1128614660.db2.gz XRILGAGNLIFINC-INIZCTEOSA-N 1 3 252.446 3.517 20 0 CHADHO CCCC[C@H](C)[C@H](C)[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000569884507 1128611159 /nfs/dbraw/zinc/61/11/59/1128611159.db2.gz TXNRINJTJIJDJH-CAOSSQGBSA-N 1 3 254.462 3.664 20 0 CHADHO C[C@@H]1C[C@@H](NCc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000073656713 1128646468 /nfs/dbraw/zinc/64/64/68/1128646468.db2.gz IXDNIBGGPCJLNV-XLIONFOSSA-N 1 3 294.442 3.829 20 0 CHADHO C[C@@H]1C[C@@H](NCc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000073656713 1128646471 /nfs/dbraw/zinc/64/64/71/1128646471.db2.gz IXDNIBGGPCJLNV-XLIONFOSSA-N 1 3 294.442 3.829 20 0 CHADHO CC(C)OC1CCC([NH2+]CCCN2CCCC[C@H]2C)CC1 ZINC001257871788 1128659666 /nfs/dbraw/zinc/65/96/66/1128659666.db2.gz GDMPNAYSFHRPMV-WWDZGPRUSA-N 1 3 296.499 3.577 20 0 CHADHO CC(C)[NH+]1CCC(N[C@H](c2ccccc2)C2CC2)CC1 ZINC000035053250 1117764083 /nfs/dbraw/zinc/76/40/83/1117764083.db2.gz XLODXXXUXUAMAI-GOSISDBHSA-N 1 3 272.436 3.600 20 0 CHADHO Cc1cccc(C[C@H]([NH2+][C@H]2CCNC3(CCC3)C2)C2CC2)c1 ZINC000643546029 1117793001 /nfs/dbraw/zinc/79/30/01/1117793001.db2.gz HFMBKHICEVFQEO-OALUTQOASA-N 1 3 298.474 3.580 20 0 CHADHO CCC[C@@H]([NH2+][C@@H]1CCNC2(CCC2)C1)C1CCCCC1 ZINC000643547033 1117794157 /nfs/dbraw/zinc/79/41/57/1117794157.db2.gz YSOXAPRIKNNAHJ-IAGOWNOFSA-N 1 3 278.484 4.000 20 0 CHADHO C[N@@H+]1CC[C@@H](NCc2cc3ccccc3s2)CC1(C)C ZINC000623376935 1117845076 /nfs/dbraw/zinc/84/50/76/1117845076.db2.gz IJJCTZIMGUUQNS-CQSZACIVSA-N 1 3 288.460 3.864 20 0 CHADHO C[N@H+]1CC[C@@H](NCc2cc3ccccc3s2)CC1(C)C ZINC000623376935 1117845081 /nfs/dbraw/zinc/84/50/81/1117845081.db2.gz IJJCTZIMGUUQNS-CQSZACIVSA-N 1 3 288.460 3.864 20 0 CHADHO CC[C@@H](N[C@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1 ZINC000623384666 1117846821 /nfs/dbraw/zinc/84/68/21/1117846821.db2.gz CLARFDOECNKVLE-JKSUJKDBSA-N 1 3 260.425 3.600 20 0 CHADHO CC[C@@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1 ZINC000623384666 1117846827 /nfs/dbraw/zinc/84/68/27/1117846827.db2.gz CLARFDOECNKVLE-JKSUJKDBSA-N 1 3 260.425 3.600 20 0 CHADHO CCCN1CCC([NH2+]Cc2ccc(C)cc2SC)CC1 ZINC000119263950 1117879094 /nfs/dbraw/zinc/87/90/94/1117879094.db2.gz YFPUQBIHMKMQEQ-UHFFFAOYSA-N 1 3 292.492 3.681 20 0 CHADHO C[N@@H+]1CCCC[C@H](CNCc2cccc3ccccc32)C1 ZINC000623654663 1117883781 /nfs/dbraw/zinc/88/37/81/1117883781.db2.gz FPULGHPWLSUZLP-MRXNPFEDSA-N 1 3 282.431 3.661 20 0 CHADHO C[N@H+]1CCCC[C@H](CNCc2cccc3ccccc32)C1 ZINC000623654663 1117883790 /nfs/dbraw/zinc/88/37/90/1117883790.db2.gz FPULGHPWLSUZLP-MRXNPFEDSA-N 1 3 282.431 3.661 20 0 CHADHO CN1CCCC[C@H](C[NH2+]Cc2cccc3ccccc32)C1 ZINC000623654663 1117883796 /nfs/dbraw/zinc/88/37/96/1117883796.db2.gz FPULGHPWLSUZLP-MRXNPFEDSA-N 1 3 282.431 3.661 20 0 CHADHO CC(C)[C@H](C[NH2+]C[C@H]1CCCCN(C)C1)c1ccccc1 ZINC000623656803 1117885504 /nfs/dbraw/zinc/88/55/04/1117885504.db2.gz CELMSXRUZBHTOX-MJGOQNOKSA-N 1 3 288.479 3.748 20 0 CHADHO CC[C@H](C)[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000579288065 1128743169 /nfs/dbraw/zinc/74/31/69/1128743169.db2.gz IDMDKTJQHXIGKQ-JCHJZTRSSA-N 1 3 286.463 3.675 20 0 CHADHO C([NH2+]C1CCN(C2CCCCC2)CC1)[C@@H]1CCCC12CC2 ZINC000623825872 1117942746 /nfs/dbraw/zinc/94/27/46/1117942746.db2.gz MUBNBVOGWPBQRX-INIZCTEOSA-N 1 3 290.495 3.953 20 0 CHADHO CC1(CN2CCC([NH+]3CCCC3)CC2)CCCCC1 ZINC001208897779 1117958485 /nfs/dbraw/zinc/95/84/85/1117958485.db2.gz IVMUIIBVORJSBG-UHFFFAOYSA-N 1 3 264.457 3.517 20 0 CHADHO C[C@H](NC[C@H]1CCCC[N@H+](C)C1)c1cc2c(s1)CCC2 ZINC000624122592 1117984942 /nfs/dbraw/zinc/98/49/42/1117984942.db2.gz WKDLXZQFWUSMBR-UONOGXRCSA-N 1 3 292.492 3.619 20 0 CHADHO C[C@H](NC[C@H]1CCCC[N@@H+](C)C1)c1cc2c(s1)CCC2 ZINC000624122592 1117984946 /nfs/dbraw/zinc/98/49/46/1117984946.db2.gz WKDLXZQFWUSMBR-UONOGXRCSA-N 1 3 292.492 3.619 20 0 CHADHO Cc1ccc([C@H](C)NC[C@@H]2CCCC[N@H+](C)C2)c(C)c1 ZINC000624119550 1117985957 /nfs/dbraw/zinc/98/59/57/1117985957.db2.gz DXJMZTXMBHHISL-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc([C@H](C)NC[C@@H]2CCCC[N@@H+](C)C2)c(C)c1 ZINC000624119550 1117985962 /nfs/dbraw/zinc/98/59/62/1117985962.db2.gz DXJMZTXMBHHISL-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)c(C)c1 ZINC000624119550 1117985966 /nfs/dbraw/zinc/98/59/66/1117985966.db2.gz DXJMZTXMBHHISL-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H]2CCCCC23CCCC3)C1 ZINC000380634502 1118002197 /nfs/dbraw/zinc/00/21/97/1118002197.db2.gz JBQICRLVNHJGFC-IAGOWNOFSA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@@H]2CCCCC23CCCC3)C1 ZINC000380634501 1118002448 /nfs/dbraw/zinc/00/24/48/1118002448.db2.gz JBQICRLVNHJGFC-DLBZAZTESA-N 1 3 278.484 3.809 20 0 CHADHO CC[C@@H](NCC[C@@H]1CCC[N@@H+]1C)c1ccc(C)cc1 ZINC000181711731 1118005032 /nfs/dbraw/zinc/00/50/32/1118005032.db2.gz FQVKEFSNIPWRGK-DLBZAZTESA-N 1 3 260.425 3.520 20 0 CHADHO CC[C@@H](NCC[C@@H]1CCC[N@H+]1C)c1ccc(C)cc1 ZINC000181711731 1118005037 /nfs/dbraw/zinc/00/50/37/1118005037.db2.gz FQVKEFSNIPWRGK-DLBZAZTESA-N 1 3 260.425 3.520 20 0 CHADHO CC[C@@H]([NH2+]CC[C@@H]1CCCN1C)c1ccc(C)cc1 ZINC000181711731 1118005040 /nfs/dbraw/zinc/00/50/40/1118005040.db2.gz FQVKEFSNIPWRGK-DLBZAZTESA-N 1 3 260.425 3.520 20 0 CHADHO CCc1ccc([C@H](CC)[NH2+]C[C@@H]2CCN(CC)C2)cc1 ZINC000037644302 1118033942 /nfs/dbraw/zinc/03/39/42/1118033942.db2.gz OPCSDHWVIFNUBL-WMZOPIPTSA-N 1 3 274.452 3.632 20 0 CHADHO CCc1ccc([C@H](CC)NC[C@@H]2CC[N@H+](CC)C2)cc1 ZINC000037644302 1118033946 /nfs/dbraw/zinc/03/39/46/1118033946.db2.gz OPCSDHWVIFNUBL-WMZOPIPTSA-N 1 3 274.452 3.632 20 0 CHADHO CCc1ccc([C@H](CC)NC[C@@H]2CC[N@@H+](CC)C2)cc1 ZINC000037644302 1118033951 /nfs/dbraw/zinc/03/39/51/1118033951.db2.gz OPCSDHWVIFNUBL-WMZOPIPTSA-N 1 3 274.452 3.632 20 0 CHADHO CCC[C@H]([NH2+]C[C@H](C)CN1CCCCC1)c1cccnc1 ZINC000185081657 1118059848 /nfs/dbraw/zinc/05/98/48/1118059848.db2.gz CXIHRIISZAPJEX-WMZOPIPTSA-N 1 3 289.467 3.634 20 0 CHADHO C[C@H](NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000076446135 1118072664 /nfs/dbraw/zinc/07/26/64/1118072664.db2.gz QDMKBJFKYUIRML-HKUYNNGSSA-N 1 3 294.442 3.859 20 0 CHADHO C[C@H](NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000076446135 1118072668 /nfs/dbraw/zinc/07/26/68/1118072668.db2.gz QDMKBJFKYUIRML-HKUYNNGSSA-N 1 3 294.442 3.859 20 0 CHADHO C[C@@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1cccc(C2CC2)c1 ZINC000340175834 1118099643 /nfs/dbraw/zinc/09/96/43/1118099643.db2.gz RCQZHMSSVNEHPQ-HUUCEWRRSA-N 1 3 284.447 3.699 20 0 CHADHO C[C@@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1cccc(C2CC2)c1 ZINC000340175834 1118099648 /nfs/dbraw/zinc/09/96/48/1118099648.db2.gz RCQZHMSSVNEHPQ-HUUCEWRRSA-N 1 3 284.447 3.699 20 0 CHADHO CC1CCC([NH2+]C2CCN(CC3CCCC3)CC2)CC1 ZINC000236825116 1118119231 /nfs/dbraw/zinc/11/92/31/1118119231.db2.gz BUJFVJDSWVLKSO-UHFFFAOYSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@H](C[NH2+]Cc1cc(-c2ccccc2)cs1)CN(C)C ZINC000312520549 1118150741 /nfs/dbraw/zinc/15/07/41/1118150741.db2.gz OKVRJKVTGFXZEA-CQSZACIVSA-N 1 3 288.460 3.702 20 0 CHADHO C[C@H](Cc1ccc(Cl)cc1)[NH2+][C@@H]1CCC[C@H](N(C)C)C1 ZINC000715491963 1118282592 /nfs/dbraw/zinc/28/25/92/1118282592.db2.gz RPVDTCRILOPBHK-XYPHTWIQSA-N 1 3 294.870 3.733 20 0 CHADHO CCOCC[N@H+](CC[C@@H](C)CC(C)(C)C)C1CCNCC1 ZINC001236459970 1128771033 /nfs/dbraw/zinc/77/10/33/1128771033.db2.gz JNFLAXIMXQCXIH-MRXNPFEDSA-N 1 3 298.515 3.539 20 0 CHADHO CCOCC[N@@H+](CC[C@@H](C)CC(C)(C)C)C1CCNCC1 ZINC001236459970 1128771036 /nfs/dbraw/zinc/77/10/36/1128771036.db2.gz JNFLAXIMXQCXIH-MRXNPFEDSA-N 1 3 298.515 3.539 20 0 CHADHO CCOCCN(CC[C@@H](C)CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236459970 1128771040 /nfs/dbraw/zinc/77/10/40/1128771040.db2.gz JNFLAXIMXQCXIH-MRXNPFEDSA-N 1 3 298.515 3.539 20 0 CHADHO CCOCC[N@H+](CC[C@H](C)CC(C)(C)C)C1CCNCC1 ZINC001236459968 1128771087 /nfs/dbraw/zinc/77/10/87/1128771087.db2.gz JNFLAXIMXQCXIH-INIZCTEOSA-N 1 3 298.515 3.539 20 0 CHADHO CCOCC[N@@H+](CC[C@H](C)CC(C)(C)C)C1CCNCC1 ZINC001236459968 1128771089 /nfs/dbraw/zinc/77/10/89/1128771089.db2.gz JNFLAXIMXQCXIH-INIZCTEOSA-N 1 3 298.515 3.539 20 0 CHADHO CCOCCN(CC[C@H](C)CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236459968 1128771091 /nfs/dbraw/zinc/77/10/91/1128771091.db2.gz JNFLAXIMXQCXIH-INIZCTEOSA-N 1 3 298.515 3.539 20 0 CHADHO C[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1ccc(-c2ccncc2)cc1 ZINC000580062712 1118371297 /nfs/dbraw/zinc/37/12/97/1118371297.db2.gz WNBIXMOMDNSLQL-JVPBZIDWSA-N 1 3 295.430 3.669 20 0 CHADHO CC1CCN(CCC[NH2+]C2C[C@H](C)C[C@@H](C)C2)CC1 ZINC000084463105 1118377549 /nfs/dbraw/zinc/37/75/49/1118377549.db2.gz YOIHECASAMFGLL-HZPDHXFCSA-N 1 3 266.473 3.523 20 0 CHADHO CC[N@@H+](C/C=C\c1ccccc1)CCCN1CCCC1 ZINC000580245225 1118407020 /nfs/dbraw/zinc/40/70/20/1118407020.db2.gz FTUHCKLOBVRJIE-WQLSENKSSA-N 1 3 272.436 3.508 20 0 CHADHO CC[N@H+](C/C=C\c1ccccc1)CCCN1CCCC1 ZINC000580245225 1118407021 /nfs/dbraw/zinc/40/70/21/1118407021.db2.gz FTUHCKLOBVRJIE-WQLSENKSSA-N 1 3 272.436 3.508 20 0 CHADHO C[C@@H]([NH2+][C@H](CN)C1CC1)c1cc2c(ccc3ccccc23)o1 ZINC000580301816 1118415078 /nfs/dbraw/zinc/41/50/78/1118415078.db2.gz NGHWEBONKDLTKB-SJKOYZFVSA-N 1 3 294.398 3.974 20 0 CHADHO CC[N@H+](CCCN1CCCC1)Cc1ccnc2ccccc12 ZINC000580378982 1118440995 /nfs/dbraw/zinc/44/09/95/1118440995.db2.gz GWLWSOGFCWFCPJ-UHFFFAOYSA-N 1 3 297.446 3.543 20 0 CHADHO CC[N@@H+](CCCN1CCCC1)Cc1ccnc2ccccc12 ZINC000580378982 1118440996 /nfs/dbraw/zinc/44/09/96/1118440996.db2.gz GWLWSOGFCWFCPJ-UHFFFAOYSA-N 1 3 297.446 3.543 20 0 CHADHO C[C@H]([NH3+])[C@@H]1CCCN(Cc2ccc(-c3ccccc3)cc2)C1 ZINC000262001658 1118479007 /nfs/dbraw/zinc/47/90/07/1118479007.db2.gz VFWWKGCVSNQRGP-OXJNMPFZSA-N 1 3 294.442 3.913 20 0 CHADHO CC[N@H+](CCCN1CCCC1)Cc1coc2ccccc12 ZINC000349383284 1118560849 /nfs/dbraw/zinc/56/08/49/1118560849.db2.gz KWZBTCNGAZSNMC-UHFFFAOYSA-N 1 3 286.419 3.741 20 0 CHADHO CC[N@@H+](CCCN1CCCC1)Cc1coc2ccccc12 ZINC000349383284 1118560851 /nfs/dbraw/zinc/56/08/51/1118560851.db2.gz KWZBTCNGAZSNMC-UHFFFAOYSA-N 1 3 286.419 3.741 20 0 CHADHO C[C@H]1c2ccsc2CCN1Cc1cccc2c1CC[NH2+]C2 ZINC000123945977 1118577487 /nfs/dbraw/zinc/57/74/87/1118577487.db2.gz OUPDMDOBIXFJPY-ZDUSSCGKSA-N 1 3 298.455 3.513 20 0 CHADHO C[C@H](C[NH2+][C@@H]1C[C@H](C)CC(C)(C)C1)CN1CCCCC1 ZINC000109920601 1118588952 /nfs/dbraw/zinc/58/89/52/1118588952.db2.gz NZNRRXHMXBVCHW-GVDBMIGSSA-N 1 3 280.500 3.913 20 0 CHADHO C[C@@H]1C[C@@H]([NH3+])CCN1Cc1ccc(-c2ccccc2)cc1 ZINC000129021495 1118752371 /nfs/dbraw/zinc/75/23/71/1118752371.db2.gz ZEXOKJBPLQKHCH-BEFAXECRSA-N 1 3 280.415 3.665 20 0 CHADHO C(C1CCCC1)N1CCC([NH2+][C@@H]2CC[C@H]2C2CCC2)CC1 ZINC000510668664 1118786297 /nfs/dbraw/zinc/78/62/97/1118786297.db2.gz STWTZKBVZNWGDL-RBUKOAKNSA-N 1 3 290.495 3.809 20 0 CHADHO CCC[NH+]1CCC(N(C)CCc2ccc(Cl)cc2)CC1 ZINC000445210800 1118870203 /nfs/dbraw/zinc/87/02/03/1118870203.db2.gz IXIMYHGUMSAVTN-UHFFFAOYSA-N 1 3 294.870 3.689 20 0 CHADHO CC(C)(C[NH2+][C@H]1CCC[C@@H]1CCCF)CN1CCCC1 ZINC000511031371 1118962044 /nfs/dbraw/zinc/96/20/44/1118962044.db2.gz QLPWTPHEXWBCTF-CVEARBPZSA-N 1 3 284.463 3.616 20 0 CHADHO CN1CCCC[C@@H]1CC[N@H+](C)Cc1ccccc1C1CC1 ZINC001167509985 1118973141 /nfs/dbraw/zinc/97/31/41/1118973141.db2.gz RZBOEVCJXJULDQ-GOSISDBHSA-N 1 3 286.463 3.870 20 0 CHADHO CN1CCCC[C@@H]1CC[N@@H+](C)Cc1ccccc1C1CC1 ZINC001167509985 1118973142 /nfs/dbraw/zinc/97/31/42/1118973142.db2.gz RZBOEVCJXJULDQ-GOSISDBHSA-N 1 3 286.463 3.870 20 0 CHADHO C[C@@H]1C[C@@H](NCc2cccc(C3CCCC3)c2)CC[N@@H+]1C ZINC000657376469 1119040711 /nfs/dbraw/zinc/04/07/11/1119040711.db2.gz RADBEBPCCIAQAA-BEFAXECRSA-N 1 3 286.463 3.917 20 0 CHADHO C[C@@H]1C[C@@H](NCc2cccc(C3CCCC3)c2)CC[N@H+]1C ZINC000657376469 1119040715 /nfs/dbraw/zinc/04/07/15/1119040715.db2.gz RADBEBPCCIAQAA-BEFAXECRSA-N 1 3 286.463 3.917 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H]2C[C@H](c3ccccc3)C2(C)C)C1 ZINC000122956040 1119289117 /nfs/dbraw/zinc/28/91/17/1119289117.db2.gz JLWZNUVIVOXXOD-CGTJXYLNSA-N 1 3 286.463 3.500 20 0 CHADHO c1cc2c(cccc2CN[C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)[nH]1 ZINC000635011988 1119368650 /nfs/dbraw/zinc/36/86/50/1119368650.db2.gz IOXCMPBXMKVRIN-NZSAHSFTSA-N 1 3 297.446 3.568 20 0 CHADHO CSCCCCCCN[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000235166989 1119394039 /nfs/dbraw/zinc/39/40/39/1119394039.db2.gz IISHRQJNAYJLON-CVEARBPZSA-N 1 3 278.465 3.644 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H](C)c2cccc(C)c2C)C1 ZINC000151102573 1119396541 /nfs/dbraw/zinc/39/65/41/1119396541.db2.gz WBFDNUFEZKKSKL-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H](C)c2cccc(C)c2C)C1 ZINC000151102573 1119396543 /nfs/dbraw/zinc/39/65/43/1119396543.db2.gz WBFDNUFEZKKSKL-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@@H](C)c1ccc(Cl)cc1 ZINC000650759244 1119417472 /nfs/dbraw/zinc/41/74/72/1119417472.db2.gz HHGDDFQSTZPXIR-ZDUSSCGKSA-N 1 3 288.822 3.910 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCCC[C@@H]1C)C(C)(C)C(F)F ZINC000657824547 1119468665 /nfs/dbraw/zinc/46/86/65/1119468665.db2.gz UOCTXSGOHRWBDX-QWHCGFSZSA-N 1 3 276.415 3.520 20 0 CHADHO Cc1cc(CN[C@@H](C)c2cccc(C[NH+](C)C)c2)cc(C)n1 ZINC000926601374 1119625435 /nfs/dbraw/zinc/62/54/35/1119625435.db2.gz NTARKFNLXQJLFW-INIZCTEOSA-N 1 3 297.446 3.611 20 0 CHADHO C[C@@H]1CCCC[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000132185812 1119653732 /nfs/dbraw/zinc/65/37/32/1119653732.db2.gz ZILPDEQVNLOXDW-QAPCUYQASA-N 1 3 278.484 3.952 20 0 CHADHO C[C@@H](CC[NH2+][C@@H](C)C(C)(C)C(F)F)N1CCCCC1 ZINC000657973305 1119657668 /nfs/dbraw/zinc/65/76/68/1119657668.db2.gz PQJGHMIQGLMOSI-STQMWFEESA-N 1 3 276.415 3.520 20 0 CHADHO CC[C@@H]([NH2+]C1CCN(C2CCCC2)CC1)[C@@H]1CC1(C)C ZINC000414116363 1119904870 /nfs/dbraw/zinc/90/48/70/1119904870.db2.gz QRGCNSDKCMHIGR-DLBZAZTESA-N 1 3 278.484 3.808 20 0 CHADHO CC[C@H]1CCC[C@@H](C[N@@H+]2CCCC23CCN(C)CC3)C1 ZINC000472595308 1119997344 /nfs/dbraw/zinc/99/73/44/1119997344.db2.gz FACKCQUKJVYBSA-DLBZAZTESA-N 1 3 278.484 3.763 20 0 CHADHO CC[C@H]1CCC[C@@H](C[N@H+]2CCCC23CCN(C)CC3)C1 ZINC000472595308 1119997347 /nfs/dbraw/zinc/99/73/47/1119997347.db2.gz FACKCQUKJVYBSA-DLBZAZTESA-N 1 3 278.484 3.763 20 0 CHADHO Clc1ccc(CN2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)s1 ZINC000647543224 1120004616 /nfs/dbraw/zinc/00/46/16/1120004616.db2.gz JQVZKISHFQNFTH-STQMWFEESA-N 1 3 298.883 3.613 20 0 CHADHO CC(C)CCC[C@@H](C)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000624120779 1120066048 /nfs/dbraw/zinc/06/60/48/1120066048.db2.gz GWJCFKLOZJORDE-CVEARBPZSA-N 1 3 254.462 3.523 20 0 CHADHO CN1CCCC[C@@H](C[NH2+][C@@H]2CCc3c2cccc3Cl)C1 ZINC000624121151 1120074634 /nfs/dbraw/zinc/07/46/34/1120074634.db2.gz PFJWVGCUEKBJEA-SUMWQHHRSA-N 1 3 292.854 3.649 20 0 CHADHO CC(C)C1CCC([NH2+][C@H]2CCC[C@@H](N(C)C)C2)CC1 ZINC000715544789 1120110935 /nfs/dbraw/zinc/11/09/35/1120110935.db2.gz SHHIUQPJYRFDOR-SJJHQCBESA-N 1 3 266.473 3.664 20 0 CHADHO C=Cc1ccc(CC[NH2+]C2CCN(C(C)(C)C)CC2)cc1 ZINC000462823139 1120208934 /nfs/dbraw/zinc/20/89/34/1120208934.db2.gz ZDNPXXBOFATBFJ-UHFFFAOYSA-N 1 3 286.463 3.725 20 0 CHADHO FC(F)(F)CCN1CCC(C[NH+]2CCCCCC2)CC1 ZINC000077265202 1120321018 /nfs/dbraw/zinc/32/10/18/1120321018.db2.gz SMRGINKTUADHNR-UHFFFAOYSA-N 1 3 292.389 3.527 20 0 CHADHO C[C@@H]1CC[NH2+]CC[C@H]1N[C@H]1CCCc2ccc(Cl)cc21 ZINC000629549001 1128914673 /nfs/dbraw/zinc/91/46/73/1128914673.db2.gz PJMHHRMLMGUKKA-JLZZUVOBSA-N 1 3 292.854 3.695 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417310959 1120425657 /nfs/dbraw/zinc/42/56/57/1120425657.db2.gz LDGMHMFNHODAGX-ARKGTOAJSA-N 1 3 292.492 3.703 20 0 CHADHO C[C@H](N[C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(C2CC2)cc1 ZINC000417356887 1120435667 /nfs/dbraw/zinc/43/56/67/1120435667.db2.gz QNRJSGXHKSMEFO-DEYYWGMASA-N 1 3 272.436 3.697 20 0 CHADHO C[C@H](N[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(C2CC2)cc1 ZINC000417356887 1120435669 /nfs/dbraw/zinc/43/56/69/1120435669.db2.gz QNRJSGXHKSMEFO-DEYYWGMASA-N 1 3 272.436 3.697 20 0 CHADHO C[C@H]([NH2+]CCCC1CCC1)[C@H]1CCCN(C2CCC2)C1 ZINC000660255338 1120467746 /nfs/dbraw/zinc/46/77/46/1120467746.db2.gz BIKHNUHUVDQPIM-RDJZCZTQSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@H](C[NH2+][C@@H](Cc1ccccc1)c1ccccc1)CN(C)C ZINC000390708389 1120609406 /nfs/dbraw/zinc/60/94/06/1120609406.db2.gz GZZYEJWITHBSFQ-XLIONFOSSA-N 1 3 296.458 3.758 20 0 CHADHO C[C@H](CN[C@@H](Cc1ccccc1)c1ccccc1)C[NH+](C)C ZINC000390708389 1120609409 /nfs/dbraw/zinc/60/94/09/1120609409.db2.gz GZZYEJWITHBSFQ-XLIONFOSSA-N 1 3 296.458 3.758 20 0 CHADHO CC[C@H](CN[C@H](c1ccccc1)[C@H](C)[NH3+])CC(F)(F)F ZINC000925697426 1120622719 /nfs/dbraw/zinc/62/27/19/1120622719.db2.gz NLOWJSCFNRWVCD-OBJOEFQTSA-N 1 3 288.357 3.643 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H]2CCCCC[C@H]2C)C1 ZINC000651706115 1120717080 /nfs/dbraw/zinc/71/70/80/1120717080.db2.gz TUBYIHJEDTZSGA-BRWVUGGUSA-N 1 3 266.473 3.665 20 0 CHADHO CC1=C[C@H](C)CN(CC[C@H](C)[N@H+]2CC(C)=C[C@H](C)C2)C1 ZINC000430264919 1120854876 /nfs/dbraw/zinc/85/48/76/1120854876.db2.gz CDQPZDHTPDYCRJ-ZVZYQTTQSA-N 1 3 276.468 3.561 20 0 CHADHO CC1=C[C@H](C)CN(CC[C@H](C)[N@@H+]2CC(C)=C[C@H](C)C2)C1 ZINC000430264919 1120854878 /nfs/dbraw/zinc/85/48/78/1120854878.db2.gz CDQPZDHTPDYCRJ-ZVZYQTTQSA-N 1 3 276.468 3.561 20 0 CHADHO CC1=C[C@H](C)CN([C@@H](C)CC[N@H+]2CC(C)=C[C@H](C)C2)C1 ZINC000430264919 1120854880 /nfs/dbraw/zinc/85/48/80/1120854880.db2.gz CDQPZDHTPDYCRJ-ZVZYQTTQSA-N 1 3 276.468 3.561 20 0 CHADHO CC1=C[C@H](C)CN([C@@H](C)CC[N@@H+]2CC(C)=C[C@H](C)C2)C1 ZINC000430264919 1120854882 /nfs/dbraw/zinc/85/48/82/1120854882.db2.gz CDQPZDHTPDYCRJ-ZVZYQTTQSA-N 1 3 276.468 3.561 20 0 CHADHO C[C@H](CC[NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1ccccc1 ZINC000248827283 1120878810 /nfs/dbraw/zinc/87/88/10/1120878810.db2.gz GOUXCNCLAUXLJV-KBAYOESNSA-N 1 3 274.452 3.643 20 0 CHADHO CC1(C)CNCC[C@H]1[NH2+]C[C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000662277911 1120918033 /nfs/dbraw/zinc/91/80/33/1120918033.db2.gz TXMMIEHPFZJSQH-KBAYOESNSA-N 1 3 286.463 3.548 20 0 CHADHO CC(C)c1nc(CN2CCC[C@@H](C)[C@H]2CCC[NH3+])cs1 ZINC000662311538 1120924316 /nfs/dbraw/zinc/92/43/16/1120924316.db2.gz BSHMWOWYNUUVTI-UKRRQHHQSA-N 1 3 295.496 3.606 20 0 CHADHO c1ccc2c(c1)CCC[C@H]2NC[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663469085 1120982901 /nfs/dbraw/zinc/98/29/01/1120982901.db2.gz OEDLXFBKCQHKSW-FXAWDEMLSA-N 1 3 298.474 3.776 20 0 CHADHO c1ccc2c(c1)CCC[C@H]2NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663469085 1120982903 /nfs/dbraw/zinc/98/29/03/1120982903.db2.gz OEDLXFBKCQHKSW-FXAWDEMLSA-N 1 3 298.474 3.776 20 0 CHADHO CC(C)[C@@H](N[C@@H]1CC[NH2+]C2(CCC2)C1)c1ccccc1 ZINC000643547896 1121011746 /nfs/dbraw/zinc/01/17/46/1121011746.db2.gz KMQPJIMZYXRAIR-IAGOWNOFSA-N 1 3 272.436 3.648 20 0 CHADHO CC(C)[C@@H]([NH2+][C@@H]1CCNC2(CCC2)C1)c1ccccc1 ZINC000643547896 1121011750 /nfs/dbraw/zinc/01/17/50/1121011750.db2.gz KMQPJIMZYXRAIR-IAGOWNOFSA-N 1 3 272.436 3.648 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N1CCC[C@@H]1c1nccs1 ZINC001167836462 1121039264 /nfs/dbraw/zinc/03/92/64/1121039264.db2.gz DTEDEJYDGJMQRG-LSDHHAIUSA-N 1 3 295.496 3.791 20 0 CHADHO CC[NH+]1CCC(N[C@H](C)c2ccc3ccccc3c2)CC1 ZINC000037977243 1121096120 /nfs/dbraw/zinc/09/61/20/1121096120.db2.gz PUBLCAVSFXVVHD-OAHLLOKOSA-N 1 3 282.431 3.975 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2sc(C(C)C)nc2C)C1 ZINC000163234109 1121176904 /nfs/dbraw/zinc/17/69/04/1121176904.db2.gz HGLRBDIOBWQSAX-JSGCOSHPSA-N 1 3 295.496 3.567 20 0 CHADHO CN(CC[C@H]1CCCC[N@@H+]1C)[C@@H]1CCCc2ccccc21 ZINC000674771514 1121178949 /nfs/dbraw/zinc/17/89/49/1121178949.db2.gz OBVJDOMEUXUQBK-IEBWSBKVSA-N 1 3 286.463 3.870 20 0 CHADHO CN(CC[C@H]1CCCC[N@H+]1C)[C@@H]1CCCc2ccccc21 ZINC000674771514 1121178951 /nfs/dbraw/zinc/17/89/51/1121178951.db2.gz OBVJDOMEUXUQBK-IEBWSBKVSA-N 1 3 286.463 3.870 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)N1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000063197558 1121201508 /nfs/dbraw/zinc/20/15/08/1121201508.db2.gz GHMVCXRETYAAIH-CXAGYDPISA-N 1 3 292.854 3.865 20 0 CHADHO CN(C)C1(C)CC[NH+](C[C@@H]2CCCCC2(C)C)CC1 ZINC001175398175 1121291585 /nfs/dbraw/zinc/29/15/85/1121291585.db2.gz ARBNDPQLIPMSCN-HNNXBMFYSA-N 1 3 266.473 3.619 20 0 CHADHO CCC[C@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000675723157 1121348605 /nfs/dbraw/zinc/34/86/05/1121348605.db2.gz YBFDHVKCYRVSRD-AWEZNQCLSA-N 1 3 252.446 3.562 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC(C)(C)c2ccccc2)CC1 ZINC000675744164 1121353269 /nfs/dbraw/zinc/35/32/69/1121353269.db2.gz FHZQTPXDFASYKE-UHFFFAOYSA-N 1 3 288.479 3.817 20 0 CHADHO CC(C)(C)c1cc(Nc2ccc(C[NH3+])cc2)ccn1 ZINC001175966021 1121506117 /nfs/dbraw/zinc/50/61/17/1121506117.db2.gz DMVIVZJYPZIRLQ-UHFFFAOYSA-N 1 3 255.365 3.581 20 0 CHADHO CC(C)CCC[N@@H+]1CCC[C@@H](N2[C@H](C)CC[C@@H]2C)C1 ZINC000429324989 1121527875 /nfs/dbraw/zinc/52/78/75/1121527875.db2.gz GXMVEPCUCUXZSU-IXDOHACOSA-N 1 3 266.473 3.760 20 0 CHADHO CC(C)CCC[N@H+]1CCC[C@@H](N2[C@H](C)CC[C@@H]2C)C1 ZINC000429324989 1121527882 /nfs/dbraw/zinc/52/78/82/1121527882.db2.gz GXMVEPCUCUXZSU-IXDOHACOSA-N 1 3 266.473 3.760 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@@H+]1CCC[C@](C)(N)C1 ZINC001204939033 1121755821 /nfs/dbraw/zinc/75/58/21/1121755821.db2.gz PENPFZSAISFXLM-CVEARBPZSA-N 1 3 252.446 3.572 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@H+]1CCC[C@](C)(N)C1 ZINC001204939033 1121755828 /nfs/dbraw/zinc/75/58/28/1121755828.db2.gz PENPFZSAISFXLM-CVEARBPZSA-N 1 3 252.446 3.572 20 0 CHADHO CC(C)(CCN1CCCC[C@@](F)(C[NH3+])C1)c1ccccc1 ZINC001206337294 1121803045 /nfs/dbraw/zinc/80/30/45/1121803045.db2.gz SDMBVWSYYRELND-GOSISDBHSA-N 1 3 292.442 3.507 20 0 CHADHO CCCCCC[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC000149614730 1121822607 /nfs/dbraw/zinc/82/26/07/1121822607.db2.gz ARKFVRRNAANDQX-UHFFFAOYSA-N 1 3 254.462 3.808 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@@H]1CC[C@H](Cc2ccccc2)C1 ZINC000436278824 1121833773 /nfs/dbraw/zinc/83/37/73/1121833773.db2.gz DYXJVUNNLBVWKG-RTBURBONSA-N 1 3 288.479 3.718 20 0 CHADHO CC1(C)CCC[C@H]([NH2+]C[C@@H]2CCCN(CC3CC3)C2)C1 ZINC001179259528 1121866746 /nfs/dbraw/zinc/86/67/46/1121866746.db2.gz UTKWSZGSUMOJAZ-IRXDYDNUSA-N 1 3 278.484 3.667 20 0 CHADHO CCC[C@H](C)[N@@H+]1CCC[C@H](CN2CCC(C)CC2)C1 ZINC000501152279 1121960442 /nfs/dbraw/zinc/96/04/42/1121960442.db2.gz WZLKPTFPCUJIAQ-DLBZAZTESA-N 1 3 266.473 3.619 20 0 CHADHO CCC[C@H](C)[N@H+]1CCC[C@H](CN2CCC(C)CC2)C1 ZINC000501152279 1121960447 /nfs/dbraw/zinc/96/04/47/1121960447.db2.gz WZLKPTFPCUJIAQ-DLBZAZTESA-N 1 3 266.473 3.619 20 0 CHADHO CC[NH+]1CCC(N(C)[C@@H](C)c2nccc3ccccc32)CC1 ZINC001180531027 1121994371 /nfs/dbraw/zinc/99/43/71/1121994371.db2.gz BLQHHHFQGNGNOV-HNNXBMFYSA-N 1 3 297.446 3.712 20 0 CHADHO CCCN(CCC[NH+](C)C)Cc1c(C)[nH]c2ccccc21 ZINC001204292410 1122041940 /nfs/dbraw/zinc/04/19/40/1122041940.db2.gz BXKSMVDAVIZHDS-UHFFFAOYSA-N 1 3 287.451 3.640 20 0 CHADHO C[C@]12C[C@H]1CCC[C@H]2[NH2+]C1CCN(C2CCCC2)CC1 ZINC000502281443 1122069608 /nfs/dbraw/zinc/06/96/08/1122069608.db2.gz AOHXOFJNCYHVOB-OLMNPRSZSA-N 1 3 276.468 3.562 20 0 CHADHO CCN(CC)CCC[NH2+][C@H](C)CCc1ccc(F)cc1F ZINC000513758577 1122152022 /nfs/dbraw/zinc/15/20/22/1122152022.db2.gz AASOQRCEABVORW-CQSZACIVSA-N 1 3 298.421 3.607 20 0 CHADHO CCC[C@H](Cc1ccccc1)[NH2+]C[C@H]1CCCCN(C)C1 ZINC001182903021 1122194662 /nfs/dbraw/zinc/19/46/62/1122194662.db2.gz VRFKTEINQBLWCH-RTBURBONSA-N 1 3 288.479 3.719 20 0 CHADHO CN1C[C@@H]2CC[C@@H]([NH2+]C3CCC(c4ccccc4)CC3)[C@H]2C1 ZINC001184387482 1122272894 /nfs/dbraw/zinc/27/28/94/1122272894.db2.gz LFGSNAGWLOPSSI-KPZODNFCSA-N 1 3 298.474 3.643 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@@H](C)[C@H]1CC2CCC1CC2 ZINC001184419352 1122276160 /nfs/dbraw/zinc/27/61/60/1122276160.db2.gz ZUMOFLXZDQXTGS-NRNWYNIKSA-N 1 3 280.500 3.911 20 0 CHADHO CC[C@@H]1CN(CCCc2cccc3ccccc32)CC[C@H]1[NH3+] ZINC000647936281 1122309064 /nfs/dbraw/zinc/30/90/64/1122309064.db2.gz ATUGROIZTGPUIP-OXQOHEQNSA-N 1 3 296.458 3.832 20 0 CHADHO CC[C@@H]1C[N@H+](CCCc2cccc3ccccc32)CC[C@H]1N ZINC000647936281 1122309070 /nfs/dbraw/zinc/30/90/70/1122309070.db2.gz ATUGROIZTGPUIP-OXQOHEQNSA-N 1 3 296.458 3.832 20 0 CHADHO CC[C@@H]1C[N@@H+](CCCc2cccc3ccccc32)CC[C@H]1N ZINC000647936281 1122309075 /nfs/dbraw/zinc/30/90/75/1122309075.db2.gz ATUGROIZTGPUIP-OXQOHEQNSA-N 1 3 296.458 3.832 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H]2C[C@@H](C)c3c2cccc3C)C1 ZINC000504895196 1122309572 /nfs/dbraw/zinc/30/95/72/1122309572.db2.gz RMHDKDKTGVHYFW-JFIYKMOQSA-N 1 3 286.463 3.865 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H]2C[C@@H](C)c3c2cccc3C)C1 ZINC000504895196 1122309583 /nfs/dbraw/zinc/30/95/83/1122309583.db2.gz RMHDKDKTGVHYFW-JFIYKMOQSA-N 1 3 286.463 3.865 20 0 CHADHO CC(C)[C@H](c1ccc(F)cc1)N(C)CC[C@@H]1CCC[N@@H+]1C ZINC000434623342 1122385701 /nfs/dbraw/zinc/38/57/01/1122385701.db2.gz LCEXWPIAPJFCIX-ZWKOTPCHSA-N 1 3 292.442 3.939 20 0 CHADHO CC(C)[C@H](c1ccc(F)cc1)N(C)CC[C@@H]1CCC[N@H+]1C ZINC000434623342 1122385705 /nfs/dbraw/zinc/38/57/05/1122385705.db2.gz LCEXWPIAPJFCIX-ZWKOTPCHSA-N 1 3 292.442 3.939 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H]2CC[C@H](c3ccccc3)C2)C1 ZINC000436285497 1122530732 /nfs/dbraw/zinc/53/07/32/1122530732.db2.gz PVZDDYRWWAQGSV-NEWSRXKRSA-N 1 3 286.463 3.644 20 0 CHADHO C[C@@H]1C[C@@H]2CCCC[C@H]2N1CC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001191076088 1122569522 /nfs/dbraw/zinc/56/95/22/1122569522.db2.gz GASNIWNITICOHT-MDMSPXHWSA-N 1 3 278.484 3.617 20 0 CHADHO C[C@@H]1C[C@@H]2CCCC[C@H]2N1CC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001191076088 1122569525 /nfs/dbraw/zinc/56/95/25/1122569525.db2.gz GASNIWNITICOHT-MDMSPXHWSA-N 1 3 278.484 3.617 20 0 CHADHO CC(C)=CCCN1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC001191048441 1122571137 /nfs/dbraw/zinc/57/11/37/1122571137.db2.gz OBCIDHVQFFGDGK-QZTJIDSGSA-N 1 3 278.484 3.929 20 0 CHADHO CC(C)=CCCN1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC001191048441 1122571132 /nfs/dbraw/zinc/57/11/32/1122571132.db2.gz OBCIDHVQFFGDGK-QZTJIDSGSA-N 1 3 278.484 3.929 20 0 CHADHO CC(C)=CCCN1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC001191048439 1122571259 /nfs/dbraw/zinc/57/12/59/1122571259.db2.gz OBCIDHVQFFGDGK-MSOLQXFVSA-N 1 3 278.484 3.929 20 0 CHADHO CC(C)=CCCN1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC001191048439 1122571262 /nfs/dbraw/zinc/57/12/62/1122571262.db2.gz OBCIDHVQFFGDGK-MSOLQXFVSA-N 1 3 278.484 3.929 20 0 CHADHO CCCCOc1ccc([C@H](C)[NH2+]C[C@H](C)CN(C)C)cc1 ZINC000425933764 1122662577 /nfs/dbraw/zinc/66/25/77/1122662577.db2.gz WRAGBAJVHMGVSA-HOTGVXAUSA-N 1 3 292.467 3.714 20 0 CHADHO C[C@H](Cc1ccccc1F)[NH2+]CC[C@@H](C)N1CCCCC1 ZINC000437994821 1122670385 /nfs/dbraw/zinc/67/03/85/1122670385.db2.gz QFNQDKZMTHKNRD-HZPDHXFCSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@H](Cc1ccccc1F)NCC[C@@H](C)[NH+]1CCCCC1 ZINC000437994821 1122670387 /nfs/dbraw/zinc/67/03/87/1122670387.db2.gz QFNQDKZMTHKNRD-HZPDHXFCSA-N 1 3 292.442 3.611 20 0 CHADHO CCC1CCC([NH2+]C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001167963805 1122760495 /nfs/dbraw/zinc/76/04/95/1122760495.db2.gz FAHLSGRZVPRURC-PDTIQJOESA-N 1 3 290.495 3.950 20 0 CHADHO C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1)C1CCCCC1 ZINC001167968990 1122851960 /nfs/dbraw/zinc/85/19/60/1122851960.db2.gz XUEZBXDRAGGUHT-FMJMRLDVSA-N 1 3 290.495 3.950 20 0 CHADHO CC[N@H+](CCCN1CCCC1)Cc1ccc(C)c(Cl)c1 ZINC001205693739 1122856383 /nfs/dbraw/zinc/85/63/83/1122856383.db2.gz ZCNYZNUGDQQKCT-UHFFFAOYSA-N 1 3 294.870 3.956 20 0 CHADHO CC[N@@H+](CCCN1CCCC1)Cc1ccc(C)c(Cl)c1 ZINC001205693739 1122856390 /nfs/dbraw/zinc/85/63/90/1122856390.db2.gz ZCNYZNUGDQQKCT-UHFFFAOYSA-N 1 3 294.870 3.956 20 0 CHADHO CC1(C)CCC([NH2+]C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001167970830 1122861962 /nfs/dbraw/zinc/86/19/62/1122861962.db2.gz OLPURBSCKDRIHK-AYHJJNSGSA-N 1 3 290.495 3.950 20 0 CHADHO C(C1CC1)N1[C@@H]2CC[C@H]1CC([NH2+][C@H]1CCCC13CCC3)C2 ZINC001167981906 1122897816 /nfs/dbraw/zinc/89/78/16/1122897816.db2.gz OTCZFEGNTKVGGA-FBVQUNGASA-N 1 3 288.479 3.704 20 0 CHADHO CC(C)C[C@H](C)CN1CCC(C)([NH+]2CCCC2)CC1 ZINC001196684933 1122930973 /nfs/dbraw/zinc/93/09/73/1122930973.db2.gz QKXPBSSMDTXCGJ-INIZCTEOSA-N 1 3 266.473 3.619 20 0 CHADHO CC[C@@H]([NH2+]CC[C@@H]1CCCN1C)c1cc(C)ccc1C ZINC001196944218 1122940998 /nfs/dbraw/zinc/94/09/98/1122940998.db2.gz UHOSXHKWNRHMFV-FUHWJXTLSA-N 1 3 274.452 3.828 20 0 CHADHO CC[C@@H](NCC[C@@H]1CCC[N@@H+]1C)c1cc(C)ccc1C ZINC001196944218 1122941002 /nfs/dbraw/zinc/94/10/02/1122941002.db2.gz UHOSXHKWNRHMFV-FUHWJXTLSA-N 1 3 274.452 3.828 20 0 CHADHO CC[C@@H](NCC[C@@H]1CCC[N@H+]1C)c1cc(C)ccc1C ZINC001196944218 1122941005 /nfs/dbraw/zinc/94/10/05/1122941005.db2.gz UHOSXHKWNRHMFV-FUHWJXTLSA-N 1 3 274.452 3.828 20 0 CHADHO CC1(C)CCC[C@H]([NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000136285188 1122944240 /nfs/dbraw/zinc/94/42/40/1122944240.db2.gz NSPPQJZQZOVGCR-INIZCTEOSA-N 1 3 278.484 3.952 20 0 CHADHO CCC[C@H](C)CCCN1CCN(c2cc[nH+]cc2)C[C@@H]1C ZINC001197931068 1122974029 /nfs/dbraw/zinc/97/40/29/1122974029.db2.gz UXFZCQTVRBSLEJ-IRXDYDNUSA-N 1 3 289.467 3.809 20 0 CHADHO CCC[C@H](C)CCC[N@@H+]1CCN(c2ccncc2)C[C@@H]1C ZINC001197931068 1122974033 /nfs/dbraw/zinc/97/40/33/1122974033.db2.gz UXFZCQTVRBSLEJ-IRXDYDNUSA-N 1 3 289.467 3.809 20 0 CHADHO CCC[C@H](C)CCC[N@H+]1CCN(c2ccncc2)C[C@@H]1C ZINC001197931068 1122974038 /nfs/dbraw/zinc/97/40/38/1122974038.db2.gz UXFZCQTVRBSLEJ-IRXDYDNUSA-N 1 3 289.467 3.809 20 0 CHADHO CCCC[N@H+](CCC)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167993784 1123099381 /nfs/dbraw/zinc/09/93/81/1123099381.db2.gz SIQXGVZHYSEUIQ-JWTNVVGKSA-N 1 3 278.484 3.904 20 0 CHADHO CCCC[N@@H+](CCC)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167993784 1123099383 /nfs/dbraw/zinc/09/93/83/1123099383.db2.gz SIQXGVZHYSEUIQ-JWTNVVGKSA-N 1 3 278.484 3.904 20 0 CHADHO CCC[C@@H](C)C[N@@H+]1CCCC[C@H]1C[C@@H]1CCCN1C ZINC001201552086 1123118974 /nfs/dbraw/zinc/11/89/74/1123118974.db2.gz JHHGDKFQBZZRMM-IKGGRYGDSA-N 1 3 266.473 3.761 20 0 CHADHO CCC[C@@H](C)C[N@H+]1CCCC[C@H]1C[C@@H]1CCCN1C ZINC001201552086 1123118976 /nfs/dbraw/zinc/11/89/76/1123118976.db2.gz JHHGDKFQBZZRMM-IKGGRYGDSA-N 1 3 266.473 3.761 20 0 CHADHO C[C@H](CC[NH2+][C@H]1CC[C@@H](C)[C@H](C)C1)N1CCCCC1 ZINC001201954002 1123162212 /nfs/dbraw/zinc/16/22/12/1123162212.db2.gz CTLCLIPLHKTQJU-VQHPVUNQSA-N 1 3 266.473 3.665 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2C[C@H](C)CC[C@H]2CC)C1 ZINC000430732712 1123213778 /nfs/dbraw/zinc/21/37/78/1123213778.db2.gz PYEXRVFNFFGMPE-QBPKDAKJSA-N 1 3 266.473 3.523 20 0 CHADHO [NH3+][C@H]1CCC[C@H](NCc2ccc(-c3cccs3)cc2)C1 ZINC000665238512 1123241337 /nfs/dbraw/zinc/24/13/37/1123241337.db2.gz ZXEUCOLERXXIMY-HOTGVXAUSA-N 1 3 286.444 3.775 20 0 CHADHO CC[NH+]1CCC(N[C@@H]2CCc3ccc(C(C)C)cc32)CC1 ZINC000427866582 1123256890 /nfs/dbraw/zinc/25/68/90/1123256890.db2.gz LZBFESGAWGDQOJ-LJQANCHMSA-N 1 3 286.463 3.871 20 0 CHADHO CC[C@H]([NH2+]CC1(N)CCCC1)c1ccc(OC(F)F)cc1 ZINC000665249707 1123263458 /nfs/dbraw/zinc/26/34/58/1123263458.db2.gz XEUZDLGCYCGELY-AWEZNQCLSA-N 1 3 298.377 3.600 20 0 CHADHO [NH3+][C@@H]1C[C@H](NCC2CCC(F)(F)CC2)c2ccccc21 ZINC000335021912 1123291367 /nfs/dbraw/zinc/29/13/67/1123291367.db2.gz KTHCGQIQRDJURX-CABCVRRESA-N 1 3 280.362 3.546 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+][C@H]1CCC12CCCC2 ZINC000474031305 1123304472 /nfs/dbraw/zinc/30/44/72/1123304472.db2.gz IHHLPERERZQQID-CVEARBPZSA-N 1 3 264.457 3.563 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@@H](C)c1ccc(-c2ccncc2)cc1 ZINC000665280992 1123312793 /nfs/dbraw/zinc/31/27/93/1123312793.db2.gz RESGVGJPNGBUAF-HNAYVOBHSA-N 1 3 297.446 3.773 20 0 CHADHO C[C@H]1CCC[C@@H]1C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000467442420 1123319109 /nfs/dbraw/zinc/31/91/09/1123319109.db2.gz FULAOZYQGASBBT-JKSUJKDBSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)C1CCC(F)(F)CC1 ZINC000474059249 1123406592 /nfs/dbraw/zinc/40/65/92/1123406592.db2.gz NYKUSFRUWIUPKP-NWANDNLSSA-N 1 3 288.426 3.663 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1C[N@@H+]1CC[C@@H](CN(C)CC2CC2)C1 ZINC000443641869 1123456571 /nfs/dbraw/zinc/45/65/71/1123456571.db2.gz MRBLKZGEDCDJHB-WDSOQIARSA-N 1 3 290.495 3.643 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1C[N@H+]1CC[C@@H](CN(C)CC2CC2)C1 ZINC000443641869 1123456574 /nfs/dbraw/zinc/45/65/74/1123456574.db2.gz MRBLKZGEDCDJHB-WDSOQIARSA-N 1 3 290.495 3.643 20 0 CHADHO CCCN1CC[C@H](C[NH2+]C[C@@H](c2ccccc2)C(C)C)C1 ZINC000474633562 1123562658 /nfs/dbraw/zinc/56/26/58/1123562658.db2.gz ZEBDNFBZAIHXDV-IEBWSBKVSA-N 1 3 288.479 3.748 20 0 CHADHO Cc1cc(F)ccc1[C@@H](C)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000858491629 1123657725 /nfs/dbraw/zinc/65/77/25/1123657725.db2.gz MDBWVIAOXBTRCG-HUUCEWRRSA-N 1 3 278.415 3.517 20 0 CHADHO C[C@H](CC[NH2+]C[C@@H]1C[C@H]1c1ccccc1)N1CCCCC1 ZINC000346257930 1123676514 /nfs/dbraw/zinc/67/65/14/1123676514.db2.gz YFOACFIGSZYRNR-NEWSRXKRSA-N 1 3 286.463 3.644 20 0 CHADHO [NH3+][C@@H]1CC[C@H]2CN(Cc3cc(-c4ccccc4)cs3)C[C@@H]12 ZINC000346826969 1123724436 /nfs/dbraw/zinc/72/44/36/1123724436.db2.gz FMBMURKANLASKO-BMGDILEWSA-N 1 3 298.455 3.584 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1C[N@@H+]1CCCC12CCN(C)CC2 ZINC000475131402 1123796639 /nfs/dbraw/zinc/79/66/39/1123796639.db2.gz RNSILQGMBSXIDN-DLBZAZTESA-N 1 3 276.468 3.539 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1C[N@H+]1CCCC12CCN(C)CC2 ZINC000475131402 1123796642 /nfs/dbraw/zinc/79/66/42/1123796642.db2.gz RNSILQGMBSXIDN-DLBZAZTESA-N 1 3 276.468 3.539 20 0 CHADHO Cc1oc2ccccc2c1[C@H](C)N[C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000925140167 1123823713 /nfs/dbraw/zinc/82/37/13/1123823713.db2.gz JAUWQMHBHVIGCI-IPYPFGDCSA-N 1 3 286.419 3.875 20 0 CHADHO Cc1oc2ccccc2c1[C@H](C)N[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000925140167 1123823718 /nfs/dbraw/zinc/82/37/18/1123823718.db2.gz JAUWQMHBHVIGCI-IPYPFGDCSA-N 1 3 286.419 3.875 20 0 CHADHO Cc1ccc2nccc(NC3CC[NH+](C4CC4)CC3)c2c1 ZINC000302164660 1123958840 /nfs/dbraw/zinc/95/88/40/1123958840.db2.gz QSFXXCLPCRTTMH-UHFFFAOYSA-N 1 3 281.403 3.582 20 0 CHADHO CCc1ccccc1CCN(C)[C@H]1CC[N@@H+](CC)[C@@H](C)C1 ZINC000444647404 1124048521 /nfs/dbraw/zinc/04/85/21/1124048521.db2.gz FBIIKHMWDUPKJU-LPHOPBHVSA-N 1 3 288.479 3.596 20 0 CHADHO CCc1ccccc1CCN(C)[C@H]1CC[N@H+](CC)[C@@H](C)C1 ZINC000444647404 1124048525 /nfs/dbraw/zinc/04/85/25/1124048525.db2.gz FBIIKHMWDUPKJU-LPHOPBHVSA-N 1 3 288.479 3.596 20 0 CHADHO Cc1cc([C@@H](C)[NH2+]CC2(CN(C)C)CCCC2)c(C)o1 ZINC000447599212 1124498047 /nfs/dbraw/zinc/49/80/47/1124498047.db2.gz JKSJNHGEVYRGJF-CQSZACIVSA-N 1 3 278.440 3.669 20 0 CHADHO C[C@H](Cc1coc2ccccc12)N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000449091053 1124648973 /nfs/dbraw/zinc/64/89/73/1124648973.db2.gz OZTVGBVUVSAXRB-DJIMGWMZSA-N 1 3 298.430 3.580 20 0 CHADHO C[C@H](Cc1coc2ccccc12)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000449091053 1124648975 /nfs/dbraw/zinc/64/89/75/1124648975.db2.gz OZTVGBVUVSAXRB-DJIMGWMZSA-N 1 3 298.430 3.580 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H]2C[C@H](C)CC[C@@H]2C)C1 ZINC000449129623 1124652534 /nfs/dbraw/zinc/65/25/34/1124652534.db2.gz CYNZLLUTJXIFBG-TWMKSMIVSA-N 1 3 266.473 3.521 20 0 CHADHO C[C@@H]1CCCC[C@@H]1[NH+]1CCC(NC2CC(C)(F)C2)CC1 ZINC000449374633 1124704757 /nfs/dbraw/zinc/70/47/57/1124704757.db2.gz BGVNNBARESHDKW-AKBUMOGYSA-N 1 3 282.447 3.510 20 0 CHADHO Cc1ccc(C2(CN[C@H]3CC[N@@H+]4CCC[C@@H]4C3)CC2)c(C)c1 ZINC000449378329 1124716060 /nfs/dbraw/zinc/71/60/60/1124716060.db2.gz QYYAWXDSAXUXHK-ZWKOTPCHSA-N 1 3 298.474 3.551 20 0 CHADHO Cc1ccc(C2(CN[C@H]3CC[N@H+]4CCC[C@@H]4C3)CC2)c(C)c1 ZINC000449378329 1124716063 /nfs/dbraw/zinc/71/60/63/1124716063.db2.gz QYYAWXDSAXUXHK-ZWKOTPCHSA-N 1 3 298.474 3.551 20 0 CHADHO COc1ccc(CN[C@H](C)c2cccc(C[NH+](C)C)c2)cc1 ZINC000820805576 1131302589 /nfs/dbraw/zinc/30/25/89/1131302589.db2.gz NGBBQPPMDHCPSQ-OAHLLOKOSA-N 1 3 298.430 3.608 20 0 CHADHO Cc1cc(Cl)cc(C)c1C[NH2+]C1C[C@H]2CC[C@@H](C1)N2C ZINC000449559857 1124801915 /nfs/dbraw/zinc/80/19/15/1124801915.db2.gz CYUIFWZXCIKCTF-MQVJKMGUSA-N 1 3 292.854 3.672 20 0 CHADHO Cc1occc1C[NH2+]C[C@@]1(C)CCN(Cc2ccccc2)C1 ZINC000320917889 1125218042 /nfs/dbraw/zinc/21/80/42/1125218042.db2.gz JXNYQLHDZKECMT-LJQANCHMSA-N 1 3 298.430 3.590 20 0 CHADHO Cc1csc(C[N@@H+]2CCCC[C@H]2CCN2CCCC2)c1 ZINC001137157141 1125282973 /nfs/dbraw/zinc/28/29/73/1125282973.db2.gz MMTHHFSVBNVMBT-INIZCTEOSA-N 1 3 292.492 3.897 20 0 CHADHO Cc1csc(C[N@H+]2CCCC[C@H]2CCN2CCCC2)c1 ZINC001137157141 1125282978 /nfs/dbraw/zinc/28/29/78/1125282978.db2.gz MMTHHFSVBNVMBT-INIZCTEOSA-N 1 3 292.492 3.897 20 0 CHADHO C1CC12CCC[C@@H]([NH2+]C1CCN(C3CCCC3)CC1)C2 ZINC000883195549 1125376500 /nfs/dbraw/zinc/37/65/00/1125376500.db2.gz XABBDLJNUNURKI-MRXNPFEDSA-N 1 3 276.468 3.706 20 0 CHADHO C[C@H](N[C@H]1CCCC[C@@H]1C[NH3+])c1cc2ccccc2o1 ZINC000089143048 1129217280 /nfs/dbraw/zinc/21/72/80/1129217280.db2.gz JVMHEHHAKIOWMS-CFVMTHIKSA-N 1 3 272.392 3.601 20 0 CHADHO C[C@@H](NCC(C)(C)[NH2+][C@@H](C)c1ccccc1)[C@H]1CC1(F)F ZINC000638602031 1129263762 /nfs/dbraw/zinc/26/37/62/1129263762.db2.gz RHUUALXEPORNPT-GZBFAFLISA-N 1 3 296.405 3.749 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CCCC[C@@H](CN)C1 ZINC001206606313 1129380935 /nfs/dbraw/zinc/38/09/35/1129380935.db2.gz KDKVKLFNGQJVAA-IRXDYDNUSA-N 1 3 266.473 3.820 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CCCC[C@@H](CN)C1 ZINC001206606313 1129380940 /nfs/dbraw/zinc/38/09/40/1129380940.db2.gz KDKVKLFNGQJVAA-IRXDYDNUSA-N 1 3 266.473 3.820 20 0 CHADHO Clc1cccc2c1CC[C@@H]2NCc1ccc2c(c1)C[NH2+]C2 ZINC000643523461 1129444101 /nfs/dbraw/zinc/44/41/01/1129444101.db2.gz NLOGCGLGRHFTMC-SFHVURJKSA-N 1 3 298.817 3.720 20 0 CHADHO c1ccc([C@@H]2CC[C@@H]([NH2+][C@H]3CCNC4(CCC4)C3)C2)cc1 ZINC000643548868 1129446352 /nfs/dbraw/zinc/44/63/52/1129446352.db2.gz WKMFZAKCGPWTIR-KURKYZTESA-N 1 3 284.447 3.587 20 0 CHADHO C[C@H]1SCC[C@@H]1[NH2+]C1CCN([C@H]2CCC[C@@H](C)C2)CC1 ZINC000647357643 1129575350 /nfs/dbraw/zinc/57/53/50/1129575350.db2.gz GELKQOTWADHWBF-JHNDHUHGSA-N 1 3 296.524 3.513 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]CC[C@@H](C)c2ccccc2)C1 ZINC000194422966 1129647066 /nfs/dbraw/zinc/64/70/66/1129647066.db2.gz VJBXALKRSQCTAC-QZTJIDSGSA-N 1 3 288.479 3.890 20 0 CHADHO C(C1CCCCC1)N1CCC([NH2+][C@@H]2CC[C@@H]2C2CC2)CC1 ZINC000798005398 1129674753 /nfs/dbraw/zinc/67/47/53/1129674753.db2.gz VBFKGAIWVUZJMU-RTBURBONSA-N 1 3 290.495 3.809 20 0 CHADHO CC(C)C[C@@H](Cc1ccccc1)[NH2+]CC[C@@H]1CCCN1C ZINC001169058171 1129693873 /nfs/dbraw/zinc/69/38/73/1129693873.db2.gz DIIPOHIJPVOJEQ-OALUTQOASA-N 1 3 288.479 3.718 20 0 CHADHO CC(C)[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)N2C)c1ccccc1F ZINC001169101122 1129697293 /nfs/dbraw/zinc/69/72/93/1129697293.db2.gz OQWYQXVDAAGYQS-BASYENTBSA-N 1 3 290.426 3.738 20 0 CHADHO CCc1ccc([C@@H](CC)N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC001169120163 1129700504 /nfs/dbraw/zinc/70/05/04/1129700504.db2.gz YZOONMLALYTORT-AKHDSKFASA-N 1 3 286.463 3.915 20 0 CHADHO CCc1ccc([C@@H](CC)N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC001169120163 1129700505 /nfs/dbraw/zinc/70/05/05/1129700505.db2.gz YZOONMLALYTORT-AKHDSKFASA-N 1 3 286.463 3.915 20 0 CHADHO CC[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cc(C)cc(C)c1 ZINC001169118381 1129700779 /nfs/dbraw/zinc/70/07/79/1129700779.db2.gz IVHOSJRHCAUXAW-OKYOBFRVSA-N 1 3 286.463 3.969 20 0 CHADHO CC[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc(C)cc(C)c1 ZINC001169118381 1129700783 /nfs/dbraw/zinc/70/07/83/1129700783.db2.gz IVHOSJRHCAUXAW-OKYOBFRVSA-N 1 3 286.463 3.969 20 0 CHADHO Cc1ccc([C@@H](NCc2ccc(C[NH3+])cc2F)C2CC2)cc1 ZINC000650754767 1129722233 /nfs/dbraw/zinc/72/22/33/1129722233.db2.gz QFHXPTGEQPZLGR-LJQANCHMSA-N 1 3 298.405 3.834 20 0 CHADHO CCC(C)(C)C1CCC([NH2+]C[C@H]2CNCC[C@H]2F)CC1 ZINC001246221249 1131408596 /nfs/dbraw/zinc/40/85/96/1131408596.db2.gz JTPANGSINGFCAK-PRLABOORSA-N 1 3 284.463 3.519 20 0 CHADHO CCC(C)(C)C1CCC([NH2+]C[C@@H]2CNCC[C@H]2F)CC1 ZINC001246221251 1131408790 /nfs/dbraw/zinc/40/87/90/1131408790.db2.gz JTPANGSINGFCAK-SLTXQBBLSA-N 1 3 284.463 3.519 20 0 CHADHO c1ccc2cc(CCN[C@@H]3CC[N@@H+]4CCC[C@H]4C3)ccc2c1 ZINC000677237657 1130296220 /nfs/dbraw/zinc/29/62/20/1130296220.db2.gz MNCUIKFSQDPNGH-UXHICEINSA-N 1 3 294.442 3.599 20 0 CHADHO c1ccc2cc(CCN[C@@H]3CC[N@H+]4CCC[C@H]4C3)ccc2c1 ZINC000677237657 1130296224 /nfs/dbraw/zinc/29/62/24/1130296224.db2.gz MNCUIKFSQDPNGH-UXHICEINSA-N 1 3 294.442 3.599 20 0 CHADHO C[C@H]1CC[C@@H]([NH+]2CCC3(CN(Cc4ccccc4)C3)CC2)C1 ZINC001170150319 1130357395 /nfs/dbraw/zinc/35/73/95/1130357395.db2.gz NQHGAMZZHVRXAV-PKOBYXMFSA-N 1 3 298.474 3.773 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2ccccc2C2CC2)[C@H](C)C1 ZINC000678277427 1130389330 /nfs/dbraw/zinc/38/93/30/1130389330.db2.gz JHNNTKUKKZQPPB-BEFAXECRSA-N 1 3 286.463 3.726 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2ccccc2C2CC2)[C@H](C)C1 ZINC000678277427 1130389335 /nfs/dbraw/zinc/38/93/35/1130389335.db2.gz JHNNTKUKKZQPPB-BEFAXECRSA-N 1 3 286.463 3.726 20 0 CHADHO C[C@@H]1CCc2ccccc2[C@@H]1N[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000678609523 1130442294 /nfs/dbraw/zinc/44/22/94/1130442294.db2.gz PAZLEKOLQZSPLU-QSOKESPWSA-N 1 3 284.447 3.526 20 0 CHADHO C[C@@H]1CCc2ccccc2[C@@H]1N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000678609523 1130442298 /nfs/dbraw/zinc/44/22/98/1130442298.db2.gz PAZLEKOLQZSPLU-QSOKESPWSA-N 1 3 284.447 3.526 20 0 CHADHO CCOc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCCCN2C)cc1 ZINC000678733864 1130448666 /nfs/dbraw/zinc/44/86/66/1130448666.db2.gz YTIXAYJPBBEWGB-WBVHZDCISA-N 1 3 290.451 3.610 20 0 CHADHO CC[NH+](CC)CCCN[C@H](C)Cc1ccccc1Cl ZINC001170247781 1130473191 /nfs/dbraw/zinc/47/31/91/1130473191.db2.gz YQEMQYHMDWPCSE-CQSZACIVSA-N 1 3 282.859 3.593 20 0 CHADHO CCN(CC)CCC[NH2+][C@H](C)Cc1ccccc1Cl ZINC001170247781 1130473197 /nfs/dbraw/zinc/47/31/97/1130473197.db2.gz YQEMQYHMDWPCSE-CQSZACIVSA-N 1 3 282.859 3.593 20 0 CHADHO CC1=C[C@H](C)[C@H](C[N@@H+](C(C)C)[C@H]2CCCNCC2)CC1 ZINC001206580567 1130538025 /nfs/dbraw/zinc/53/80/25/1130538025.db2.gz FCJDFVADZOZECY-BZSNNMDCSA-N 1 3 278.484 3.831 20 0 CHADHO CC1=C[C@H](C)[C@H](C[N@H+](C(C)C)[C@H]2CCCNCC2)CC1 ZINC001206580567 1130538028 /nfs/dbraw/zinc/53/80/28/1130538028.db2.gz FCJDFVADZOZECY-BZSNNMDCSA-N 1 3 278.484 3.831 20 0 CHADHO CCCC[C@H](CC)C[N@@H+]1CCCC[C@]12CCCNC2 ZINC001235176027 1130718864 /nfs/dbraw/zinc/71/88/64/1130718864.db2.gz YXBANSHTHHZJJA-DLBZAZTESA-N 1 3 266.473 3.811 20 0 CHADHO CCCC[C@H](CC)C[N@H+]1CCCC[C@]12CCCNC2 ZINC001235176027 1130718870 /nfs/dbraw/zinc/71/88/70/1130718870.db2.gz YXBANSHTHHZJJA-DLBZAZTESA-N 1 3 266.473 3.811 20 0 CHADHO CCCC[C@H](CC)CN1CCCC[C@]12CCC[NH2+]C2 ZINC001235176027 1130718876 /nfs/dbraw/zinc/71/88/76/1130718876.db2.gz YXBANSHTHHZJJA-DLBZAZTESA-N 1 3 266.473 3.811 20 0 CHADHO c1c2ccccc2[nH]c1CN1CCC([C@H]2CCCC[NH2+]2)CC1 ZINC001235226868 1130724049 /nfs/dbraw/zinc/72/40/49/1130724049.db2.gz BEMXRIKSBZCMQH-GOSISDBHSA-N 1 3 297.446 3.522 20 0 CHADHO C[C@H](CN1CC[C@@H]2[NH2+]CC[C@H]2C1)c1cccc2ccccc21 ZINC001235257013 1130729818 /nfs/dbraw/zinc/72/98/18/1130729818.db2.gz WMYAUSKRLFFIST-SYNHAJSKSA-N 1 3 294.442 3.627 20 0 CHADHO CC/C=C\CC[N@@H+]1CC[C@]2(c3ccccc3)CCNC[C@H]2C1 ZINC001235366866 1130736760 /nfs/dbraw/zinc/73/67/60/1130736760.db2.gz RWISRRSGLNNBJI-FZZLMOMWSA-N 1 3 298.474 3.596 20 0 CHADHO CC/C=C\CC[N@H+]1CC[C@]2(c3ccccc3)CCNC[C@H]2C1 ZINC001235366866 1130736764 /nfs/dbraw/zinc/73/67/64/1130736764.db2.gz RWISRRSGLNNBJI-FZZLMOMWSA-N 1 3 298.474 3.596 20 0 CHADHO Cc1ccccc1[C@@H]1CCCN1CC[C@H]1CCCC[NH2+]1 ZINC001235446271 1130745581 /nfs/dbraw/zinc/74/55/81/1130745581.db2.gz XNNXGZJPYGALAC-AEFFLSMTSA-N 1 3 272.436 3.664 20 0 CHADHO c1ccc(C2CC[NH+](Cc3ccc4c(c3)CNC4)CC2)cc1 ZINC001235442763 1130745892 /nfs/dbraw/zinc/74/58/92/1130745892.db2.gz ZLGMAMCRQOTZDI-UHFFFAOYSA-N 1 3 292.426 3.669 20 0 CHADHO [NH3+]C[C@H]1CCCN(Cc2ccc(-c3ccc(F)cc3)cc2)C1 ZINC001235675537 1130766599 /nfs/dbraw/zinc/76/65/99/1130766599.db2.gz ZDHQMPZNYNXOGR-MRXNPFEDSA-N 1 3 298.405 3.663 20 0 CHADHO CC(C)=CCCC1=CC[C@H](C[N@@H+]2CC[C@H](CN)C2)CC1 ZINC001235751378 1130775905 /nfs/dbraw/zinc/77/59/05/1130775905.db2.gz XHZLKCGVLVOYFH-ZWKOTPCHSA-N 1 3 276.468 3.740 20 0 CHADHO CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@H](CN)C2)CC1 ZINC001235751378 1130775913 /nfs/dbraw/zinc/77/59/13/1130775913.db2.gz XHZLKCGVLVOYFH-ZWKOTPCHSA-N 1 3 276.468 3.740 20 0 CHADHO CC1([NH3+])CCN(Cc2ccccc2-c2ccc(F)cc2)CC1 ZINC001235749966 1130777087 /nfs/dbraw/zinc/77/70/87/1130777087.db2.gz YAURKEXJEMCRLU-UHFFFAOYSA-N 1 3 298.405 3.806 20 0 CHADHO Cc1ccc(Oc2cccc(CN3CC(CC[NH3+])C3)c2)cc1 ZINC001235918845 1130805015 /nfs/dbraw/zinc/80/50/15/1130805015.db2.gz MGGMLLHJNWXWTQ-UHFFFAOYSA-N 1 3 296.414 3.568 20 0 CHADHO [NH3+]CC[C@@H]1CCCN1Cc1ccc2oc3ccccc3c2c1 ZINC001235925038 1130805996 /nfs/dbraw/zinc/80/59/96/1130805996.db2.gz HABYWZIYFBRHKX-HNNXBMFYSA-N 1 3 294.398 3.899 20 0 CHADHO CCOc1ccc2ccccc2c1CN1CCC[C@H]1CC[NH3+] ZINC001235924904 1130806790 /nfs/dbraw/zinc/80/67/90/1130806790.db2.gz BEBWCVWGDRHJNI-INIZCTEOSA-N 1 3 298.430 3.552 20 0 CHADHO C[C@H](CN(C)C[C@H]1CCC[NH2+]C1)c1cccc2ccccc21 ZINC001235952005 1130815074 /nfs/dbraw/zinc/81/50/74/1130815074.db2.gz WTCGRUOPISKWTD-SJORKVTESA-N 1 3 296.458 3.875 20 0 CHADHO C[C@H](C[N@H+](C)C[C@H]1CCCNC1)c1cccc2ccccc21 ZINC001235952005 1130815081 /nfs/dbraw/zinc/81/50/81/1130815081.db2.gz WTCGRUOPISKWTD-SJORKVTESA-N 1 3 296.458 3.875 20 0 CHADHO C[C@H](C[N@@H+](C)C[C@H]1CCCNC1)c1cccc2ccccc21 ZINC001235952005 1130815087 /nfs/dbraw/zinc/81/50/87/1130815087.db2.gz WTCGRUOPISKWTD-SJORKVTESA-N 1 3 296.458 3.875 20 0 CHADHO CC/C=C\CCCCCC[N@H+](C)C[C@H]1CCCNC1 ZINC001235950889 1130815471 /nfs/dbraw/zinc/81/54/71/1130815471.db2.gz ORKISABXBNJWEK-CHYADLBTSA-N 1 3 266.473 3.835 20 0 CHADHO CC/C=C\CCCCCC[N@@H+](C)C[C@H]1CCCNC1 ZINC001235950889 1130815475 /nfs/dbraw/zinc/81/54/75/1130815475.db2.gz ORKISABXBNJWEK-CHYADLBTSA-N 1 3 266.473 3.835 20 0 CHADHO c1cc(-c2ccccc2)oc1CN1CC2(C1)CCC[NH2+]CC2 ZINC001236009658 1130832551 /nfs/dbraw/zinc/83/25/51/1130832551.db2.gz OCAWDXGKMHHNGC-UHFFFAOYSA-N 1 3 296.414 3.522 20 0 CHADHO CC[N@H+](CCN)Cc1cccc2c3ccccc3sc21 ZINC001236144811 1130875956 /nfs/dbraw/zinc/87/59/56/1130875956.db2.gz VVNGQDNABGIOPR-UHFFFAOYSA-N 1 3 284.428 3.835 20 0 CHADHO CC[N@@H+](CCN)Cc1cccc2c3ccccc3sc21 ZINC001236144811 1130875960 /nfs/dbraw/zinc/87/59/60/1130875960.db2.gz VVNGQDNABGIOPR-UHFFFAOYSA-N 1 3 284.428 3.835 20 0 CHADHO C[N@H+](Cc1cccc2[nH]cc(Cl)c21)[C@@H]1CCCC[C@@H]1N ZINC001236215740 1130890643 /nfs/dbraw/zinc/89/06/43/1130890643.db2.gz XRNVXUSRSKHQMI-DZGCQCFKSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@@H+](Cc1cccc2[nH]cc(Cl)c21)[C@@H]1CCCC[C@@H]1N ZINC001236215740 1130890647 /nfs/dbraw/zinc/89/06/47/1130890647.db2.gz XRNVXUSRSKHQMI-DZGCQCFKSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@H+](Cc1cccc(-c2ccccc2)c1)C1(C)CCNCC1 ZINC001236226588 1130897599 /nfs/dbraw/zinc/89/75/99/1130897599.db2.gz PCKBTCCPCHOGSH-UHFFFAOYSA-N 1 3 294.442 3.928 20 0 CHADHO C[N@@H+](Cc1cccc(-c2ccccc2)c1)C1(C)CCNCC1 ZINC001236226588 1130897607 /nfs/dbraw/zinc/89/76/07/1130897607.db2.gz PCKBTCCPCHOGSH-UHFFFAOYSA-N 1 3 294.442 3.928 20 0 CHADHO CN(Cc1cccc(-c2ccccc2)c1)C1(C)CC[NH2+]CC1 ZINC001236226588 1130897612 /nfs/dbraw/zinc/89/76/12/1130897612.db2.gz PCKBTCCPCHOGSH-UHFFFAOYSA-N 1 3 294.442 3.928 20 0 CHADHO C[C@H](CN1CCC[NH2+]CCC1)c1cccc2ccccc21 ZINC001236239538 1130901739 /nfs/dbraw/zinc/90/17/39/1130901739.db2.gz FGAJLSSZFYWJGJ-MRXNPFEDSA-N 1 3 282.431 3.629 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)C[NH+]2CCCNCCC2)cc1 ZINC001236240599 1130902154 /nfs/dbraw/zinc/90/21/54/1130902154.db2.gz QATDCUKZCXJIPU-QGZVFWFLSA-N 1 3 288.479 3.674 20 0 CHADHO C(C1CCCCC1)[N@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236373533 1130923582 /nfs/dbraw/zinc/92/35/82/1130923582.db2.gz ZCFKVBXFUNSKNS-QGZVFWFLSA-N 1 3 278.484 3.811 20 0 CHADHO C(C1CCCCC1)[N@@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236373533 1130923583 /nfs/dbraw/zinc/92/35/83/1130923583.db2.gz ZCFKVBXFUNSKNS-QGZVFWFLSA-N 1 3 278.484 3.811 20 0 CHADHO C[NH+](C)Cc1cccc(-c2ccc3c(N)ccnc3c2)c1 ZINC001236426556 1130938563 /nfs/dbraw/zinc/93/85/63/1130938563.db2.gz XDXFYSISJCBWSZ-UHFFFAOYSA-N 1 3 277.371 3.546 20 0 CHADHO CC(C)=CCCC1=CC[C@H](CN2CC[C@](F)(C[NH3+])C2)CC1 ZINC001236433768 1130941006 /nfs/dbraw/zinc/94/10/06/1130941006.db2.gz IKTXJMDWUYMVND-ROUUACIJSA-N 1 3 294.458 3.832 20 0 CHADHO CC[C@@H](C)C[N@H+](Cc1ccc(F)cc1C)C1CCNCC1 ZINC001236518061 1130961375 /nfs/dbraw/zinc/96/13/75/1130961375.db2.gz OTTIGCXKAVFUKF-CQSZACIVSA-N 1 3 292.442 3.734 20 0 CHADHO CC[C@@H](C)C[N@@H+](Cc1ccc(F)cc1C)C1CCNCC1 ZINC001236518061 1130961377 /nfs/dbraw/zinc/96/13/77/1130961377.db2.gz OTTIGCXKAVFUKF-CQSZACIVSA-N 1 3 292.442 3.734 20 0 CHADHO CC1=CC[C@@H](CC[N@H+](C[C@H]2CCCNC2)C2CC2)C1(C)C ZINC001236584617 1130980258 /nfs/dbraw/zinc/98/02/58/1130980258.db2.gz MIVVBCUOTZUAAF-IRXDYDNUSA-N 1 3 290.495 3.833 20 0 CHADHO CC1=CC[C@@H](CC[N@@H+](C[C@H]2CCCNC2)C2CC2)C1(C)C ZINC001236584617 1130980261 /nfs/dbraw/zinc/98/02/61/1130980261.db2.gz MIVVBCUOTZUAAF-IRXDYDNUSA-N 1 3 290.495 3.833 20 0 CHADHO Cc1ccc([C@H](C)CCN(C[C@@H]2CCC[NH2+]C2)C2CC2)o1 ZINC001236584502 1130980701 /nfs/dbraw/zinc/98/07/01/1130980701.db2.gz FUJBVSVJJZDDLJ-GDBMZVCRSA-N 1 3 290.451 3.546 20 0 CHADHO c1cc(C[N@H+](C2CCC2)C2CCNCC2)c2c(c1)CCCC2 ZINC001236638341 1130987271 /nfs/dbraw/zinc/98/72/71/1130987271.db2.gz ZKJMRDCWKJOHKP-UHFFFAOYSA-N 1 3 298.474 3.672 20 0 CHADHO c1cc(C[N@@H+](C2CCC2)C2CCNCC2)c2c(c1)CCCC2 ZINC001236638341 1130987274 /nfs/dbraw/zinc/98/72/74/1130987274.db2.gz ZKJMRDCWKJOHKP-UHFFFAOYSA-N 1 3 298.474 3.672 20 0 CHADHO CCCc1ccc(CN(CCC)C[C@@H]2CC[NH2+]C2)s1 ZINC001236835340 1131017845 /nfs/dbraw/zinc/01/78/45/1131017845.db2.gz LQBGNDOXWYJKAM-CQSZACIVSA-N 1 3 280.481 3.522 20 0 CHADHO CCCc1ccc(CN(CCC)C[C@H]2CC[NH2+]C2)s1 ZINC001236835339 1131018893 /nfs/dbraw/zinc/01/88/93/1131018893.db2.gz LQBGNDOXWYJKAM-AWEZNQCLSA-N 1 3 280.481 3.522 20 0 CHADHO CC[C@H](N)C[N@H+](C)CCCc1ccc(Cl)c(Cl)c1 ZINC001236858489 1131022933 /nfs/dbraw/zinc/02/29/33/1131022933.db2.gz CCEVDURVAIFGSX-LBPRGKRZSA-N 1 3 289.250 3.595 20 0 CHADHO CC[C@H](N)C[N@@H+](C)CCCc1ccc(Cl)c(Cl)c1 ZINC001236858489 1131022938 /nfs/dbraw/zinc/02/29/38/1131022938.db2.gz CCEVDURVAIFGSX-LBPRGKRZSA-N 1 3 289.250 3.595 20 0 CHADHO C[C@]1(C[NH3+])CCCN(Cc2cccc(-c3ccccc3)c2)C1 ZINC001237058098 1131043947 /nfs/dbraw/zinc/04/39/47/1131043947.db2.gz PHZSOTKRRAYBTN-HXUWFJFHSA-N 1 3 294.442 3.914 20 0 CHADHO C[NH+]1CCC2(CCCN(Cc3ccc(Cl)s3)C2)CC1 ZINC000798957134 1131065241 /nfs/dbraw/zinc/06/52/41/1131065241.db2.gz VWJYMXKNYNBPJR-UHFFFAOYSA-N 1 3 298.883 3.709 20 0 CHADHO CCCCCCN1CCC2(CC1)[NH2+]CCc1ccccc12 ZINC001237276461 1131076063 /nfs/dbraw/zinc/07/60/63/1131076063.db2.gz VWNKIBUUJLTVLH-UHFFFAOYSA-N 1 3 286.463 3.704 20 0 CHADHO CN1CC2(C1)CC[NH+](Cc1cccc3c(F)cccc13)CC2 ZINC001237518012 1131108944 /nfs/dbraw/zinc/10/89/44/1131108944.db2.gz JOZDSPRCQFEXOY-UHFFFAOYSA-N 1 3 298.405 3.507 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+]3CCC[C@H]4C[C@H]43)cc21 ZINC001237889809 1131148456 /nfs/dbraw/zinc/14/84/56/1131148456.db2.gz OHKVRSHJLQYSBI-FUHWJXTLSA-N 1 3 282.431 3.672 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+]3CCC[C@H]4C[C@H]43)cc21 ZINC001237889809 1131148459 /nfs/dbraw/zinc/14/84/59/1131148459.db2.gz OHKVRSHJLQYSBI-FUHWJXTLSA-N 1 3 282.431 3.672 20 0 CHADHO Cc1ccc([C@H](NCc2ccc(CC[NH3+])cc2)C2CCC2)o1 ZINC000817947295 1131189245 /nfs/dbraw/zinc/18/92/45/1131189245.db2.gz BLOFSBAKMLZMNX-LJQANCHMSA-N 1 3 298.430 3.720 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc(Cl)nc2)cc1 ZINC000817962302 1131192409 /nfs/dbraw/zinc/19/24/09/1131192409.db2.gz HIMUMKFISBNBFP-RYUDHWBXSA-N 1 3 289.810 3.606 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc(Cl)nc2)cc1 ZINC000817962300 1131192668 /nfs/dbraw/zinc/19/26/68/1131192668.db2.gz HIMUMKFISBNBFP-NEPJUHHUSA-N 1 3 289.810 3.606 20 0 CHADHO CC(C)C1CCC([NH2+][C@@H]2CCN[C@H](C(C)(C)C)C2)CC1 ZINC001246335620 1131474335 /nfs/dbraw/zinc/47/43/35/1131474335.db2.gz LEMHADSARFSRRZ-BACDZXNISA-N 1 3 280.500 3.958 20 0 CHADHO CCC[C@@H](N[C@@H]1CCC[NH2+]CC1)c1ccc(C)cc1 ZINC001246477223 1131521576 /nfs/dbraw/zinc/52/15/76/1131521576.db2.gz XZLBMNDYQQPCTD-IAGOWNOFSA-N 1 3 260.425 3.568 20 0 CHADHO CCC[C@H](C)CC[C@@H](C)[NH2+][C@H](C1CCC1)C1CNC1 ZINC001246519204 1131545336 /nfs/dbraw/zinc/54/53/36/1131545336.db2.gz QSVLIDOQTYMPMZ-JJRVBVJISA-N 1 3 266.473 3.569 20 0 CHADHO CCCN(CCC[NH+](C)C)Cc1c[nH]c2cccc(C)c12 ZINC001139199874 1131594644 /nfs/dbraw/zinc/59/46/44/1131594644.db2.gz SZJPVWHDGDFFQE-UHFFFAOYSA-N 1 3 287.451 3.640 20 0 CHADHO C[C@H](CSc1ccc(F)cc1)N1CCC[C@@](C)([NH3+])CC1 ZINC001246550769 1131606633 /nfs/dbraw/zinc/60/66/33/1131606633.db2.gz JPRVPTHSRYTFIU-CZUORRHYSA-N 1 3 296.455 3.510 20 0 CHADHO C[C@@H]1[C@H](CN)CCC[N@@H+]1C1CCC2(CCCCC2)CC1 ZINC001246559392 1131621372 /nfs/dbraw/zinc/62/13/72/1131621372.db2.gz AOKDKVYMZOYFOJ-CVEARBPZSA-N 1 3 278.484 3.939 20 0 CHADHO C[C@@H]1[C@H](CN)CCC[N@H+]1C1CCC2(CCCCC2)CC1 ZINC001246559392 1131621373 /nfs/dbraw/zinc/62/13/73/1131621373.db2.gz AOKDKVYMZOYFOJ-CVEARBPZSA-N 1 3 278.484 3.939 20 0 CHADHO C[C@@H]1[C@H](CN)CCC[N@@H+]1[C@@H]1CCCC2(CCCCC2)C1 ZINC001246565089 1131631166 /nfs/dbraw/zinc/63/11/66/1131631166.db2.gz OORMQGCWPDPDOL-IXDOHACOSA-N 1 3 278.484 3.939 20 0 CHADHO C[C@@H]1[C@H](CN)CCC[N@H+]1[C@@H]1CCCC2(CCCCC2)C1 ZINC001246565089 1131631169 /nfs/dbraw/zinc/63/11/69/1131631169.db2.gz OORMQGCWPDPDOL-IXDOHACOSA-N 1 3 278.484 3.939 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[N@@H+]1CC[C@]2(C1)CCCNC2 ZINC001246600913 1131711755 /nfs/dbraw/zinc/71/17/55/1131711755.db2.gz FFJQQIUGIZGDIQ-YESZJQIVSA-N 1 3 266.473 3.667 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[N@H+]1CC[C@]2(C1)CCCNC2 ZINC001246600913 1131711757 /nfs/dbraw/zinc/71/17/57/1131711757.db2.gz FFJQQIUGIZGDIQ-YESZJQIVSA-N 1 3 266.473 3.667 20 0 CHADHO CC/C=C/CN[C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716693632 1132029571 /nfs/dbraw/zinc/02/95/71/1132029571.db2.gz PKCXEMACMXKXRN-FLRJTCFHSA-N 1 3 284.447 3.595 20 0 CHADHO CC/C=C/CN[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716693632 1132029581 /nfs/dbraw/zinc/02/95/81/1132029581.db2.gz PKCXEMACMXKXRN-FLRJTCFHSA-N 1 3 284.447 3.595 20 0 CHADHO CC/C=C/C[NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000716693632 1132029588 /nfs/dbraw/zinc/02/95/88/1132029588.db2.gz PKCXEMACMXKXRN-FLRJTCFHSA-N 1 3 284.447 3.595 20 0 CHADHO CC[C@H]([NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)C1CC1 ZINC000716727476 1132031112 /nfs/dbraw/zinc/03/11/12/1132031112.db2.gz LGTSGQBTJDKTNI-RNQOJCNYSA-N 1 3 298.474 3.818 20 0 CHADHO Cc1ccc(CN(C)CC2CC[NH+](C(C)C)CC2)c(F)c1 ZINC001141194997 1132039047 /nfs/dbraw/zinc/03/90/47/1132039047.db2.gz WSSKWVCIZSYGLF-UHFFFAOYSA-N 1 3 292.442 3.686 20 0 CHADHO C[C@@H]1CCC[N@@H+](C2CC(C)(C)N(C)C(C)(C)C2)CC1 ZINC001171631969 1132063863 /nfs/dbraw/zinc/06/38/63/1132063863.db2.gz RLCBZLFDNSDHDG-CQSZACIVSA-N 1 3 266.473 3.760 20 0 CHADHO C[C@@H]1CCC[N@H+](C2CC(C)(C)N(C)C(C)(C)C2)CC1 ZINC001171631969 1132063871 /nfs/dbraw/zinc/06/38/71/1132063871.db2.gz RLCBZLFDNSDHDG-CQSZACIVSA-N 1 3 266.473 3.760 20 0 CHADHO C[C@H]1C[C@H](C)C[NH+](C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001171639968 1132080797 /nfs/dbraw/zinc/08/07/97/1132080797.db2.gz XEZFYPRLIUSCMQ-KBPBESRZSA-N 1 3 266.473 3.616 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccc(Cl)c(F)c1)C2 ZINC001172100464 1132124579 /nfs/dbraw/zinc/12/45/79/1132124579.db2.gz QYQOEPGWXVHOSS-BTTYYORXSA-N 1 3 296.817 3.584 20 0 CHADHO CC(C)c1ccc(CN[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172102705 1132130150 /nfs/dbraw/zinc/13/01/50/1132130150.db2.gz OINBHHCNJNKYFC-REPLKXPHSA-N 1 3 286.463 3.915 20 0 CHADHO CC(C)c1ccc(CN[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172102705 1132130153 /nfs/dbraw/zinc/13/01/53/1132130153.db2.gz OINBHHCNJNKYFC-REPLKXPHSA-N 1 3 286.463 3.915 20 0 CHADHO CCC(CC)N1CCC([NH2+][C@H](C)CCOCC(C)C)CC1 ZINC001172463830 1132242698 /nfs/dbraw/zinc/24/26/98/1132242698.db2.gz UPYMREPOYZRBER-MRXNPFEDSA-N 1 3 298.515 3.680 20 0 CHADHO CN1CCC[C@H]1CC[NH2+][C@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172544016 1132278810 /nfs/dbraw/zinc/27/88/10/1132278810.db2.gz VSPIHPDYLOYEOA-QYZOEREBSA-N 1 3 286.463 3.787 20 0 CHADHO CCC[C@H]1CCCC[N@@H+]1Cc1cc2c[nH]ccc-2n1 ZINC001232014557 1132411164 /nfs/dbraw/zinc/41/11/64/1132411164.db2.gz QLOJLQGVSWOLRR-HNNXBMFYSA-N 1 3 257.381 3.718 20 0 CHADHO CCC[C@H]1CCCC[N@H+]1Cc1cc2c[nH]ccc-2n1 ZINC001232014557 1132411166 /nfs/dbraw/zinc/41/11/66/1132411166.db2.gz QLOJLQGVSWOLRR-HNNXBMFYSA-N 1 3 257.381 3.718 20 0 CHADHO c1c2c[nH]ccc-2nc1C[N@@H+]1CC[C@@H](C2CCCCC2)C1 ZINC001232016554 1132411211 /nfs/dbraw/zinc/41/12/11/1132411211.db2.gz ZAXZVZATFSHIQP-OAHLLOKOSA-N 1 3 283.419 3.965 20 0 CHADHO c1c2c[nH]ccc-2nc1C[N@H+]1CC[C@@H](C2CCCCC2)C1 ZINC001232016554 1132411215 /nfs/dbraw/zinc/41/12/15/1132411215.db2.gz ZAXZVZATFSHIQP-OAHLLOKOSA-N 1 3 283.419 3.965 20 0 CHADHO CCc1ccc(C[C@@H](C)N(C)CCC[NH+]2CCCC2)cc1 ZINC001173244553 1132417907 /nfs/dbraw/zinc/41/79/07/1132417907.db2.gz XIYKLGISWXICJS-QGZVFWFLSA-N 1 3 288.479 3.598 20 0 CHADHO C[C@@H]1CCCC[N@H+](Cc2cc(F)cc(CN(C)C)c2)C1 ZINC001232143886 1132427127 /nfs/dbraw/zinc/42/71/27/1132427127.db2.gz DJYOXTGIFLMSTE-CQSZACIVSA-N 1 3 278.415 3.509 20 0 CHADHO C[C@@H]1CCCC[N@@H+](Cc2cc(F)cc(CN(C)C)c2)C1 ZINC001232143886 1132427129 /nfs/dbraw/zinc/42/71/29/1132427129.db2.gz DJYOXTGIFLMSTE-CQSZACIVSA-N 1 3 278.415 3.509 20 0 CHADHO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cc(F)cc(CN(C)C)c1 ZINC001232146777 1132427462 /nfs/dbraw/zinc/42/74/62/1132427462.db2.gz HCSJBNQUHHQBSA-UONOGXRCSA-N 1 3 278.415 3.508 20 0 CHADHO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cc(F)cc(CN(C)C)c1 ZINC001232146777 1132427467 /nfs/dbraw/zinc/42/74/67/1132427467.db2.gz HCSJBNQUHHQBSA-UONOGXRCSA-N 1 3 278.415 3.508 20 0 CHADHO C[C@H]1CC[N@H+](Cc2cc(F)cc(CN(C)C)c2)[C@@H](C)C1 ZINC001232146675 1132428592 /nfs/dbraw/zinc/42/85/92/1132428592.db2.gz YAOFNUVMMRWDFN-KBPBESRZSA-N 1 3 278.415 3.508 20 0 CHADHO C[C@H]1CC[N@@H+](Cc2cc(F)cc(CN(C)C)c2)[C@@H](C)C1 ZINC001232146675 1132428594 /nfs/dbraw/zinc/42/85/94/1132428594.db2.gz YAOFNUVMMRWDFN-KBPBESRZSA-N 1 3 278.415 3.508 20 0 CHADHO CC[C@@H]1CC[C@@H]([NH2+]C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001173269317 1132434314 /nfs/dbraw/zinc/43/43/14/1132434314.db2.gz VLXXAQATXVSOLS-ZIAGYGMSSA-N 1 3 266.473 3.806 20 0 CHADHO C[NH+]1CCC2(CCN(Cc3cc(Cl)cs3)CC2)CC1 ZINC001232280053 1132449540 /nfs/dbraw/zinc/44/95/40/1132449540.db2.gz KZRWMNWCZAPAJC-UHFFFAOYSA-N 1 3 298.883 3.709 20 0 CHADHO CN1CC[C@@H]2C[N@@H+]([C@@H]3CCCC4(CCCCC4)C3)C[C@@H]2C1 ZINC001173343866 1132468512 /nfs/dbraw/zinc/46/85/12/1132468512.db2.gz KLZCDEJXXQCSFP-FGTMMUONSA-N 1 3 290.495 3.763 20 0 CHADHO CN1CC[C@@H]2C[N@H+]([C@@H]3CCCC4(CCCCC4)C3)C[C@@H]2C1 ZINC001173343866 1132468516 /nfs/dbraw/zinc/46/85/16/1132468516.db2.gz KLZCDEJXXQCSFP-FGTMMUONSA-N 1 3 290.495 3.763 20 0 CHADHO c1cc(Nc2ccc3c(c2)C[NH2+]C3)cc(C2CCC2)n1 ZINC001159364823 1132832704 /nfs/dbraw/zinc/83/27/04/1132832704.db2.gz ZITLDDJKCCBZJQ-UHFFFAOYSA-N 1 3 265.360 3.696 20 0 CHADHO CC(C)(C)C(=[NH2+])Nc1ccc(F)c(CN2CCCC2)c1 ZINC001162666052 1133102790 /nfs/dbraw/zinc/10/27/90/1133102790.db2.gz XYTWWOWRIXEHFC-UHFFFAOYSA-N 1 3 277.387 3.857 20 0 CHADHO Cc1cc2cc(NCC[C@H]3CCC[N@@H+](C)C3)ccc2cn1 ZINC001165300721 1133238119 /nfs/dbraw/zinc/23/81/19/1133238119.db2.gz RNZVMHUOJYAEFL-OAHLLOKOSA-N 1 3 283.419 3.687 20 0 CHADHO Cc1cc2cc(NCC[C@H]3CCC[N@H+](C)C3)ccc2cn1 ZINC001165300721 1133238124 /nfs/dbraw/zinc/23/81/24/1133238124.db2.gz RNZVMHUOJYAEFL-OAHLLOKOSA-N 1 3 283.419 3.687 20 0 CHADHO CC[NH+]1CCC(CC2CCN(Cc3ccco3)CC2)CC1 ZINC001203283565 1133310695 /nfs/dbraw/zinc/31/06/95/1133310695.db2.gz JYKZSSPXESXOPU-UHFFFAOYSA-N 1 3 290.451 3.614 20 0 CHADHO CCC[NH+]1C[C@@H]2CN(Cc3cccc4ccccc43)C[C@H]2C1 ZINC001203989075 1133395126 /nfs/dbraw/zinc/39/51/26/1133395126.db2.gz SAVLQXYVRLAOEG-RTBURBONSA-N 1 3 294.442 3.613 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+](C[C@@H]2CCCC(C)(C)C2)C1 ZINC001204161891 1133412465 /nfs/dbraw/zinc/41/24/65/1133412465.db2.gz HNAMINCQACIZNO-IAGOWNOFSA-N 1 3 280.500 3.867 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+](C[C@@H]2CCCC(C)(C)C2)C1 ZINC001204161891 1133412468 /nfs/dbraw/zinc/41/24/68/1133412468.db2.gz HNAMINCQACIZNO-IAGOWNOFSA-N 1 3 280.500 3.867 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@@H+]1CCC[C@H](N)CC1 ZINC001205087762 1133526258 /nfs/dbraw/zinc/52/62/58/1133526258.db2.gz IVOPILJQTAAZFD-CVEARBPZSA-N 1 3 252.446 3.572 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@H+]1CCC[C@H](N)CC1 ZINC001205087762 1133526261 /nfs/dbraw/zinc/52/62/61/1133526261.db2.gz IVOPILJQTAAZFD-CVEARBPZSA-N 1 3 252.446 3.572 20 0 CHADHO CCOc1ccc2ccccc2c1CN1CCC[C@@H]([NH3+])CC1 ZINC001205102640 1133530441 /nfs/dbraw/zinc/53/04/41/1133530441.db2.gz UZHOCTIBNDZRPB-MRXNPFEDSA-N 1 3 298.430 3.552 20 0 CHADHO Cc1ccc(-c2ccc(CN3CCC[C@H]([NH3+])CC3)cc2)cc1 ZINC001205109134 1133530875 /nfs/dbraw/zinc/53/08/75/1133530875.db2.gz BIDVTCPKUSYAIA-FQEVSTJZSA-N 1 3 294.442 3.975 20 0 CHADHO CC(C)c1ccc(CN2CCC[C@@](C)([NH3+])CC2)cc1 ZINC001205265336 1133551238 /nfs/dbraw/zinc/55/12/38/1133551238.db2.gz PYKXZKMPEKUDSU-QGZVFWFLSA-N 1 3 260.425 3.513 20 0 CHADHO C[C@@]1([NH3+])CCCN(Cc2ccc(C3CCC3)cc2)CC1 ZINC001205289529 1133554675 /nfs/dbraw/zinc/55/46/75/1133554675.db2.gz YQGQJMHZHODXDY-GOSISDBHSA-N 1 3 272.436 3.657 20 0 CHADHO Cc1ccc(Cl)c(CN2CC[C@@H](C)[C@@H](C[NH3+])CC2)c1F ZINC001205618928 1133596709 /nfs/dbraw/zinc/59/67/09/1133596709.db2.gz ZGRIFBCSPOAFGM-DGCLKSJQSA-N 1 3 298.833 3.594 20 0 CHADHO Cc1ccc2ccccc2c1C[N@H+]1CCC[C@H](CN)[C@@H]1C ZINC001205917425 1133630284 /nfs/dbraw/zinc/63/02/84/1133630284.db2.gz YOSVWKMBDXXAFQ-DOTOQJQBSA-N 1 3 282.431 3.707 20 0 CHADHO Cc1ccc2ccccc2c1C[N@@H+]1CCC[C@H](CN)[C@@H]1C ZINC001205917425 1133630287 /nfs/dbraw/zinc/63/02/87/1133630287.db2.gz YOSVWKMBDXXAFQ-DOTOQJQBSA-N 1 3 282.431 3.707 20 0 CHADHO N[C@@H]1CCCC[N@H+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC001205932264 1133632898 /nfs/dbraw/zinc/63/28/98/1133632898.db2.gz PEWRLOMWHCXCTN-LJQANCHMSA-N 1 3 280.415 3.667 20 0 CHADHO N[C@@H]1CCCC[N@@H+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC001205932264 1133632901 /nfs/dbraw/zinc/63/29/01/1133632901.db2.gz PEWRLOMWHCXCTN-LJQANCHMSA-N 1 3 280.415 3.667 20 0 CHADHO Cc1ccc(-c2ccc(C[N@@H+]3CCCC[C@H](N)C3)cc2)cc1 ZINC001205930782 1133632973 /nfs/dbraw/zinc/63/29/73/1133632973.db2.gz DJCHVVRYMJPRAJ-FQEVSTJZSA-N 1 3 294.442 3.975 20 0 CHADHO Cc1ccc(-c2ccc(C[N@H+]3CCCC[C@H](N)C3)cc2)cc1 ZINC001205930782 1133632977 /nfs/dbraw/zinc/63/29/77/1133632977.db2.gz DJCHVVRYMJPRAJ-FQEVSTJZSA-N 1 3 294.442 3.975 20 0 CHADHO Cc1cccc(-c2ccc(C[N@@H+]3CCCC[C@H](N)C3)cc2)c1 ZINC001205938927 1133633312 /nfs/dbraw/zinc/63/33/12/1133633312.db2.gz LZJFAKPAPCIPMW-FQEVSTJZSA-N 1 3 294.442 3.975 20 0 CHADHO Cc1cccc(-c2ccc(C[N@H+]3CCCC[C@H](N)C3)cc2)c1 ZINC001205938927 1133633315 /nfs/dbraw/zinc/63/33/15/1133633315.db2.gz LZJFAKPAPCIPMW-FQEVSTJZSA-N 1 3 294.442 3.975 20 0 CHADHO [NH3+]Cc1cccc(CN2CCC[C@@H]2c2ccc(F)cc2)c1 ZINC001206049556 1133649672 /nfs/dbraw/zinc/64/96/72/1133649672.db2.gz OEVDUJIHHJTIJA-GOSISDBHSA-N 1 3 284.378 3.622 20 0 CHADHO NC[C@]1(F)CCCC[N@H+](Cc2ccc(C3CCC3)cc2)C1 ZINC001206370664 1133695706 /nfs/dbraw/zinc/69/57/06/1133695706.db2.gz OOUBPMWFEAHMDL-GOSISDBHSA-N 1 3 290.426 3.607 20 0 CHADHO NC[C@]1(F)CCCC[N@@H+](Cc2ccc(C3CCC3)cc2)C1 ZINC001206370664 1133695709 /nfs/dbraw/zinc/69/57/09/1133695709.db2.gz OOUBPMWFEAHMDL-GOSISDBHSA-N 1 3 290.426 3.607 20 0 CHADHO Cc1cc(CN2CCC(CC[NH3+])CC2)cc(C)c1Cl ZINC001206507049 1133712144 /nfs/dbraw/zinc/71/21/44/1133712144.db2.gz YMUWUXHIKWIHPV-UHFFFAOYSA-N 1 3 280.843 3.518 20 0 CHADHO CC(C)N(Cc1ccc(F)c(Cl)c1)[C@H]1CCC[NH2+]CC1 ZINC001206582760 1133721717 /nfs/dbraw/zinc/72/17/17/1133721717.db2.gz PLZFHHHTBMOZPC-AWEZNQCLSA-N 1 3 298.833 3.832 20 0 CHADHO Cc1cc(CN(C(C)C)[C@H]2CCC[NH2+]CC2)cc(C)c1F ZINC001206588874 1133723686 /nfs/dbraw/zinc/72/36/86/1133723686.db2.gz CSGJFKBSXDVCKZ-KRWDZBQOSA-N 1 3 292.442 3.795 20 0 CHADHO NC[C@@H]1CCCC[N@H+](C[C@@H]2C[C@H]2c2ccc(Cl)cc2)C1 ZINC001206606561 1133726342 /nfs/dbraw/zinc/72/63/42/1133726342.db2.gz PHFGOPMOCPKKKX-QRTARXTBSA-N 1 3 292.854 3.504 20 0 CHADHO NC[C@@H]1CCCC[N@@H+](C[C@@H]2C[C@H]2c2ccc(Cl)cc2)C1 ZINC001206606561 1133726346 /nfs/dbraw/zinc/72/63/46/1133726346.db2.gz PHFGOPMOCPKKKX-QRTARXTBSA-N 1 3 292.854 3.504 20 0 CHADHO C[C@H](CC[N@@H+]1C[C@H](CN)CC[C@@H]1C)CC(C)(C)C ZINC001206760923 1133743193 /nfs/dbraw/zinc/74/31/93/1133743193.db2.gz OGMNEGGPDVROSS-ILXRZTDVSA-N 1 3 254.462 3.508 20 0 CHADHO C[C@H](CC[N@H+]1C[C@H](CN)CC[C@@H]1C)CC(C)(C)C ZINC001206760923 1133743196 /nfs/dbraw/zinc/74/31/96/1133743196.db2.gz OGMNEGGPDVROSS-ILXRZTDVSA-N 1 3 254.462 3.508 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[N@H+](C)CC(C)(C)CN(C)C ZINC001207282348 1133786623 /nfs/dbraw/zinc/78/66/23/1133786623.db2.gz JQFOJHAWKSIQGA-CYBMUJFWSA-N 1 3 282.859 3.921 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)CC(C)(C)CN(C)C ZINC001207282348 1133786628 /nfs/dbraw/zinc/78/66/28/1133786628.db2.gz JQFOJHAWKSIQGA-CYBMUJFWSA-N 1 3 282.859 3.921 20 0 CHADHO CN(C)CC(C)(C)C[N@@H+]1CC[C@H](c2ccccc2Cl)C1 ZINC001207285385 1133789460 /nfs/dbraw/zinc/78/94/60/1133789460.db2.gz IXEMXDVMUVIQAU-AWEZNQCLSA-N 1 3 294.870 3.717 20 0 CHADHO CN(C)CC(C)(C)C[N@H+]1CC[C@H](c2ccccc2Cl)C1 ZINC001207285385 1133789466 /nfs/dbraw/zinc/78/94/66/1133789466.db2.gz IXEMXDVMUVIQAU-AWEZNQCLSA-N 1 3 294.870 3.717 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1C[C@@H]1C[C@H]2C=C[C@@H]1C2 ZINC001207631417 1133833978 /nfs/dbraw/zinc/83/39/78/1133833978.db2.gz HBEZMLVGCJQOTL-PJVZLEMVSA-N 1 3 288.479 3.537 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@H+]1C[C@@H]1C[C@H]2C=C[C@@H]1C2 ZINC001207631417 1133833984 /nfs/dbraw/zinc/83/39/84/1133833984.db2.gz HBEZMLVGCJQOTL-PJVZLEMVSA-N 1 3 288.479 3.537 20 0 CHADHO CN(C1CC1)C1CC[NH+](CCCC2CCCC2)CC1 ZINC001208094378 1133876758 /nfs/dbraw/zinc/87/67/58/1133876758.db2.gz LEAYPEJVRAYFMY-UHFFFAOYSA-N 1 3 264.457 3.515 20 0 CHADHO C[C@H](C[NH+]1CCC(N(C)C)CC1)c1cccc2ccccc21 ZINC001208707841 1133933178 /nfs/dbraw/zinc/93/31/78/1133933178.db2.gz ULMUZVLGYQOMBC-MRXNPFEDSA-N 1 3 296.458 3.969 20 0 CHADHO c1ccc(CCCCCN2CCC([NH+]3CCC3)CC2)cc1 ZINC001209232287 1133993243 /nfs/dbraw/zinc/99/32/43/1133993243.db2.gz LUJSDQWFFWXUGU-UHFFFAOYSA-N 1 3 286.463 3.570 20 0 CHADHO C[C@H](c1cccc(O[C@H]2CNCc3ccccc32)c1)[NH+](C)C ZINC001218487969 1135115704 /nfs/dbraw/zinc/11/57/04/1135115704.db2.gz LECCXGKNGLPTRE-KUHUBIRLSA-N 1 3 296.414 3.533 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@@H+]1CCC[C@@]2(CCCNC2)C1 ZINC001222259383 1135215573 /nfs/dbraw/zinc/21/55/73/1135215573.db2.gz OJUCDPHUSYLGGW-QZTJIDSGSA-N 1 3 278.484 3.835 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@H+]1CCC[C@@]2(CCCNC2)C1 ZINC001222259383 1135215577 /nfs/dbraw/zinc/21/55/77/1135215577.db2.gz OJUCDPHUSYLGGW-QZTJIDSGSA-N 1 3 278.484 3.835 20 0 CHADHO C[C@H](C[N@@H+]1CC[C@H]2CNCC[C@H]21)c1cccc2ccccc21 ZINC001222616189 1135256288 /nfs/dbraw/zinc/25/62/88/1135256288.db2.gz ZCXRELJYXOTHKF-OXFYSEKESA-N 1 3 294.442 3.627 20 0 CHADHO C[C@H](C[N@H+]1CC[C@H]2CNCC[C@H]21)c1cccc2ccccc21 ZINC001222616189 1135256294 /nfs/dbraw/zinc/25/62/94/1135256294.db2.gz ZCXRELJYXOTHKF-OXFYSEKESA-N 1 3 294.442 3.627 20 0 CHADHO CC(C)(CCN1CCC2(CCC[NH2+]2)CC1)c1ccccc1 ZINC001226786224 1135741196 /nfs/dbraw/zinc/74/11/96/1135741196.db2.gz XRCVFRZXAZPNHI-UHFFFAOYSA-N 1 3 286.463 3.572 20 0 CHADHO Cc1cc(CN2CCC(C[N@@H+](C)C(C)C)CC2)cs1 ZINC000574636677 335035710 /nfs/dbraw/zinc/03/57/10/335035710.db2.gz DZVXVKBNSNIIQN-UHFFFAOYSA-N 1 3 280.481 3.609 20 0 CHADHO Cc1cc(CN2CCC(C[N@H+](C)C(C)C)CC2)cs1 ZINC000574636677 335035711 /nfs/dbraw/zinc/03/57/11/335035711.db2.gz DZVXVKBNSNIIQN-UHFFFAOYSA-N 1 3 280.481 3.609 20 0 CHADHO C[C@@H](NCc1ccc(C[NH+](C)C)cc1)c1cccs1 ZINC000171126810 335055883 /nfs/dbraw/zinc/05/58/83/335055883.db2.gz UPJJOIFMJPAITA-CYBMUJFWSA-N 1 3 274.433 3.661 20 0 CHADHO Cc1ccccc1C1CC[NH+](CC[C@H]2CCCN2C)CC1 ZINC000179426117 260048029 /nfs/dbraw/zinc/04/80/29/260048029.db2.gz JEPZANSVLCPNDE-GOSISDBHSA-N 1 3 286.463 3.659 20 0 CHADHO Cc1ccccc1C1CCN(CC[C@H]2CCC[N@H+]2C)CC1 ZINC000179426117 260048042 /nfs/dbraw/zinc/04/80/42/260048042.db2.gz JEPZANSVLCPNDE-GOSISDBHSA-N 1 3 286.463 3.659 20 0 CHADHO Cc1ccccc1C1CCN(CC[C@H]2CCC[N@@H+]2C)CC1 ZINC000179426117 260048045 /nfs/dbraw/zinc/04/80/45/260048045.db2.gz JEPZANSVLCPNDE-GOSISDBHSA-N 1 3 286.463 3.659 20 0 CHADHO Cc1ccccc1C1CC[NH+](CC[C@@H]2CCCN2C)CC1 ZINC000179426108 260048099 /nfs/dbraw/zinc/04/80/99/260048099.db2.gz JEPZANSVLCPNDE-SFHVURJKSA-N 1 3 286.463 3.659 20 0 CHADHO Cc1ccccc1C1CCN(CC[C@@H]2CCC[N@H+]2C)CC1 ZINC000179426108 260048101 /nfs/dbraw/zinc/04/81/01/260048101.db2.gz JEPZANSVLCPNDE-SFHVURJKSA-N 1 3 286.463 3.659 20 0 CHADHO Cc1ccccc1C1CCN(CC[C@@H]2CCC[N@@H+]2C)CC1 ZINC000179426108 260048103 /nfs/dbraw/zinc/04/81/03/260048103.db2.gz JEPZANSVLCPNDE-SFHVURJKSA-N 1 3 286.463 3.659 20 0 CHADHO CC[NH+](CC)CCCNc1cc(C)nc2ccccc21 ZINC000005597872 170117790 /nfs/dbraw/zinc/11/77/90/170117790.db2.gz FNYDNRQXVGBSQH-UHFFFAOYSA-N 1 3 271.408 3.687 20 0 CHADHO CC(C)Oc1ccc([C@H](C)[NH2+]CCCN2CCCC2)cc1 ZINC000020129092 171016353 /nfs/dbraw/zinc/01/63/53/171016353.db2.gz BXMWDKULBMPZJK-INIZCTEOSA-N 1 3 290.451 3.610 20 0 CHADHO C[C@@H](CCc1ccccc1)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000020143204 171028877 /nfs/dbraw/zinc/02/88/77/171028877.db2.gz YIJPHBCGUJNFOE-HNNXBMFYSA-N 1 3 288.479 3.907 20 0 CHADHO C[C@@H](CCc1ccccc1)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000020143204 171028879 /nfs/dbraw/zinc/02/88/79/171028879.db2.gz YIJPHBCGUJNFOE-HNNXBMFYSA-N 1 3 288.479 3.907 20 0 CHADHO C[C@H]([NH2+]CCCN1CCC(C)CC1)c1cccs1 ZINC000020146283 171032365 /nfs/dbraw/zinc/03/23/65/171032365.db2.gz LVMISDGFSGJIAU-AWEZNQCLSA-N 1 3 266.454 3.521 20 0 CHADHO CC(C)[NH+]1CCC(N[C@@H]2CCCCc3ccccc32)CC1 ZINC000020189038 171054894 /nfs/dbraw/zinc/05/48/94/171054894.db2.gz GRWFZZOBLIJTLD-LJQANCHMSA-N 1 3 286.463 3.917 20 0 CHADHO CC[C@H](NCCC[NH+]1CCCCC1)c1ccccc1 ZINC000020547768 171244862 /nfs/dbraw/zinc/24/48/62/171244862.db2.gz SSCKQXVUGLKJKX-KRWDZBQOSA-N 1 3 260.425 3.603 20 0 CHADHO Cc1ccccc1[C@@H](C)[NH2+]C[C@H](C)CN1CCCCC1 ZINC000038041722 174043576 /nfs/dbraw/zinc/04/35/76/174043576.db2.gz CULGSRINXPTZGF-DOTOQJQBSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@H]([NH2+]CCCN1CCCCC1)c1ccccc1OC ZINC000037229255 260075673 /nfs/dbraw/zinc/07/56/73/260075673.db2.gz ZMUNHQAYDDCYDR-KRWDZBQOSA-N 1 3 290.451 3.612 20 0 CHADHO C[C@H]1CCC[C@H](C[NH2+]C2CCN(C(C)(C)C)CC2)C1 ZINC000089608410 260189708 /nfs/dbraw/zinc/18/97/08/260189708.db2.gz SQIDHMBLBXWCFR-GJZGRUSLSA-N 1 3 266.473 3.665 20 0 CHADHO CC[C@H](NC[C@@H](C)C[NH+]1CCCC1)c1cccc(C)c1 ZINC000312830815 260209469 /nfs/dbraw/zinc/20/94/69/260209469.db2.gz UPMFFSXHEQJOEL-AEFFLSMTSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@H]([NH2+]C[C@@H](C)CN1CCCC1)c1cccc(C)c1 ZINC000312830815 260209470 /nfs/dbraw/zinc/20/94/70/260209470.db2.gz UPMFFSXHEQJOEL-AEFFLSMTSA-N 1 3 274.452 3.768 20 0 CHADHO Cc1ccc([C@H]([NH2+]CCCN(C)C(C)C)C2CC2)cc1 ZINC000223024183 260259220 /nfs/dbraw/zinc/25/92/20/260259220.db2.gz NOHYGEXNSWRBPF-SFHVURJKSA-N 1 3 274.452 3.766 20 0 CHADHO CC(C)c1ccc(CN[C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000093453001 260285734 /nfs/dbraw/zinc/28/57/34/260285734.db2.gz QGITZKOZNBXKOV-CEXWTWQISA-N 1 3 286.463 3.820 20 0 CHADHO C[C@H](c1ccccc1Cl)N(CC1CC[NH2+]CC1)C1CC1 ZINC000094021285 260342840 /nfs/dbraw/zinc/34/28/40/260342840.db2.gz HLPBYCSOEDMRLK-CYBMUJFWSA-N 1 3 292.854 3.865 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@H]2CCC[NH2+]CC2)cc1 ZINC000129024535 260381139 /nfs/dbraw/zinc/38/11/39/260381139.db2.gz WOKIJJNWYVJXJN-YOEHRIQHSA-N 1 3 260.425 3.603 20 0 CHADHO CC(C)(C)C[C@@H](NC[C@@H]1CCC[NH2+]C1)c1ccccc1 ZINC000130956624 260399544 /nfs/dbraw/zinc/39/95/44/260399544.db2.gz SDLQXNNVOHSQMG-NVXWUHKLSA-N 1 3 274.452 3.753 20 0 CHADHO CC(C)(C)C[C@@H]([NH2+]C[C@@H]1CCCNC1)c1ccccc1 ZINC000130956624 260399546 /nfs/dbraw/zinc/39/95/46/260399546.db2.gz SDLQXNNVOHSQMG-NVXWUHKLSA-N 1 3 274.452 3.753 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2NC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000152867037 261070456 /nfs/dbraw/zinc/07/04/56/261070456.db2.gz QZTORFPEBDFYCF-VKJFTORMSA-N 1 3 284.447 3.617 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000152867037 261070457 /nfs/dbraw/zinc/07/04/57/261070457.db2.gz QZTORFPEBDFYCF-VKJFTORMSA-N 1 3 284.447 3.617 20 0 CHADHO Cc1cccc2c1[C@@H](C)C[C@H]2NC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000152867297 261070640 /nfs/dbraw/zinc/07/06/40/261070640.db2.gz QZTORFPEBDFYCF-RLFYNMQTSA-N 1 3 284.447 3.617 20 0 CHADHO Cc1cccc2c1[C@@H](C)C[C@H]2NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000152867297 261070642 /nfs/dbraw/zinc/07/06/42/261070642.db2.gz QZTORFPEBDFYCF-RLFYNMQTSA-N 1 3 284.447 3.617 20 0 CHADHO CCCCN1CCC([NH2+][C@H](C)c2sccc2OC)CC1 ZINC000186136196 262080697 /nfs/dbraw/zinc/08/06/97/262080697.db2.gz SQDFTNWYESUZNG-CYBMUJFWSA-N 1 3 296.480 3.672 20 0 CHADHO CC(C)=CCN[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000188443811 262296791 /nfs/dbraw/zinc/29/67/91/262296791.db2.gz FAPVVGIBZKFGJF-FUHWJXTLSA-N 1 3 272.436 3.595 20 0 CHADHO CC(C)=CCN[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000188443811 262296792 /nfs/dbraw/zinc/29/67/92/262296792.db2.gz FAPVVGIBZKFGJF-FUHWJXTLSA-N 1 3 272.436 3.595 20 0 CHADHO CC(C)[C@H](N[C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(F)cc1 ZINC000221836499 262304399 /nfs/dbraw/zinc/30/43/99/262304399.db2.gz GFLGAJHXMDNPEN-XKQJLSEDSA-N 1 3 278.415 3.595 20 0 CHADHO CC(C)[C@H](N[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(F)cc1 ZINC000221836499 262304400 /nfs/dbraw/zinc/30/44/00/262304400.db2.gz GFLGAJHXMDNPEN-XKQJLSEDSA-N 1 3 278.415 3.595 20 0 CHADHO CC(C)[C@@H](C)[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000390782846 262346068 /nfs/dbraw/zinc/34/60/68/262346068.db2.gz UGKACKAREGMKCS-MJGOQNOKSA-N 1 3 288.479 3.923 20 0 CHADHO C[C@@H](C[NH2+]C1CCNCC1)Cc1ccc(C(C)(C)C)cc1 ZINC000414783110 263046995 /nfs/dbraw/zinc/04/69/95/263046995.db2.gz GEQYEPWGNGHOMF-OAHLLOKOSA-N 1 3 288.479 3.504 20 0 CHADHO Cc1ccc(CNCc2ccc([C@@H](C)[NH3+])cc2)cc1C ZINC000414804057 263051701 /nfs/dbraw/zinc/05/17/01/263051701.db2.gz DRVPAEFKMCGXGZ-OAHLLOKOSA-N 1 3 268.404 3.613 20 0 CHADHO NC[C@@H]1CCCC[C@H]1[NH2+]CCCc1c(F)cccc1Cl ZINC000414811455 263053017 /nfs/dbraw/zinc/05/30/17/263053017.db2.gz WJBRQPVZGNKSIB-BLLLJJGKSA-N 1 3 298.833 3.519 20 0 CHADHO C[C@H](CC(C)(C)c1ccccc1)NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414820642 263054846 /nfs/dbraw/zinc/05/48/46/263054846.db2.gz AOVMXANOJHPKLJ-NAZJXLNTSA-N 1 3 286.463 3.615 20 0 CHADHO c1ccc([C@@H]2CCCC[C@@H]([NH2+]C[C@H]3CCCNC3)C2)cc1 ZINC000414825738 263055728 /nfs/dbraw/zinc/05/57/28/263055728.db2.gz HPDHGNGXQUAZEM-QXAKKESOSA-N 1 3 286.463 3.692 20 0 CHADHO C[C@H]([NH2+]C1CCC(C(C)(C)C)CC1)[C@H]1CCCNC1 ZINC000414844894 263059475 /nfs/dbraw/zinc/05/94/75/263059475.db2.gz DFJWESYDCHYPCG-FXQLRMTLSA-N 1 3 266.473 3.569 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+][C@H](C)[C@@H]1CCCNC1 ZINC000414857856 263074225 /nfs/dbraw/zinc/07/42/25/263074225.db2.gz QIUCOYPFLIRCFF-BHIYHBOVSA-N 1 3 288.479 3.766 20 0 CHADHO C[C@@H](CC[NH3+])NCc1ccc(-c2ccccc2Cl)s1 ZINC000414880789 263096378 /nfs/dbraw/zinc/09/63/78/263096378.db2.gz KDXVZIPRHHTGFJ-NSHDSACASA-N 1 3 294.851 3.895 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+][C@@H]1CCC[C@@H](N)C1 ZINC000414907079 263114216 /nfs/dbraw/zinc/11/42/16/263114216.db2.gz AIRVTLOSQNVHLR-KZNAEPCWSA-N 1 3 274.452 3.647 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@H]2c2ccc(Cl)cc2)C1 ZINC000414928126 263134380 /nfs/dbraw/zinc/13/43/80/263134380.db2.gz PWEMPLRMDAXYQO-LTIDMASMSA-N 1 3 292.854 3.836 20 0 CHADHO CC1([NH2+]Cc2ccc(-c3ccccc3)cc2)CCNCC1 ZINC000414936867 263143612 /nfs/dbraw/zinc/14/36/12/263143612.db2.gz HBXDUUFAAULONI-UHFFFAOYSA-N 1 3 280.415 3.585 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+]Cc1cc(-c2ccccc2)cs1 ZINC000414966346 263169539 /nfs/dbraw/zinc/16/95/39/263169539.db2.gz WLUCLMUIEYHYKI-CXAGYDPISA-N 1 3 286.444 3.503 20 0 CHADHO CCn1c2ccccc2c2cc(C[NH2+][C@H](C)[C@@H](C)N)ccc21 ZINC000415006649 263218738 /nfs/dbraw/zinc/21/87/38/263218738.db2.gz KUFHYLQQAPKPCE-ZIAGYGMSSA-N 1 3 295.430 3.640 20 0 CHADHO [NH3+]C[C@H]1CC[C@H](NCc2ccc(-c3ccccc3)cc2F)C1 ZINC000415029151 263256307 /nfs/dbraw/zinc/25/63/07/263256307.db2.gz DJCNOHGSFJOPCJ-KSSFIOAISA-N 1 3 298.405 3.710 20 0 CHADHO C[C@H](CC[NH2+][C@@H]1CNC[C@H]1c1ccccc1)c1ccccc1 ZINC000415036145 263257159 /nfs/dbraw/zinc/25/71/59/263257159.db2.gz FJMSTJKPGKBVJY-LSTHTHJFSA-N 1 3 294.442 3.525 20 0 CHADHO c1ccc2cc(CN3CCCC[C@@H]3[C@@H]3CC[NH2+]C3)ccc2c1 ZINC000415036708 263257184 /nfs/dbraw/zinc/25/71/84/263257184.db2.gz GCSCNTULBQCJHC-WOJBJXKFSA-N 1 3 294.442 3.804 20 0 CHADHO COc1cc(CN[C@@H](CCC[NH3+])c2ccccc2)ccc1C ZINC000415047581 263258165 /nfs/dbraw/zinc/25/81/65/263258165.db2.gz DZELRMDEEMQMAC-SFHVURJKSA-N 1 3 298.430 3.573 20 0 CHADHO [NH3+]C[C@@H](NCc1cc2ccccc2s1)C1CCCC1 ZINC000415073894 263264301 /nfs/dbraw/zinc/26/43/01/263264301.db2.gz ZZNSYHHHMLDOKY-OAHLLOKOSA-N 1 3 274.433 3.508 20 0 CHADHO CC(C)c1ccc2c(c1)[C@H](N[C@H]1CC[N@H+](C)[C@H](C)C1)CC2 ZINC000187801689 263268994 /nfs/dbraw/zinc/26/89/94/263268994.db2.gz CEULMMXWUAALBF-DKSSEZFCSA-N 1 3 286.463 3.870 20 0 CHADHO CC(C)c1ccc2c(c1)[C@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)CC2 ZINC000187801689 263268996 /nfs/dbraw/zinc/26/89/96/263268996.db2.gz CEULMMXWUAALBF-DKSSEZFCSA-N 1 3 286.463 3.870 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)NC[C@@H]1CCC[NH2+]C1 ZINC000415112988 263272954 /nfs/dbraw/zinc/27/29/54/263272954.db2.gz SCBLSHAUSPYIFU-AEFFLSMTSA-N 1 3 274.452 3.671 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)[NH2+]C[C@@H]1CCCNC1 ZINC000415112988 263272955 /nfs/dbraw/zinc/27/29/55/263272955.db2.gz SCBLSHAUSPYIFU-AEFFLSMTSA-N 1 3 274.452 3.671 20 0 CHADHO Cc1ccccc1[C@@H](CC(C)C)NC[C@@H]1CCC[NH2+]C1 ZINC000415112990 263273335 /nfs/dbraw/zinc/27/33/35/263273335.db2.gz SCBLSHAUSPYIFU-SJLPKXTDSA-N 1 3 274.452 3.671 20 0 CHADHO Cc1ccccc1[C@@H](CC(C)C)[NH2+]C[C@@H]1CCCNC1 ZINC000415112990 263273337 /nfs/dbraw/zinc/27/33/37/263273337.db2.gz SCBLSHAUSPYIFU-SJLPKXTDSA-N 1 3 274.452 3.671 20 0 CHADHO C[C@H](C[NH2+][C@H](C)CCc1ccc(Cl)s1)CN(C)C ZINC000425947112 263961491 /nfs/dbraw/zinc/96/14/91/263961491.db2.gz ZHZDJWZZFBHIFA-VXGBXAGGSA-N 1 3 288.888 3.510 20 0 CHADHO CN(C)Cc1cccc(C[NH2+]C[C@@H]2C[C@@H]2c2ccccc2)c1 ZINC000348242794 265147828 /nfs/dbraw/zinc/14/78/28/265147828.db2.gz LCSMAOMRIDEQEH-VQTJNVASSA-N 1 3 294.442 3.642 20 0 CHADHO CC1(C)CC[C@@H](NC[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc21 ZINC000314691663 265178126 /nfs/dbraw/zinc/17/81/26/265178126.db2.gz LSLWAVKKQCMVFL-HNAYVOBHSA-N 1 3 298.474 3.873 20 0 CHADHO CC1(C)CC[C@@H](NC[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc21 ZINC000314691663 265178127 /nfs/dbraw/zinc/17/81/27/265178127.db2.gz LSLWAVKKQCMVFL-HNAYVOBHSA-N 1 3 298.474 3.873 20 0 CHADHO CC[C@H](NCC[C@H]1CCCC[N@@H+]1C)c1ccc(C)cc1 ZINC000356818639 266179604 /nfs/dbraw/zinc/17/96/04/266179604.db2.gz WLKQQXMKSDSMRC-MSOLQXFVSA-N 1 3 274.452 3.910 20 0 CHADHO CC[C@H](NCC[C@H]1CCCC[N@H+]1C)c1ccc(C)cc1 ZINC000356818639 266179606 /nfs/dbraw/zinc/17/96/06/266179606.db2.gz WLKQQXMKSDSMRC-MSOLQXFVSA-N 1 3 274.452 3.910 20 0 CHADHO [NH3+]Cc1ccc(CN[C@H](CC2CC2)c2ccccc2)cc1 ZINC000563154459 327931198 /nfs/dbraw/zinc/93/11/98/327931198.db2.gz YSCZABMHJMQTNP-LJQANCHMSA-N 1 3 280.415 3.776 20 0 CHADHO CCCN1CC[C@H](C[NH2+]CCC2CCCCCC2)C1 ZINC000571329048 328107624 /nfs/dbraw/zinc/10/76/24/328107624.db2.gz YAWXTJMGWYACJG-QGZVFWFLSA-N 1 3 266.473 3.668 20 0 CHADHO C[C@H]([NH3+])c1ccc(CNCc2ccc(Cl)cc2)cc1 ZINC000414807708 328232353 /nfs/dbraw/zinc/23/23/53/328232353.db2.gz JHJWCLIVYXAUFG-LBPRGKRZSA-N 1 3 274.795 3.650 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2NC1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000296064924 328288809 /nfs/dbraw/zinc/28/88/09/328288809.db2.gz WESDGZPMESYEEW-XNRPARBSSA-N 1 3 284.447 3.758 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000296064924 328288810 /nfs/dbraw/zinc/28/88/10/328288810.db2.gz WESDGZPMESYEEW-XNRPARBSSA-N 1 3 284.447 3.758 20 0 CHADHO CCOc1ccc(CN[C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000415052004 328299118 /nfs/dbraw/zinc/29/91/18/328299118.db2.gz KOQDGRVRIXBOAU-LJQANCHMSA-N 1 3 298.430 3.655 20 0 CHADHO C[C@H](NC1CCC([NH3+])CC1)c1ccc(Cl)cc1Cl ZINC000051693235 328467928 /nfs/dbraw/zinc/46/79/28/328467928.db2.gz LGULUDPPFUGOPD-GCVQQVDUSA-N 1 3 287.234 3.914 20 0 CHADHO C[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1ccc(Cl)c(Cl)c1 ZINC000093210166 328510807 /nfs/dbraw/zinc/51/08/07/328510807.db2.gz MOFPPAXTHLTSSS-DLOVCJGASA-N 1 3 287.234 3.914 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](N[C@H]2CCCc3sc(Cl)cc32)C1 ZINC000576240741 327025827 /nfs/dbraw/zinc/02/58/27/327025827.db2.gz HSLJHDLITUWRSV-SCVCMEIPSA-N 1 3 284.856 3.638 20 0 CHADHO CCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000558419116 327092450 /nfs/dbraw/zinc/09/24/50/327092450.db2.gz IAYGWNXIBULGGZ-BBWFWOEESA-N 1 3 266.473 3.665 20 0 CHADHO CC1(C)CCC(N[C@@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC000132125598 327185464 /nfs/dbraw/zinc/18/54/64/327185464.db2.gz SYWKDEYDXSYBNV-JKSUJKDBSA-N 1 3 258.409 3.690 20 0 CHADHO CC(C)(C)CCC[N@@H+]1CC[C@@H](CN2CCCCC2)C1 ZINC000410388801 327190653 /nfs/dbraw/zinc/19/06/53/327190653.db2.gz SGUXFKFLNHIRRF-INIZCTEOSA-N 1 3 266.473 3.621 20 0 CHADHO CC(C)(C)CCC[N@H+]1CC[C@@H](CN2CCCCC2)C1 ZINC000410388801 327190655 /nfs/dbraw/zinc/19/06/55/327190655.db2.gz SGUXFKFLNHIRRF-INIZCTEOSA-N 1 3 266.473 3.621 20 0 CHADHO CC(C)(C)CCCN1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000410388801 327190656 /nfs/dbraw/zinc/19/06/56/327190656.db2.gz SGUXFKFLNHIRRF-INIZCTEOSA-N 1 3 266.473 3.621 20 0 CHADHO CC(C)(C)N1CCC([NH2+]C[C@H]2CCCC2(C)C)CC1 ZINC000559919854 327271644 /nfs/dbraw/zinc/27/16/44/327271644.db2.gz QAJCWGAWBKGZSD-CQSZACIVSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)C(C[NH2+]C[C@H]1CCCN(C(C)C)C1)C(C)C ZINC000560047600 327280448 /nfs/dbraw/zinc/28/04/48/327280448.db2.gz AROVMIWLGYQZSQ-MRXNPFEDSA-N 1 3 268.489 3.625 20 0 CHADHO Cc1ccccc1C[C@@H]([NH2+]CCCN(C)C(C)C)C1CC1 ZINC000560247324 327293550 /nfs/dbraw/zinc/29/35/50/327293550.db2.gz MHKRAWMJORUDCB-LJQANCHMSA-N 1 3 288.479 3.636 20 0 CHADHO C[NH+]1CCC([C@@H]2CCN(Cc3cc(Cl)cs3)C2)CC1 ZINC000583348768 327313533 /nfs/dbraw/zinc/31/35/33/327313533.db2.gz DRGYNBVIRHELHS-CYBMUJFWSA-N 1 3 298.883 3.565 20 0 CHADHO CN(CCC[NH+](C)C)CC(c1ccccc1)c1ccccc1 ZINC000560524242 327318470 /nfs/dbraw/zinc/31/84/70/327318470.db2.gz SXGAVAKAPKGJOQ-UHFFFAOYSA-N 1 3 296.458 3.702 20 0 CHADHO CCC(CC)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000560892535 327349880 /nfs/dbraw/zinc/34/98/80/327349880.db2.gz MHNFQLDKQLGCNP-UHFFFAOYSA-N 1 3 252.446 3.562 20 0 CHADHO CC(C)C(C)(C)C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCCN1 ZINC000261573889 327384766 /nfs/dbraw/zinc/38/47/66/327384766.db2.gz WDSFFVVKDRTJKD-BZUAXINKSA-N 1 3 266.473 3.569 20 0 CHADHO Cc1cc(N(C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc2n1 ZINC000561366949 327389597 /nfs/dbraw/zinc/38/95/97/327389597.db2.gz KYJIPLHIKFFRFP-XYPWUTKMSA-N 1 3 295.430 3.605 20 0 CHADHO Cc1cc(N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc2n1 ZINC000561366949 327389598 /nfs/dbraw/zinc/38/95/98/327389598.db2.gz KYJIPLHIKFFRFP-XYPWUTKMSA-N 1 3 295.430 3.605 20 0 CHADHO N[C@@H]1CCC[C@@H]([NH2+]CC2(c3cccs3)CCCCC2)C1 ZINC000566481230 327391911 /nfs/dbraw/zinc/39/19/11/327391911.db2.gz GBPCQKWWCXRDBI-HUUCEWRRSA-N 1 3 292.492 3.810 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](NCC2(c3cccs3)CCCCC2)C1 ZINC000566481230 327391912 /nfs/dbraw/zinc/39/19/12/327391912.db2.gz GBPCQKWWCXRDBI-HUUCEWRRSA-N 1 3 292.492 3.810 20 0 CHADHO Cc1ccc2nccc(N[C@@H]3CCC[C@H]([NH+](C)C)C3)c2c1 ZINC000302162788 328831374 /nfs/dbraw/zinc/83/13/74/328831374.db2.gz QBURYVNGKZQTPZ-CABCVRRESA-N 1 3 283.419 3.828 20 0 CHADHO C/C(=C\c1ccccc1)CN1CCC[C@@H]2C[N@H+](C)CC[C@H]21 ZINC000377840541 329031478 /nfs/dbraw/zinc/03/14/78/329031478.db2.gz SRZNORCJZLTQSJ-IGMRJXIPSA-N 1 3 284.447 3.506 20 0 CHADHO C/C(=C\c1ccccc1)CN1CCC[C@@H]2C[N@@H+](C)CC[C@H]21 ZINC000377840541 329031480 /nfs/dbraw/zinc/03/14/80/329031480.db2.gz SRZNORCJZLTQSJ-IGMRJXIPSA-N 1 3 284.447 3.506 20 0 CHADHO C/C(=C\c1ccccc1)C[N@H+]1CCC[C@@H]2CN(C)CC[C@H]21 ZINC000377840541 329031481 /nfs/dbraw/zinc/03/14/81/329031481.db2.gz SRZNORCJZLTQSJ-IGMRJXIPSA-N 1 3 284.447 3.506 20 0 CHADHO C/C(=C\c1ccccc1)C[N@@H+]1CCC[C@@H]2CN(C)CC[C@H]21 ZINC000377840541 329031483 /nfs/dbraw/zinc/03/14/83/329031483.db2.gz SRZNORCJZLTQSJ-IGMRJXIPSA-N 1 3 284.447 3.506 20 0 CHADHO CSC1(CNC2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)CC1 ZINC000193818527 329063291 /nfs/dbraw/zinc/06/32/91/329063291.db2.gz UYZQXAIIANLGCI-GDBMZVCRSA-N 1 3 296.524 3.515 20 0 CHADHO CSC1(C[NH2+]C2CCN([C@@H]3CCC[C@@H](C)C3)CC2)CC1 ZINC000193818527 329063292 /nfs/dbraw/zinc/06/32/92/329063292.db2.gz UYZQXAIIANLGCI-GDBMZVCRSA-N 1 3 296.524 3.515 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1C[N@@H+]1CC[C@H](C2CCN(C)CC2)C1 ZINC000584378550 329307069 /nfs/dbraw/zinc/30/70/69/329307069.db2.gz NYFLATXQIJMOKJ-YTQUADARSA-N 1 3 290.495 3.643 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1C[N@H+]1CC[C@H](C2CCN(C)CC2)C1 ZINC000584378550 329307071 /nfs/dbraw/zinc/30/70/71/329307071.db2.gz NYFLATXQIJMOKJ-YTQUADARSA-N 1 3 290.495 3.643 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000583131556 329318993 /nfs/dbraw/zinc/31/89/93/329318993.db2.gz SWQGEOYVNMMIDD-DZRGKWQISA-N 1 3 286.463 3.641 20 0 CHADHO CC(C)(C[NH2+][C@@H]1CC[C@@H]1C(C)(C)C)CN1CCCC1 ZINC000571868595 329925000 /nfs/dbraw/zinc/92/50/00/329925000.db2.gz OCLRANONQXBTQB-LSDHHAIUSA-N 1 3 266.473 3.523 20 0 CHADHO CC[C@@H](c1ccc(F)cc1F)N1CCC(CC[NH2+]C)CC1 ZINC000262015302 329997485 /nfs/dbraw/zinc/99/74/85/329997485.db2.gz VVZFRORAMKEMPH-KRWDZBQOSA-N 1 3 296.405 3.737 20 0 CHADHO C[C@H](CCCC[NH3+])N[C@@H](CC(F)(F)F)c1ccccc1 ZINC000422707285 330151053 /nfs/dbraw/zinc/15/10/53/330151053.db2.gz HEQWJMQJMSABBO-OCCSQVGLSA-N 1 3 288.357 3.787 20 0 CHADHO Cc1ccccc1[C@@H](CC(C)C)NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422705427 330151222 /nfs/dbraw/zinc/15/12/22/330151222.db2.gz BWXVPXCVPLCGLE-SUTQANCOSA-N 1 3 286.463 3.955 20 0 CHADHO c1ccc(C[C@@H]2CCCC[C@H]2NC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000422712032 330151409 /nfs/dbraw/zinc/15/14/09/330151409.db2.gz NRQTWCVIAXYAKS-XEOGZFBHSA-N 1 3 298.474 3.661 20 0 CHADHO c1csc([C@H](NC2C[C@H]3CC[C@@H](C2)[NH2+]3)C2CCCC2)c1 ZINC000422711041 330151543 /nfs/dbraw/zinc/15/15/43/330151543.db2.gz GPJKTFRTTAZWTJ-KJFZJZGVSA-N 1 3 290.476 3.852 20 0 CHADHO CCCC[C@H](N[C@@H](C)C[C@@H](C)[NH3+])c1ccc(OC)cc1 ZINC000422717978 330152193 /nfs/dbraw/zinc/15/21/93/330152193.db2.gz WHIPUWQFYNZJLA-KEYYUXOJSA-N 1 3 278.440 3.642 20 0 CHADHO [NH3+][C@H]1CCC[C@H]1NCCC(c1ccccc1)c1ccccc1 ZINC000422727645 330152321 /nfs/dbraw/zinc/15/23/21/330152321.db2.gz HRWJEMOXNUVSOR-VQTJNVASSA-N 1 3 294.442 3.678 20 0 CHADHO C[C@H]1CCNCC[C@H]1[NH2+]CC(C)(C)c1ccc(Cl)cc1 ZINC000422730226 330152388 /nfs/dbraw/zinc/15/23/88/330152388.db2.gz JHLCUNHINPXINZ-XJKSGUPXSA-N 1 3 294.870 3.595 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]CCC(c1ccccc1)c1ccccc1 ZINC000422734686 330152766 /nfs/dbraw/zinc/15/27/66/330152766.db2.gz STZILEMZZHEERK-DLBZAZTESA-N 1 3 296.458 3.924 20 0 CHADHO N[C@H]1CCCCC[C@@H]1[NH2+]Cc1csc2ccccc12 ZINC000422752363 330153233 /nfs/dbraw/zinc/15/32/33/330153233.db2.gz DYARFAJJHVTURQ-GJZGRUSLSA-N 1 3 274.433 3.651 20 0 CHADHO C[C@@H](N[C@@H](C)c1ccc2ccccc2c1)[C@@H]1CCC[NH2+]C1 ZINC000422749597 330153319 /nfs/dbraw/zinc/15/33/19/330153319.db2.gz ZVIYJEOEKVXFAH-QMTMVMCOSA-N 1 3 282.431 3.879 20 0 CHADHO C[C@@H](N[C@@H](C)c1ccc2c(c1)CCCC2)[C@H]1CCC[NH2+]C1 ZINC000422759015 330153529 /nfs/dbraw/zinc/15/35/29/330153529.db2.gz FHXVPLIVNKCQDC-KHYOSLBOSA-N 1 3 286.463 3.604 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+]CCSc1ccc(Cl)cc1 ZINC000422765213 330153907 /nfs/dbraw/zinc/15/39/07/330153907.db2.gz KRBBWUSQBGOLHN-WFASDCNBSA-N 1 3 298.883 3.539 20 0 CHADHO [NH3+]C[C@@H]1CCCC[C@@H]1NCCSc1ccc(Cl)cc1 ZINC000422765213 330153905 /nfs/dbraw/zinc/15/39/05/330153905.db2.gz KRBBWUSQBGOLHN-WFASDCNBSA-N 1 3 298.883 3.539 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](C)c1cccc2ccccc21 ZINC000422773212 330154234 /nfs/dbraw/zinc/15/42/34/330154234.db2.gz ZLVZVVPNXHAEAV-MJBXVCDLSA-N 1 3 256.393 3.616 20 0 CHADHO C[C@H](CN[C@H]1C[C@H]([NH3+])c2ccccc21)Cc1cccs1 ZINC000422775684 330154571 /nfs/dbraw/zinc/15/45/71/330154571.db2.gz BEELQQJTJSGLTC-ZLIFDBKOSA-N 1 3 286.444 3.661 20 0 CHADHO CC[C@@H](C)[C@@H]([NH2+]C1CCNCC1)c1ccc(Cl)cc1 ZINC000422788037 330155244 /nfs/dbraw/zinc/15/52/44/330155244.db2.gz VBJLXFQZFQWQKK-MLGOLLRUSA-N 1 3 280.843 3.769 20 0 CHADHO CC(C)[C@@H](N[C@H](C)C[C@H](C)[NH3+])c1ccc(Cl)cc1 ZINC000422787898 330155255 /nfs/dbraw/zinc/15/52/55/330155255.db2.gz AKEWWBQHOOUQGZ-YWPYICTPSA-N 1 3 268.832 3.753 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000422808803 330155987 /nfs/dbraw/zinc/15/59/87/330155987.db2.gz QWPWPGQXBUWEIG-LIRRHRJNSA-N 1 3 295.430 3.651 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H]1CCC(C)(C)C[C@@H]1C ZINC000422816457 330156222 /nfs/dbraw/zinc/15/62/22/330156222.db2.gz FGWXVQDHICBMEX-RVSPLBMKSA-N 1 3 289.467 3.714 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H]1CCC(C)(C)C[C@@H]1C ZINC000422816456 330156239 /nfs/dbraw/zinc/15/62/39/330156239.db2.gz FGWXVQDHICBMEX-JDFRZJQESA-N 1 3 289.467 3.714 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)[C@@H]1CCCNC1)[C@@H](C)C1CCCCC1 ZINC000422822797 330156505 /nfs/dbraw/zinc/15/65/05/330156505.db2.gz KQGIAVFJVAYDTA-PNBKFKSVSA-N 1 3 266.473 3.569 20 0 CHADHO CC[C@H](N[C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(Cl)cc1 ZINC000422825555 330156662 /nfs/dbraw/zinc/15/66/62/330156662.db2.gz PZKKKLUQFVNUFP-BJJXKVORSA-N 1 3 280.843 3.769 20 0 CHADHO Cc1cccc([C@@H](NC2C[C@H]3CC[C@@H](C2)[NH2+]3)C(C)(C)C)c1 ZINC000422836924 330156938 /nfs/dbraw/zinc/15/69/38/330156938.db2.gz KZHVCFMZICLLIW-UJJTZGENSA-N 1 3 286.463 3.955 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@H](c1cccc(F)c1)C(C)(C)C ZINC000422840440 330157076 /nfs/dbraw/zinc/15/70/76/330157076.db2.gz SYCIOPBGPDRYJK-SLEUVZQESA-N 1 3 266.404 3.628 20 0 CHADHO CC(C)(C)[C@H](N[C@H]1CCC[NH2+]CC1)c1cccc(F)c1 ZINC000422839815 330157210 /nfs/dbraw/zinc/15/72/10/330157210.db2.gz RKXOJWPLCSAYNA-JKSUJKDBSA-N 1 3 278.415 3.645 20 0 CHADHO CC[C@H](N[C@@H](C)C[C@H](C)[NH3+])c1cccc(Cl)c1 ZINC000422853784 330157359 /nfs/dbraw/zinc/15/73/59/330157359.db2.gz CGSRYKIIPPFYLQ-MJVIPROJSA-N 1 3 254.805 3.507 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCc1ccc(OC2CCCCC2)cc1 ZINC000422847410 330157504 /nfs/dbraw/zinc/15/75/04/330157504.db2.gz ICZUTDGZVMGLQA-CABCVRRESA-N 1 3 290.451 3.614 20 0 CHADHO C[C@H](CCCC[NH3+])N[C@@H](C)c1nc(C(C)(C)C)cs1 ZINC000422856512 330157798 /nfs/dbraw/zinc/15/77/98/330157798.db2.gz FOHFOYXRFRGYGN-NEPJUHHUSA-N 1 3 283.485 3.609 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NC[C@@H](C)c1c(Cl)cccc1Cl ZINC000422882744 330159296 /nfs/dbraw/zinc/15/92/96/330159296.db2.gz TTXVCWYEGISGCA-VWYCJHECSA-N 1 3 289.250 3.812 20 0 CHADHO CC[C@H](N[C@H](C)CCC[NH3+])c1ccccc1Br ZINC000422892164 330159299 /nfs/dbraw/zinc/15/92/99/330159299.db2.gz MKGDNRKUTBXFGI-RISCZKNCSA-N 1 3 299.256 3.617 20 0 CHADHO c1ccc([C@@H]2CCCC[C@H]2NC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000422896053 330159456 /nfs/dbraw/zinc/15/94/56/330159456.db2.gz HFBYXJKYXFULJN-JKHFOPOESA-N 1 3 284.447 3.585 20 0 CHADHO CC(C)(C)C[C@H]([NH2+]C1CCNCC1)c1ccc(F)cc1 ZINC000422896874 330159530 /nfs/dbraw/zinc/15/95/30/330159530.db2.gz IVSCMVXJPWGBEH-INIZCTEOSA-N 1 3 278.415 3.645 20 0 CHADHO C[C@@H](N)C[C@H](C)[NH2+]CC1(c2cccc(F)c2)CCCCC1 ZINC000422908382 330159663 /nfs/dbraw/zinc/15/96/63/330159663.db2.gz YJIICGFPKOPBOQ-CABCVRRESA-N 1 3 292.442 3.743 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCC1(c2cccc(F)c2)CCCCC1 ZINC000422908382 330159665 /nfs/dbraw/zinc/15/96/65/330159665.db2.gz YJIICGFPKOPBOQ-CABCVRRESA-N 1 3 292.442 3.743 20 0 CHADHO C[C@H](NC1CCC(C[NH3+])CC1)c1c(F)cccc1Cl ZINC000422919587 330160513 /nfs/dbraw/zinc/16/05/13/330160513.db2.gz KCIRKYQDWSRHQZ-UNXYVOJBSA-N 1 3 284.806 3.647 20 0 CHADHO CC[C@@H](Cc1ccc(Cl)cc1)NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422983750 330162770 /nfs/dbraw/zinc/16/27/70/330162770.db2.gz UVMHVCKOHBVTNE-PMRDEQMMSA-N 1 3 292.854 3.534 20 0 CHADHO Cc1ccc(CC[C@H](C)N[C@@H]2C[C@H]([NH3+])c3ccccc32)o1 ZINC000423008520 330165198 /nfs/dbraw/zinc/16/51/98/330165198.db2.gz SWSXZBMKFPFWCM-UYHISHBKSA-N 1 3 284.403 3.644 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NCCC2Cc3ccccc3C2)c2ccccc21 ZINC000423017754 330165509 /nfs/dbraw/zinc/16/55/09/330165509.db2.gz WZXYFQBRDKSCFD-WOJBJXKFSA-N 1 3 292.426 3.526 20 0 CHADHO C[C@@H](N)C[C@H](C)[NH2+]C1CCC(c2ccc(F)cc2)CC1 ZINC000423037483 330166462 /nfs/dbraw/zinc/16/64/62/330166462.db2.gz WBCMTTXIAXOEFL-HGDLATOJSA-N 1 3 278.415 3.567 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@H](CC1CCC1)c1ccccc1 ZINC000423043246 330166895 /nfs/dbraw/zinc/16/68/95/330166895.db2.gz OAENPAOWVDRSOK-GRDNDAEWSA-N 1 3 260.425 3.633 20 0 CHADHO CC(C)[C@@H](CC(F)(F)F)N[C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000423059126 330167789 /nfs/dbraw/zinc/16/77/89/330167789.db2.gz LESWOBBJRLEBGB-MGPQQGTHSA-N 1 3 294.405 3.864 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](C)c1cc2ccccc2s1 ZINC000423058674 330167780 /nfs/dbraw/zinc/16/77/80/330167780.db2.gz KBXPILSWCUZMOS-TUAOUCFPSA-N 1 3 262.422 3.678 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CC1(C)CCC(C)CC1 ZINC000423086242 330168892 /nfs/dbraw/zinc/16/88/92/330168892.db2.gz MONHMVFSGRQYBE-TXKKKEFDSA-N 1 3 289.467 3.716 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[C@H](c2ccccc2F)C1 ZINC000423097618 330169922 /nfs/dbraw/zinc/16/99/22/330169922.db2.gz QWQWZSKMHBGDJD-XSWJXKHESA-N 1 3 290.426 3.569 20 0 CHADHO CC(C)[C@H](CN[C@@H]1CCC[C@H]1[NH3+])c1ccc(Cl)cc1 ZINC000423103284 330170532 /nfs/dbraw/zinc/17/05/32/330170532.db2.gz GGOKARODKYYONQ-ARFHVFGLSA-N 1 3 280.843 3.549 20 0 CHADHO C[C@@H](N[C@@H](C)C[C@H](C)[NH3+])c1ccc(Oc2cccnc2)cc1 ZINC000423119882 330170991 /nfs/dbraw/zinc/17/09/91/330170991.db2.gz FRIVPTGNYBDXFK-SOUVJXGZSA-N 1 3 299.418 3.650 20 0 CHADHO c1ccc([C@@H]2CCCC[C@@H]2CNC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000423153592 330173095 /nfs/dbraw/zinc/17/30/95/330173095.db2.gz HZNODBMRWLHLGL-QDSUGMFFSA-N 1 3 298.474 3.833 20 0 CHADHO Cc1ccccc1[C@@H]([NH2+]C1CCNCC1)C1CCCC1 ZINC000423180738 330175529 /nfs/dbraw/zinc/17/55/29/330175529.db2.gz IUNNXHXZRYRICA-SFHVURJKSA-N 1 3 272.436 3.568 20 0 CHADHO Cc1ccccc1[C@@H](NC1CC[NH2+]CC1)C1CCCC1 ZINC000423180738 330175531 /nfs/dbraw/zinc/17/55/31/330175531.db2.gz IUNNXHXZRYRICA-SFHVURJKSA-N 1 3 272.436 3.568 20 0 CHADHO COc1ccc([C@H](CCC(C)C)[NH2+]C2CCNCC2)cc1 ZINC000423190930 330175970 /nfs/dbraw/zinc/17/59/70/330175970.db2.gz SYMVOXNWAWOLCG-SFHVURJKSA-N 1 3 290.451 3.514 20 0 CHADHO CC(C)C[C@@H](NCCC[NH3+])c1cccc(C(F)(F)F)c1 ZINC000423195546 330176238 /nfs/dbraw/zinc/17/62/38/330176238.db2.gz SWPHNDZIEHZSMX-CQSZACIVSA-N 1 3 288.357 3.731 20 0 CHADHO NC1(C[NH2+][C@@H](c2cccnc2)C2CCC2)CCCCCC1 ZINC000423198439 330176559 /nfs/dbraw/zinc/17/65/59/330176559.db2.gz FWAZWCLYOLPOPX-QGZVFWFLSA-N 1 3 287.451 3.564 20 0 CHADHO C[C@@H](NCC1([NH3+])CCCCCC1)[C@@H]1C[C@H]1c1ccccc1 ZINC000423202566 330176755 /nfs/dbraw/zinc/17/67/55/330176755.db2.gz RCPTXICYZQXZKI-NJAFHUGGSA-N 1 3 286.463 3.820 20 0 CHADHO CC(C)[C@@H]1C[C@H](N[C@@H](C)[C@H]2CCC[NH2+]C2)c2ccccc21 ZINC000423206295 330177414 /nfs/dbraw/zinc/17/74/14/330177414.db2.gz BRWQXPMFISCLDO-LNMJFAINSA-N 1 3 286.463 3.849 20 0 CHADHO CCC[C@H](NC[C@H]1CCC[NH2+]C1)c1ccc(Cl)cc1 ZINC000423209291 330177597 /nfs/dbraw/zinc/17/75/97/330177597.db2.gz IXSBKVUEMJDLNK-BBRMVZONSA-N 1 3 280.843 3.770 20 0 CHADHO CCC[C@@H](NC[C@H]1CCC[NH2+]C1)c1ccc(Cl)cc1 ZINC000423209294 330177728 /nfs/dbraw/zinc/17/77/28/330177728.db2.gz IXSBKVUEMJDLNK-XJKSGUPXSA-N 1 3 280.843 3.770 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2N[C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000423211847 330177940 /nfs/dbraw/zinc/17/79/40/330177940.db2.gz HLBFDCNLNUOJNU-AESZEHBQSA-N 1 3 272.436 3.521 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+][C@@H](C)[C@H]1CCCNC1 ZINC000423211847 330177941 /nfs/dbraw/zinc/17/79/41/330177941.db2.gz HLBFDCNLNUOJNU-AESZEHBQSA-N 1 3 272.436 3.521 20 0 CHADHO C[C@@H](NC[C@H]1CCC[NH2+]C1)c1ccc(F)c2ccccc21 ZINC000423216912 330178828 /nfs/dbraw/zinc/17/88/28/330178828.db2.gz SNKUJVOWLBVRNX-KGLIPLIRSA-N 1 3 286.394 3.629 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCCNC1)c1ccc(F)c2ccccc21 ZINC000423216912 330178831 /nfs/dbraw/zinc/17/88/31/330178831.db2.gz SNKUJVOWLBVRNX-KGLIPLIRSA-N 1 3 286.394 3.629 20 0 CHADHO C[C@H](N[C@H]1CCCc2c3ccccc3[nH]c21)[C@@H]1CCC[NH2+]C1 ZINC000423222069 330179676 /nfs/dbraw/zinc/17/96/76/330179676.db2.gz ZMJZVKKYKFHBOR-IYOUNJFTSA-N 1 3 297.446 3.523 20 0 CHADHO C[C@H]([NH2+][C@H]1CCCc2c3ccccc3[nH]c21)[C@@H]1CCCNC1 ZINC000423222069 330179678 /nfs/dbraw/zinc/17/96/78/330179678.db2.gz ZMJZVKKYKFHBOR-IYOUNJFTSA-N 1 3 297.446 3.523 20 0 CHADHO C[C@H](N)CC[NH2+][C@@H]1CCC[C@H](c2ccc(Cl)cc2)C1 ZINC000423225570 330180086 /nfs/dbraw/zinc/18/00/86/330180086.db2.gz NGOUJUZLJLTDAA-DUVNUKRYSA-N 1 3 280.843 3.693 20 0 CHADHO C[C@H]([NH3+])CCN[C@@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000423227988 330180285 /nfs/dbraw/zinc/18/02/85/330180285.db2.gz XUKXRDLJNGQSKP-WFASDCNBSA-N 1 3 266.404 3.630 20 0 CHADHO CC[C@H](N[C@H](C[NH3+])C1CC1)c1ccc2cc(OC)ccc2c1 ZINC000423275884 330185058 /nfs/dbraw/zinc/18/50/58/330185058.db2.gz MGEBIRIFYCMULV-RBUKOAKNSA-N 1 3 298.430 3.626 20 0 CHADHO CC[C@@H](N[C@H](C[NH3+])C1CC1)c1ccc2cc(OC)ccc2c1 ZINC000423275885 330185078 /nfs/dbraw/zinc/18/50/78/330185078.db2.gz MGEBIRIFYCMULV-RTBURBONSA-N 1 3 298.430 3.626 20 0 CHADHO C[C@H](N[C@@H]1CCCC[C@@H]1C[NH3+])c1csc(Cl)c1 ZINC000423278976 330185402 /nfs/dbraw/zinc/18/54/02/330185402.db2.gz QPRYHENTJQROJB-HOSYDEDBSA-N 1 3 272.845 3.570 20 0 CHADHO CC(C)[C@@H]([NH2+]CC(C)(C)N)c1ccc(C(F)(F)F)cc1 ZINC000423280813 330185518 /nfs/dbraw/zinc/18/55/18/330185518.db2.gz AJPVFGVKBZJLMY-CYBMUJFWSA-N 1 3 288.357 3.729 20 0 CHADHO CC(C)[C@@H]([NH3+])CN[C@H](C)C(c1ccccc1)c1ccccc1 ZINC000423285887 330185775 /nfs/dbraw/zinc/18/57/75/330185775.db2.gz ZSOHQNWUGMJLNG-APWZRJJASA-N 1 3 296.458 3.780 20 0 CHADHO Cc1cccc([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000423293975 330188128 /nfs/dbraw/zinc/18/81/28/330188128.db2.gz STEKPIHGFJNNLV-CABCVRRESA-N 1 3 268.404 3.866 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@H]2CCc3c2cccc3F)cc1 ZINC000423295002 330188198 /nfs/dbraw/zinc/18/81/98/330188198.db2.gz WAYDCUGNSROIDT-SGTLLEGYSA-N 1 3 284.378 3.623 20 0 CHADHO CC(C)[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1cccnc1 ZINC000423296256 330188323 /nfs/dbraw/zinc/18/83/23/330188323.db2.gz YTDGLBTVTTVSPU-KBXCAEBGSA-N 1 3 283.419 3.588 20 0 CHADHO CCCC[C@H](CN)[NH2+][C@H](C)c1cc2cccc(OC)c2o1 ZINC000423297043 330188527 /nfs/dbraw/zinc/18/85/27/330188527.db2.gz IMTROVPGDQJSPE-TZMCWYRMSA-N 1 3 290.407 3.610 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2ccccc2)cc1 ZINC000423296804 330188610 /nfs/dbraw/zinc/18/86/10/330188610.db2.gz ZWKIAKZAJXVZFI-ZIAGYGMSSA-N 1 3 254.377 3.557 20 0 CHADHO CC[C@@H](NC[C@H](C)C[NH3+])c1ccc(Cl)c(Cl)c1 ZINC000423300888 330189143 /nfs/dbraw/zinc/18/91/43/330189143.db2.gz SJZFLKZXFBVBAQ-NOZJJQNGSA-N 1 3 275.223 3.629 20 0 CHADHO CCC[C@@H](NC[C@@]1(C)CCC[NH2+]C1)c1ccccc1 ZINC000423316977 330190042 /nfs/dbraw/zinc/19/00/42/330190042.db2.gz AZLSMDNPNMODST-SJORKVTESA-N 1 3 260.425 3.507 20 0 CHADHO CCC[C@@H]([NH2+]C[C@@]1(C)CCCNC1)c1ccccc1 ZINC000423316977 330190044 /nfs/dbraw/zinc/19/00/44/330190044.db2.gz AZLSMDNPNMODST-SJORKVTESA-N 1 3 260.425 3.507 20 0 CHADHO NC1(C[NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2)CCC1 ZINC000423324552 330190748 /nfs/dbraw/zinc/19/07/48/330190748.db2.gz KMOHMBALNJOFCY-SFHVURJKSA-N 1 3 298.405 3.581 20 0 CHADHO CCC[C@H](NC[C@@]1(C)CCC[NH2+]C1)c1ccc(OC)cc1 ZINC000423331400 330191252 /nfs/dbraw/zinc/19/12/52/330191252.db2.gz OEOJRZVSAPXRJP-ROUUACIJSA-N 1 3 290.451 3.516 20 0 CHADHO CCC[C@H]([NH2+]C[C@@]1(C)CCCNC1)c1ccc(OC)cc1 ZINC000423331400 330191254 /nfs/dbraw/zinc/19/12/54/330191254.db2.gz OEOJRZVSAPXRJP-ROUUACIJSA-N 1 3 290.451 3.516 20 0 CHADHO C[C@@]1(CN[C@@H]2CCCc3c4ccccc4[nH]c32)CCC[NH2+]C1 ZINC000423343019 330192076 /nfs/dbraw/zinc/19/20/76/330192076.db2.gz NILBPYYBWJGXTP-IEBWSBKVSA-N 1 3 297.446 3.525 20 0 CHADHO C[C@@]1(C[NH2+][C@@H]2CCCc3c4ccccc4[nH]c32)CCCNC1 ZINC000423343019 330192077 /nfs/dbraw/zinc/19/20/77/330192077.db2.gz NILBPYYBWJGXTP-IEBWSBKVSA-N 1 3 297.446 3.525 20 0 CHADHO Cc1cc2cc([C@@H](C)NCC3=CC[NH2+]CC3)oc2cc1C ZINC000423345377 330192276 /nfs/dbraw/zinc/19/22/76/330192276.db2.gz NVGHPRZIVJETNS-CQSZACIVSA-N 1 3 284.403 3.620 20 0 CHADHO C[C@@H](NC[C@@]1(C)CCC[NH2+]C1)c1cc2ccccc2s1 ZINC000423351348 330192720 /nfs/dbraw/zinc/19/27/20/330192720.db2.gz YWPTVKPJFNEULI-DYVFJYSZSA-N 1 3 288.460 3.942 20 0 CHADHO C[C@@H]([NH2+]C[C@@]1(C)CCCNC1)c1cc2ccccc2s1 ZINC000423351348 330192722 /nfs/dbraw/zinc/19/27/22/330192722.db2.gz YWPTVKPJFNEULI-DYVFJYSZSA-N 1 3 288.460 3.942 20 0 CHADHO C[C@H](NC[C@@]1(C)CCC[NH2+]C1)c1cc2ccccc2s1 ZINC000423351349 330192916 /nfs/dbraw/zinc/19/29/16/330192916.db2.gz YWPTVKPJFNEULI-GUYCJALGSA-N 1 3 288.460 3.942 20 0 CHADHO C[C@H]([NH2+]C[C@@]1(C)CCCNC1)c1cc2ccccc2s1 ZINC000423351349 330192918 /nfs/dbraw/zinc/19/29/18/330192918.db2.gz YWPTVKPJFNEULI-GUYCJALGSA-N 1 3 288.460 3.942 20 0 CHADHO C[C@@H]1CC[C@@H](NC[C@]2(C)CCC[NH2+]C2)c2sccc21 ZINC000423350149 330192942 /nfs/dbraw/zinc/19/29/42/330192942.db2.gz XBJVYHUUTURBNA-XNRPHZJLSA-N 1 3 278.465 3.666 20 0 CHADHO C[C@@H]1CC[C@@H]([NH2+]C[C@]2(C)CCCNC2)c2sccc21 ZINC000423350149 330192944 /nfs/dbraw/zinc/19/29/44/330192944.db2.gz XBJVYHUUTURBNA-XNRPHZJLSA-N 1 3 278.465 3.666 20 0 CHADHO C[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccc(Cl)s1 ZINC000423354185 330193086 /nfs/dbraw/zinc/19/30/86/330193086.db2.gz FPTNSTVAOCPGHW-JTQLQIEISA-N 1 3 292.835 3.856 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CNC3)CC(C)(C)C1 ZINC000423354832 330193174 /nfs/dbraw/zinc/19/31/74/330193174.db2.gz HDMNZDGLKTUBLH-CXAGYDPISA-N 1 3 272.436 3.594 20 0 CHADHO Clc1cccc([C@@H]2CC[C@H](NCC[C@H]3CCC[NH2+]3)C2)c1 ZINC000423355546 330193273 /nfs/dbraw/zinc/19/32/73/330193273.db2.gz ICLGJFMNAYVBLN-OIISXLGYSA-N 1 3 292.854 3.708 20 0 CHADHO N[C@@H]1CCC[C@@H]([NH2+][C@@H](Cc2ccccc2Cl)C2CC2)C1 ZINC000423360968 330193713 /nfs/dbraw/zinc/19/37/13/330193713.db2.gz GILUCECUHZKJHF-INMHGKMJSA-N 1 3 292.854 3.521 20 0 CHADHO Clc1ccc([C@H]2CC[C@H](NCC[C@H]3CCC[NH2+]3)C2)cc1 ZINC000423362947 330194006 /nfs/dbraw/zinc/19/40/06/330194006.db2.gz UGAPFSGOYNPNGI-UAGQMJEPSA-N 1 3 292.854 3.708 20 0 CHADHO CCC[C@H]([NH2+][C@H]1CCC[C@H](N)C1)C1CCCCC1 ZINC000423363720 330194238 /nfs/dbraw/zinc/19/42/38/330194238.db2.gz AGKKMXZKUSUKNC-JYJNAYRXSA-N 1 3 252.446 3.595 20 0 CHADHO CC[C@@H](C)C[C@H](CC)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423364379 330194389 /nfs/dbraw/zinc/19/43/89/330194389.db2.gz VUJMABWJNJGGDT-DYVFJYSZSA-N 1 3 260.425 3.594 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)[C@@H](C)c1ccc(Cl)cc1 ZINC000423371319 330195295 /nfs/dbraw/zinc/19/52/95/330195295.db2.gz FJBKJGVCICUFBS-NFFDBFGFSA-N 1 3 280.843 3.562 20 0 CHADHO C[C@H](N[C@@H]1CC[NH2+][C@H](C)C1)[C@@H](C)c1ccc(Cl)cc1 ZINC000423371319 330195296 /nfs/dbraw/zinc/19/52/96/330195296.db2.gz FJBKJGVCICUFBS-NFFDBFGFSA-N 1 3 280.843 3.562 20 0 CHADHO CC(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423371498 330195390 /nfs/dbraw/zinc/19/53/90/330195390.db2.gz GJEMTMFKBZZEMG-ROUUACIJSA-N 1 3 272.436 3.594 20 0 CHADHO Cc1cc(C)cc([C@@H](C)NCc2ccc3c(c2)C[NH2+]C3)c1 ZINC000423396823 330195560 /nfs/dbraw/zinc/19/55/60/330195560.db2.gz SSUGVTFJVNTPNF-OAHLLOKOSA-N 1 3 280.415 3.757 20 0 CHADHO CC(C)Cc1ccc([C@H](C)[NH2+][C@H]2CCN[C@@H](C)C2)cc1 ZINC000423399348 330195804 /nfs/dbraw/zinc/19/58/04/330195804.db2.gz VTNVWUOSJKTIML-MPGHIAIKSA-N 1 3 274.452 3.676 20 0 CHADHO C[C@H](N[C@H]1CC[NH2+]C[C@H]1C)c1cc2ccccc2s1 ZINC000423397744 330195910 /nfs/dbraw/zinc/19/59/10/330195910.db2.gz OLFSNWBZUFHJIR-DYEKYZERSA-N 1 3 274.433 3.550 20 0 CHADHO C[C@H]([NH2+][C@H]1CCNC[C@H]1C)c1cc2ccccc2s1 ZINC000423397744 330195911 /nfs/dbraw/zinc/19/59/11/330195911.db2.gz OLFSNWBZUFHJIR-DYEKYZERSA-N 1 3 274.433 3.550 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@@H]1N[C@@H](Cc1ccccc1)c1ccccc1 ZINC000423400735 330195951 /nfs/dbraw/zinc/19/59/51/330195951.db2.gz QHGCSGQQVLNRHU-UXPWSPDFSA-N 1 3 294.442 3.558 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H](Cc1ccccc1)c1ccccc1 ZINC000423400735 330195952 /nfs/dbraw/zinc/19/59/52/330195952.db2.gz QHGCSGQQVLNRHU-UXPWSPDFSA-N 1 3 294.442 3.558 20 0 CHADHO CC[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)c1ccc(OC(F)F)cc1 ZINC000423406081 330196547 /nfs/dbraw/zinc/19/65/47/330196547.db2.gz YKTQIASOKDGXLI-IPYPFGDCSA-N 1 3 298.377 3.599 20 0 CHADHO Cc1ccc2c(c1)[C@@H](NCc1ccc3c(c1)C[NH2+]C3)[C@@H](C)C2 ZINC000423375897 330198572 /nfs/dbraw/zinc/19/85/72/330198572.db2.gz IXNUHVNRMUBWGC-XOBRGWDASA-N 1 3 292.426 3.621 20 0 CHADHO CCc1ccc([C@H](N[C@@H]2CC[NH2+][C@H](C)C2)C(C)C)cc1 ZINC000423378619 330199010 /nfs/dbraw/zinc/19/90/10/330199010.db2.gz MIEAGSSLVZDOHO-ZTFGCOKTSA-N 1 3 274.452 3.676 20 0 CHADHO CCc1ccc([C@H]([NH2+][C@@H]2CCN[C@H](C)C2)C(C)C)cc1 ZINC000423378619 330199012 /nfs/dbraw/zinc/19/90/12/330199012.db2.gz MIEAGSSLVZDOHO-ZTFGCOKTSA-N 1 3 274.452 3.676 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCN[C@H](C)C1)c1ccc(Cl)cc1 ZINC000423379811 330199059 /nfs/dbraw/zinc/19/90/59/330199059.db2.gz NHRGXNVNWGNZTJ-UGFHNGPFSA-N 1 3 266.816 3.521 20 0 CHADHO Cc1cc([C@H](C)NCc2ccc3c(c2)C[NH2+]C3)cs1 ZINC000423386587 330199574 /nfs/dbraw/zinc/19/95/74/330199574.db2.gz LYVPIQAVHIDOAZ-LBPRGKRZSA-N 1 3 272.417 3.511 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@H]1CCCCc2ccc(Cl)cc21 ZINC000423384470 330199663 /nfs/dbraw/zinc/19/96/63/330199663.db2.gz FZRUGERXVRNKBJ-JLZZUVOBSA-N 1 3 292.854 3.695 20 0 CHADHO CC(C)[C@@H](CSc1ccccc1)[NH2+][C@H]1CCN[C@H](C)C1 ZINC000423384682 330199777 /nfs/dbraw/zinc/19/97/77/330199777.db2.gz QGSJHDWNUBFZAA-HLLBOEOZSA-N 1 3 292.492 3.533 20 0 CHADHO CC(C)[C@@H](CSc1ccccc1)N[C@H]1CC[NH2+][C@H](C)C1 ZINC000423384682 330199778 /nfs/dbraw/zinc/19/97/78/330199778.db2.gz QGSJHDWNUBFZAA-HLLBOEOZSA-N 1 3 292.492 3.533 20 0 CHADHO c1ccc2c(c1)CCCC[C@H]2NCc1ccc2c(c1)C[NH2+]C2 ZINC000423387433 330199955 /nfs/dbraw/zinc/19/99/55/330199955.db2.gz MSYJOJUSMVOLCL-HXUWFJFHSA-N 1 3 292.426 3.847 20 0 CHADHO COc1ccc([C@H](C)N[C@H]2CCC[C@H]([NH3+])C2)c2ccccc12 ZINC000423394395 330200666 /nfs/dbraw/zinc/20/06/66/330200666.db2.gz RKGLEHXYAPKXIE-KKUMJFAQSA-N 1 3 298.430 3.769 20 0 CHADHO CCC[C@H]([NH2+][C@@H](C)[C@H](C)N)c1cccc(C(F)(F)F)c1 ZINC000423451875 330202911 /nfs/dbraw/zinc/20/29/11/330202911.db2.gz VQBVNQTYWMPJNL-MJVIPROJSA-N 1 3 288.357 3.872 20 0 CHADHO CC[C@H](N)C[NH2+][C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423455627 330203620 /nfs/dbraw/zinc/20/36/20/330203620.db2.gz CUDCFYSZYOROPA-GJZGRUSLSA-N 1 3 266.816 3.508 20 0 CHADHO CC[C@H](N)C[NH2+][C@H](C)c1ccc(SC(C)C)cc1 ZINC000423465030 330204329 /nfs/dbraw/zinc/20/43/29/330204329.db2.gz MJHYRGOGLFEYLO-OCCSQVGLSA-N 1 3 266.454 3.575 20 0 CHADHO C[C@H](CCC[NH3+])N[C@@H](C)c1cc(Cl)sc1Cl ZINC000423465513 330204458 /nfs/dbraw/zinc/20/44/58/330204458.db2.gz WOBWCXNXMWQYAU-SFYZADRCSA-N 1 3 281.252 3.833 20 0 CHADHO COc1ccc(Cl)cc1[C@@H](C)NCCC[C@@H]1CCC[NH2+]1 ZINC000423474815 330205366 /nfs/dbraw/zinc/20/53/66/330205366.db2.gz HNRDPPPTBLLQCC-TZMCWYRMSA-N 1 3 296.842 3.531 20 0 CHADHO CC[C@@H](N)C[NH2+][C@@H](C)c1ccc(-c2cccs2)cc1 ZINC000423484757 330206616 /nfs/dbraw/zinc/20/66/16/330206616.db2.gz YWVLGMQJCRQDQS-SWLSCSKDSA-N 1 3 274.433 3.803 20 0 CHADHO CC[C@H](NCCC[C@@H]1CCC[NH2+]1)c1cc(F)ccc1F ZINC000423490676 330207377 /nfs/dbraw/zinc/20/73/77/330207377.db2.gz XYDBOGVXNSRFBG-BBRMVZONSA-N 1 3 282.378 3.538 20 0 CHADHO C[C@H](N[C@@H]1CC[C@@H](C[NH3+])C1)c1cc(Cl)sc1Cl ZINC000423494179 330207649 /nfs/dbraw/zinc/20/76/49/330207649.db2.gz RWQPYCVIAUPYEH-DJLDLDEBSA-N 1 3 293.263 3.833 20 0 CHADHO COc1ccc([C@@H](C)N[C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423494257 330207695 /nfs/dbraw/zinc/20/76/95/330207695.db2.gz AJZURGZOWWWEHA-DNVCBOLYSA-N 1 3 298.430 3.826 20 0 CHADHO C[C@@H](N[C@H](CCC[NH3+])c1ccccc1)c1ccc(F)cc1 ZINC000423496884 330207791 /nfs/dbraw/zinc/20/77/91/330207791.db2.gz FRZGMDMNUJKTMU-RDTXWAMCSA-N 1 3 286.394 3.957 20 0 CHADHO [NH3+]CCC[C@@H](N[C@@H]1CCc2ccc(F)cc21)c1ccccc1 ZINC000423507725 330209095 /nfs/dbraw/zinc/20/90/95/330209095.db2.gz QHDTXCSJRKUZQB-RTBURBONSA-N 1 3 298.405 3.883 20 0 CHADHO Clc1ccc([C@@H]2CC[C@H]([NH2+]CCCNC3CC3)C2)cc1 ZINC000423542839 330211221 /nfs/dbraw/zinc/21/12/21/330211221.db2.gz BDVKPMYTMNBUGD-PBHICJAKSA-N 1 3 292.854 3.708 20 0 CHADHO C[C@H](NCCC1=CC[NH2+]CC1)c1ccc(-c2ccccc2)o1 ZINC000423544521 330211374 /nfs/dbraw/zinc/21/13/74/330211374.db2.gz WXFTWPLOEVVKPU-HNNXBMFYSA-N 1 3 296.414 3.907 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC000527227748 330239078 /nfs/dbraw/zinc/23/90/78/330239078.db2.gz XLBDBOPNYCBHNO-OAHLLOKOSA-N 1 3 296.405 3.834 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]CCCN2CCCC[C@@H]2C)s1 ZINC000036122760 330249731 /nfs/dbraw/zinc/24/97/31/330249731.db2.gz NZAXWRHAJZKZCT-DZGCQCFKSA-N 1 3 280.481 3.972 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](CC)CCc2ccccc2)C1 ZINC000527855327 330288902 /nfs/dbraw/zinc/28/89/02/330288902.db2.gz WAYUZHBNFUUNNI-RTBURBONSA-N 1 3 288.479 3.719 20 0 CHADHO CC(C)c1cccc([C@@H](C)NC[C@H]2CCC[N@H+](C)C2)c1 ZINC000527861498 330289337 /nfs/dbraw/zinc/28/93/37/330289337.db2.gz LNYTUUFKGGXONE-HZPDHXFCSA-N 1 3 274.452 3.802 20 0 CHADHO CC(C)c1cccc([C@@H](C)NC[C@H]2CCC[N@@H+](C)C2)c1 ZINC000527861498 330289338 /nfs/dbraw/zinc/28/93/38/330289338.db2.gz LNYTUUFKGGXONE-HZPDHXFCSA-N 1 3 274.452 3.802 20 0 CHADHO CC[C@@H](NC[C@H]1CCC[N@H+](C)C1)c1ccc(Cl)cc1 ZINC000044534529 330329948 /nfs/dbraw/zinc/32/99/48/330329948.db2.gz GLGNASSGKSZMHC-CZUORRHYSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1 ZINC000044534529 330329949 /nfs/dbraw/zinc/32/99/49/330329949.db2.gz GLGNASSGKSZMHC-CZUORRHYSA-N 1 3 280.843 3.723 20 0 CHADHO C1CC([C@@H]([NH2+][C@@H]2CCN3CCC[C@H]3C2)C2CCCCC2)C1 ZINC000424273275 330333325 /nfs/dbraw/zinc/33/33/25/330333325.db2.gz WGACJLHUNYJCMQ-QYZOEREBSA-N 1 3 290.495 3.952 20 0 CHADHO CCCC1CCC([NH2+][C@H]2CCN3CCC[C@@H]3C2)CC1 ZINC000106868924 330341448 /nfs/dbraw/zinc/34/14/48/330341448.db2.gz WPAMHESSDJMMPT-SJJHQCBESA-N 1 3 264.457 3.562 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)[N@@H+]1CC[C@@H]2[C@@H](CCCN2C)C1 ZINC000445438176 330347824 /nfs/dbraw/zinc/34/78/24/330347824.db2.gz FCSCDFJSSWCHEI-UIAACRFSSA-N 1 3 298.474 3.652 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)[N@H+]1CC[C@@H]2[C@@H](CCCN2C)C1 ZINC000445438176 330347825 /nfs/dbraw/zinc/34/78/25/330347825.db2.gz FCSCDFJSSWCHEI-UIAACRFSSA-N 1 3 298.474 3.652 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000445438176 330347826 /nfs/dbraw/zinc/34/78/26/330347826.db2.gz FCSCDFJSSWCHEI-UIAACRFSSA-N 1 3 298.474 3.652 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000445438176 330347827 /nfs/dbraw/zinc/34/78/27/330347827.db2.gz FCSCDFJSSWCHEI-UIAACRFSSA-N 1 3 298.474 3.652 20 0 CHADHO Cc1cc2c(cc1C)[C@H]([NH2+][C@@H]1CCCC[C@H]1N)CCS2 ZINC000424374453 330348412 /nfs/dbraw/zinc/34/84/12/330348412.db2.gz LCVMBILKHQUKOV-BZUAXINKSA-N 1 3 290.476 3.700 20 0 CHADHO CCc1cc(N2CCC[C@@H]([NH+](C)C)CC2)c2ccccc2n1 ZINC000428669550 330529249 /nfs/dbraw/zinc/52/92/49/330529249.db2.gz KIBNWTNHMPJXPB-MRXNPFEDSA-N 1 3 297.446 3.718 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@@H]([NH2+]CCCN2CCCC2)C1 ZINC000437776268 330708399 /nfs/dbraw/zinc/70/83/99/330708399.db2.gz OYFUNVWVKMMFHO-MOPGFXCFSA-N 1 3 286.463 3.572 20 0 CHADHO C[C@H](CC(C)(C)C)[NH2+]CC1CCN(c2ccncc2)CC1 ZINC000449253375 330910032 /nfs/dbraw/zinc/91/00/32/330910032.db2.gz SUBOMWCAEMEATN-OAHLLOKOSA-N 1 3 289.467 3.712 20 0 CHADHO CC[C@@H]1C[C@H]1C[NH2+]C1CCN([C@@H]2CCC[C@@H](C)C2)CC1 ZINC000449486092 330930024 /nfs/dbraw/zinc/93/00/24/330930024.db2.gz SPMUEKDIISPOPE-XLMAVXFVSA-N 1 3 278.484 3.665 20 0 CHADHO C1CC1[C@H]([NH2+]C1CCN(C2CCCC2)CC1)C1CCCC1 ZINC000453124448 331091640 /nfs/dbraw/zinc/09/16/40/331091640.db2.gz GMXMYURVOQOBHV-LJQANCHMSA-N 1 3 290.495 3.952 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)CCc2cccc(Cl)c2)C[C@H]1C ZINC000459385500 331279408 /nfs/dbraw/zinc/27/94/08/331279408.db2.gz YPNDSKUYMQCEET-PBHICJAKSA-N 1 3 294.870 3.687 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)CCc2cccc(Cl)c2)C[C@H]1C ZINC000459385500 331279409 /nfs/dbraw/zinc/27/94/09/331279409.db2.gz YPNDSKUYMQCEET-PBHICJAKSA-N 1 3 294.870 3.687 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+]C2CC(C)(c3ccccc3)C2)C1 ZINC000459432641 331281070 /nfs/dbraw/zinc/28/10/70/331281070.db2.gz UAILNEZRRSLLLG-TXQGORRRSA-N 1 3 286.463 3.569 20 0 CHADHO C[NH+](C)[C@@H]1CCC[C@@H](NC2CC(C)(c3ccccc3)C2)C1 ZINC000459432641 331281071 /nfs/dbraw/zinc/28/10/71/331281071.db2.gz UAILNEZRRSLLLG-TXQGORRRSA-N 1 3 286.463 3.569 20 0 CHADHO CC[C@H]1CC[C@H]([NH2+]C2CCN(c3ccncc3)CC2)CC1 ZINC000459594106 331289826 /nfs/dbraw/zinc/28/98/26/331289826.db2.gz RIQAUQZDVQGNOY-WKILWMFISA-N 1 3 287.451 3.609 20 0 CHADHO CCN1CC[C@H](C[NH2+]Cc2ccc(C3CCCC3)cc2)C1 ZINC000462799865 331329629 /nfs/dbraw/zinc/32/96/29/331329629.db2.gz YTPUTBLTDVNIIE-QGZVFWFLSA-N 1 3 286.463 3.776 20 0 CHADHO Cc1cc(N(C)CC[C@H]2CCCC[N@@H+]2C)c2ccccc2n1 ZINC000463077360 331339595 /nfs/dbraw/zinc/33/95/95/331339595.db2.gz KMRXQGDXWBYEHT-MRXNPFEDSA-N 1 3 297.446 3.854 20 0 CHADHO Cc1cc(N(C)CC[C@H]2CCCC[N@H+]2C)c2ccccc2n1 ZINC000463077360 331339596 /nfs/dbraw/zinc/33/95/96/331339596.db2.gz KMRXQGDXWBYEHT-MRXNPFEDSA-N 1 3 297.446 3.854 20 0 CHADHO C[C@@H]1CC[C@@H](C[NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000475567564 331637908 /nfs/dbraw/zinc/63/79/08/331637908.db2.gz CZXPNOHPHAWIND-HZPDHXFCSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H]([NH2+]C1CCC2(CC2)CC1)[C@H]1CCCN(C2CCC2)C1 ZINC000488508858 332014609 /nfs/dbraw/zinc/01/46/09/332014609.db2.gz UNYIZGSNWATALE-CVEARBPZSA-N 1 3 290.495 3.952 20 0 CHADHO C[NH+](C)CCCC1CCN(Cc2ccc(Cl)cc2)CC1 ZINC000501805586 332641458 /nfs/dbraw/zinc/64/14/58/332641458.db2.gz OVZLDEQSDRBYRE-UHFFFAOYSA-N 1 3 294.870 3.894 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)C1 ZINC000566481473 334651854 /nfs/dbraw/zinc/65/18/54/334651854.db2.gz DDEWODXUURBRSY-XJKCOSOUSA-N 1 3 296.817 3.790 20 0 CHADHO C[C@H]1CCC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000513074752 333002916 /nfs/dbraw/zinc/00/29/16/333002916.db2.gz JEZIIEMNWLYRLZ-RDJZCZTQSA-N 1 3 278.484 3.952 20 0 CHADHO C[C@@H]1C[C@H](CCNCc2ccco2)C[N@@H+]1Cc1ccccc1 ZINC000513508615 333023537 /nfs/dbraw/zinc/02/35/37/333023537.db2.gz YTZSQFNCJSFMSF-AEFFLSMTSA-N 1 3 298.430 3.670 20 0 CHADHO C[C@@H]1C[C@H](CCNCc2ccco2)C[N@H+]1Cc1ccccc1 ZINC000513508615 333023538 /nfs/dbraw/zinc/02/35/38/333023538.db2.gz YTZSQFNCJSFMSF-AEFFLSMTSA-N 1 3 298.430 3.670 20 0 CHADHO c1ccc(CN2C[C@@H]3CCCC[C@@H]([NH2+]C4CCC4)[C@@H]3C2)cc1 ZINC000513656742 333029920 /nfs/dbraw/zinc/02/99/20/333029920.db2.gz XBWNRRMEQNUSPT-DFQSSKMNSA-N 1 3 298.474 3.819 20 0 CHADHO CSC1(CNCCC[N@H+](C)C2CCCCC2)CCC1 ZINC000336809358 335120247 /nfs/dbraw/zinc/12/02/47/335120247.db2.gz VEOJBSQPKINFRE-UHFFFAOYSA-N 1 3 284.513 3.516 20 0 CHADHO CSC1(CNCCC[N@@H+](C)C2CCCCC2)CCC1 ZINC000336809358 335120248 /nfs/dbraw/zinc/12/02/48/335120248.db2.gz VEOJBSQPKINFRE-UHFFFAOYSA-N 1 3 284.513 3.516 20 0 CHADHO CSC1(C[NH2+]CCCN(C)C2CCCCC2)CCC1 ZINC000336809358 335120250 /nfs/dbraw/zinc/12/02/50/335120250.db2.gz VEOJBSQPKINFRE-UHFFFAOYSA-N 1 3 284.513 3.516 20 0 CHADHO C/C(=C/c1ccccc1)C[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000521236554 333116085 /nfs/dbraw/zinc/11/60/85/333116085.db2.gz KLRWAUXIMCVACE-LYPXWFNGSA-N 1 3 286.463 3.800 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](N[C@@H](c2cccs2)C2CCCC2)C1 ZINC000222956181 333202936 /nfs/dbraw/zinc/20/29/36/333202936.db2.gz MEGUKERRJXGUAX-IIAWOOMASA-N 1 3 278.465 3.839 20 0 CHADHO CC(C)[C@H]([NH2+]CCCN(C)C(C)C)c1ccccc1 ZINC000223025102 333203411 /nfs/dbraw/zinc/20/34/11/333203411.db2.gz FKJWLTKZBVJMPV-KRWDZBQOSA-N 1 3 262.441 3.704 20 0 CHADHO CCCC[C@@H](CCC)[NH2+]C1CCN(c2ccncc2)CC1 ZINC000226001239 333245240 /nfs/dbraw/zinc/24/52/40/333245240.db2.gz AUSABYQWVFTYQY-MRXNPFEDSA-N 1 3 289.467 3.999 20 0 CHADHO C[C@H](c1ccccc1F)N1CCC(C[NH+]2CCCC2)CC1 ZINC000194740684 333276948 /nfs/dbraw/zinc/27/69/48/333276948.db2.gz POLBPPPUXOWCSE-OAHLLOKOSA-N 1 3 290.426 3.695 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CCC[C@@H]([C@H](C)[NH3+])C2)cc1 ZINC000227183770 333277634 /nfs/dbraw/zinc/27/76/34/333277634.db2.gz PMZCRRSZHVWILH-RLFYNMQTSA-N 1 3 274.452 3.930 20 0 CHADHO CC(C)C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCN3CCC[C@@H]3C2)C1 ZINC000230773858 333321707 /nfs/dbraw/zinc/32/17/07/333321707.db2.gz ITPKZSZPYZOKTL-WNRNVDISSA-N 1 3 278.484 3.808 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](Cc2c(C)cc(C)cc2C)C1 ZINC000524766772 333387259 /nfs/dbraw/zinc/38/72/59/333387259.db2.gz BHNCKHNDSJETJZ-SFHVURJKSA-N 1 3 288.479 3.776 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](Cc2c(C)cc(C)cc2C)C1 ZINC000524766772 333387260 /nfs/dbraw/zinc/38/72/60/333387260.db2.gz BHNCKHNDSJETJZ-SFHVURJKSA-N 1 3 288.479 3.776 20 0 CHADHO C1=CC[C@H](CC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCCN2)CC1 ZINC000530217477 333528564 /nfs/dbraw/zinc/52/85/64/333528564.db2.gz HAFYDKBGUFCUQC-XLAORIBOSA-N 1 3 276.468 3.633 20 0 CHADHO CC[C@H](C)C[C@H](CC)[NH2+]CCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000539074066 333655493 /nfs/dbraw/zinc/65/54/93/333655493.db2.gz TXIDWQVVZQGFBX-XSLAGTTESA-N 1 3 298.515 3.680 20 0 CHADHO C[C@H](CCC(F)(F)F)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000541552919 333779658 /nfs/dbraw/zinc/77/96/58/333779658.db2.gz WLMRAWIATLXCTO-SNVBAGLBSA-N 1 3 280.378 3.616 20 0 CHADHO CC[C@H](c1ccccc1)N1CC[C@H](C[NH+](CC)CC)C1 ZINC000076002081 334065989 /nfs/dbraw/zinc/06/59/89/334065989.db2.gz LYOOWHYPBOQGCH-SJLPKXTDSA-N 1 3 274.452 3.801 20 0 CHADHO CC[C@H](c1ccccc1)[N@@H+]1CC[C@H](CN(CC)CC)C1 ZINC000076002081 334065990 /nfs/dbraw/zinc/06/59/90/334065990.db2.gz LYOOWHYPBOQGCH-SJLPKXTDSA-N 1 3 274.452 3.801 20 0 CHADHO CC[C@H](c1ccccc1)[N@H+]1CC[C@H](CN(CC)CC)C1 ZINC000076002081 334065991 /nfs/dbraw/zinc/06/59/91/334065991.db2.gz LYOOWHYPBOQGCH-SJLPKXTDSA-N 1 3 274.452 3.801 20 0 CHADHO CCCC[C@@H](COC)NC1CC[NH+](C2CCCCC2)CC1 ZINC000133986584 334076640 /nfs/dbraw/zinc/07/66/40/334076640.db2.gz BIULIQPWMLATKT-KRWDZBQOSA-N 1 3 296.499 3.578 20 0 CHADHO CCCC[C@@H](COC)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000133986584 334076642 /nfs/dbraw/zinc/07/66/42/334076642.db2.gz BIULIQPWMLATKT-KRWDZBQOSA-N 1 3 296.499 3.578 20 0 CHADHO CCC[C@H](CC)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000134111398 334080713 /nfs/dbraw/zinc/08/07/13/334080713.db2.gz CMUJLEKWAZIFEG-HNNXBMFYSA-N 1 3 266.473 3.952 20 0 CHADHO CC1(C)CC([NH2+][C@@H]2CCC[C@@H](C3CC3)C2)CC(C)(C)N1 ZINC000081625777 334200929 /nfs/dbraw/zinc/20/09/29/334200929.db2.gz KDLQVGYITWPBDT-HUUCEWRRSA-N 1 3 278.484 3.854 20 0 CHADHO CCc1cccc(F)c1CNCCCCC[NH+]1CCCC1 ZINC000549869765 334207664 /nfs/dbraw/zinc/20/76/64/334207664.db2.gz ZHXLGVSZNMRLRP-UHFFFAOYSA-N 1 3 292.442 3.744 20 0 CHADHO C[C@@H]1CN(CC[C@H]2CCC[N@@H+]2C)CC[C@H]1c1ccccc1 ZINC000245688333 334212666 /nfs/dbraw/zinc/21/26/66/334212666.db2.gz PYKGCJGKGOSFAL-BHIYHBOVSA-N 1 3 286.463 3.596 20 0 CHADHO C[C@@H]1CN(CC[C@H]2CCC[N@H+]2C)CC[C@H]1c1ccccc1 ZINC000245688333 334212668 /nfs/dbraw/zinc/21/26/68/334212668.db2.gz PYKGCJGKGOSFAL-BHIYHBOVSA-N 1 3 286.463 3.596 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](C)C(C)(C)c2ccccc2)C1 ZINC000246984737 334273412 /nfs/dbraw/zinc/27/34/12/334273412.db2.gz JXHYHKFVKKVEIZ-IAGOWNOFSA-N 1 3 288.479 3.674 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](CC)c2cccs2)C1 ZINC000246992321 334273454 /nfs/dbraw/zinc/27/34/54/334273454.db2.gz KGQQACVVVRFEQX-UONOGXRCSA-N 1 3 266.454 3.521 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@H](c2ccc(C)cc2)C2CC2)C1 ZINC000245939246 334224904 /nfs/dbraw/zinc/22/49/04/334224904.db2.gz ANOQLZNYPUDACM-QFBILLFUSA-N 1 3 286.463 3.768 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@H](c2ccc(C)cc2)C2CC2)C1 ZINC000245939246 334224905 /nfs/dbraw/zinc/22/49/05/334224905.db2.gz ANOQLZNYPUDACM-QFBILLFUSA-N 1 3 286.463 3.768 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](c2ccc(C)cc2)C2CC2)C1 ZINC000245939246 334224906 /nfs/dbraw/zinc/22/49/06/334224906.db2.gz ANOQLZNYPUDACM-QFBILLFUSA-N 1 3 286.463 3.768 20 0 CHADHO CC1(C)CCC[C@@H]1C[NH2+]C1CCN(C2CCCC2)CC1 ZINC000550933565 334234044 /nfs/dbraw/zinc/23/40/44/334234044.db2.gz LAMAFVZEXHJPGK-OAHLLOKOSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H](NC[C@@H]1CCC[N@H+](C)C1)c1cccc(C2CC2)c1 ZINC000551050624 334237128 /nfs/dbraw/zinc/23/71/28/334237128.db2.gz JKAHUXPTOMLHHN-CABCVRRESA-N 1 3 272.436 3.556 20 0 CHADHO C[C@@H](NC[C@@H]1CCC[N@@H+](C)C1)c1cccc(C2CC2)c1 ZINC000551050624 334237130 /nfs/dbraw/zinc/23/71/30/334237130.db2.gz JKAHUXPTOMLHHN-CABCVRRESA-N 1 3 272.436 3.556 20 0 CHADHO CC[C@@H](c1ccc(F)cc1F)[N@H+](C)C[C@H]1CCCN(C)C1 ZINC000246766043 334269217 /nfs/dbraw/zinc/26/92/17/334269217.db2.gz GRATUCOPKOSWEC-GUYCJALGSA-N 1 3 296.405 3.690 20 0 CHADHO CC[C@@H](c1ccc(F)cc1F)[N@@H+](C)C[C@H]1CCCN(C)C1 ZINC000246766043 334269218 /nfs/dbraw/zinc/26/92/18/334269218.db2.gz GRATUCOPKOSWEC-GUYCJALGSA-N 1 3 296.405 3.690 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H]2CC[C@H](C)c3ccccc32)C1 ZINC000246860060 334270837 /nfs/dbraw/zinc/27/08/37/334270837.db2.gz CZHKJGQBPMDUEL-DAYGRLMNSA-N 1 3 272.436 3.556 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H]2CC[C@H](C)c3ccccc32)C1 ZINC000246860060 334270838 /nfs/dbraw/zinc/27/08/38/334270838.db2.gz CZHKJGQBPMDUEL-DAYGRLMNSA-N 1 3 272.436 3.556 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H]2CC[C@H](C)c3ccccc32)C1 ZINC000246860060 334270839 /nfs/dbraw/zinc/27/08/39/334270839.db2.gz CZHKJGQBPMDUEL-DAYGRLMNSA-N 1 3 272.436 3.556 20 0 CHADHO Cc1c[nH+]ccc1N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000248666549 334312107 /nfs/dbraw/zinc/31/21/07/334312107.db2.gz OEPSFQIUQNBUPY-WMZOPIPTSA-N 1 3 295.430 3.855 20 0 CHADHO CCCN1CC[C@H](C[NH2+]CC[C@H](C)c2ccccc2)C1 ZINC000249041515 334325679 /nfs/dbraw/zinc/32/56/79/334325679.db2.gz UVQNXENBKAEVQT-DLBZAZTESA-N 1 3 274.452 3.502 20 0 CHADHO c1ccc2c(c1)CCCC[C@@H]2N[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000250529943 334345707 /nfs/dbraw/zinc/34/57/07/334345707.db2.gz KGYBEUXMEKWTNH-LNLFQRSKSA-N 1 3 284.447 3.671 20 0 CHADHO c1ccc2c(c1)CCCC[C@@H]2N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000250529943 334345709 /nfs/dbraw/zinc/34/57/09/334345709.db2.gz KGYBEUXMEKWTNH-LNLFQRSKSA-N 1 3 284.447 3.671 20 0 CHADHO C[C@@H]1CN(Cc2ccc(-c3ccccc3)cc2)CC[C@H]1[NH3+] ZINC000251676219 334366559 /nfs/dbraw/zinc/36/65/59/334366559.db2.gz HOZPSIKIMBSFJW-DNVCBOLYSA-N 1 3 280.415 3.523 20 0 CHADHO CC(C)(C)C1CCC([NH2+][C@@H]2CCN3CCC[C@H]3C2)CC1 ZINC000252673755 334384909 /nfs/dbraw/zinc/38/49/09/334384909.db2.gz LZTKVVINMWYDFB-BACDZXNISA-N 1 3 278.484 3.808 20 0 CHADHO CCc1ccc([C@H](C)NCc2ccc(C[NH3+])cc2)cc1 ZINC000567235405 334696422 /nfs/dbraw/zinc/69/64/22/334696422.db2.gz JGQCQIWFRZISNV-AWEZNQCLSA-N 1 3 268.404 3.559 20 0 CHADHO CC(C)CC[NH+]1CCC(CN[C@H](C)c2cncs2)CC1 ZINC000163579941 334870504 /nfs/dbraw/zinc/87/05/04/334870504.db2.gz NCAUHSPKJFJLOG-CQSZACIVSA-N 1 3 295.496 3.552 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN([C@@H](C)CCc2ccccc2)C1 ZINC000176282224 335256468 /nfs/dbraw/zinc/25/64/68/335256468.db2.gz OREMQJXMFQRYOZ-PKOBYXMFSA-N 1 3 288.479 3.671 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN([C@@H](C)CCc2ccccc2)C1 ZINC000176282224 335256469 /nfs/dbraw/zinc/25/64/69/335256469.db2.gz OREMQJXMFQRYOZ-PKOBYXMFSA-N 1 3 288.479 3.671 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+]([C@@H](C)CCc2ccccc2)C1 ZINC000176282224 335256470 /nfs/dbraw/zinc/25/64/70/335256470.db2.gz OREMQJXMFQRYOZ-PKOBYXMFSA-N 1 3 288.479 3.671 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+]([C@@H](C)CCc2ccccc2)C1 ZINC000176282224 335256471 /nfs/dbraw/zinc/25/64/71/335256471.db2.gz OREMQJXMFQRYOZ-PKOBYXMFSA-N 1 3 288.479 3.671 20 0 CHADHO CCc1cccc(Cl)c1CNCC1CC[NH+](CC)CC1 ZINC000577001969 335277071 /nfs/dbraw/zinc/27/70/71/335277071.db2.gz AQGTZWREOUJBQQ-UHFFFAOYSA-N 1 3 294.870 3.724 20 0 CHADHO C[C@H](NCc1ccc(C[NH3+])cc1)c1cccc(C2CC2)c1 ZINC000580774709 335965240 /nfs/dbraw/zinc/96/52/40/335965240.db2.gz DCWBZXBZZDCFRI-AWEZNQCLSA-N 1 3 280.415 3.874 20 0 CHADHO CC[C@H](NC1CC[NH+](CC2CC2)CC1)c1ccccc1 ZINC000581118762 336010678 /nfs/dbraw/zinc/01/06/78/336010678.db2.gz ALFAYSZFXGECAL-SFHVURJKSA-N 1 3 272.436 3.602 20 0 CHADHO CCC(C)(C)[C@@H](C)[NH2+]CC1CCN(c2ccncc2)CC1 ZINC000581173400 336019161 /nfs/dbraw/zinc/01/91/61/336019161.db2.gz DMULXIRTJGDQPM-OAHLLOKOSA-N 1 3 289.467 3.712 20 0 CHADHO C[C@H](CC[NH2+][C@H]1CCC[C@H](N(C)C)C1)c1ccccc1 ZINC000194493280 336027187 /nfs/dbraw/zinc/02/71/87/336027187.db2.gz GOUXCNCLAUXLJV-NJAFHUGGSA-N 1 3 274.452 3.643 20 0 CHADHO Cc1cc([C@H](C)[NH2+]C[C@@H](C)CN2CCCCC2)cs1 ZINC000381358968 336060199 /nfs/dbraw/zinc/06/01/99/336060199.db2.gz JVQQHNWSMZDFAK-HIFRSBDPSA-N 1 3 280.481 3.829 20 0 CHADHO CC(C)(CN[C@H]1C[C@H]([NH3+])c2ccccc21)C1CCC1 ZINC000384834586 336132201 /nfs/dbraw/zinc/13/22/01/336132201.db2.gz GHVFHPBZTLSUFW-HOTGVXAUSA-N 1 3 258.409 3.547 20 0 CHADHO CC(C)(C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCCN1)C1CCC1 ZINC000385029573 336135968 /nfs/dbraw/zinc/13/59/68/336135968.db2.gz KFSYCGIAXSQPKJ-IXDOHACOSA-N 1 3 278.484 3.713 20 0 CHADHO C[C@@H](C[NH2+]Cc1ccc2occc2c1)CN1CCCCC1 ZINC000352781622 534062406 /nfs/dbraw/zinc/06/24/06/534062406.db2.gz SXZIATMQEQLGRI-HNNXBMFYSA-N 1 3 286.419 3.644 20 0 CHADHO Cc1ccc(C)c([C@H](C)NCc2ccc(C[NH3+])cc2)c1 ZINC000572763851 518188655 /nfs/dbraw/zinc/18/86/55/518188655.db2.gz GVCJMDCGAJAFRE-HNNXBMFYSA-N 1 3 268.404 3.613 20 0 CHADHO CC(C)(CNC1CC([NH+]2CCCCC2)C1)c1ccccc1 ZINC000366289540 519265971 /nfs/dbraw/zinc/26/59/71/519265971.db2.gz WZTLYSDSOBIIAJ-UHFFFAOYSA-N 1 3 286.463 3.571 20 0 CHADHO CC(C)(CN[C@@H]1C[C@@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000157410416 519270296 /nfs/dbraw/zinc/27/02/96/519270296.db2.gz LGKSKJJUMUAKSC-QZTJIDSGSA-N 1 3 280.415 3.699 20 0 CHADHO CCN(C)C[C@H]1CC[N@H+](Cc2csc3ccccc23)C1 ZINC000072859414 520255661 /nfs/dbraw/zinc/25/56/61/520255661.db2.gz KCAADUOFECPYOU-CQSZACIVSA-N 1 3 288.460 3.675 20 0 CHADHO CCN(C)C[C@H]1CC[N@@H+](Cc2csc3ccccc23)C1 ZINC000072859414 520255664 /nfs/dbraw/zinc/25/56/64/520255664.db2.gz KCAADUOFECPYOU-CQSZACIVSA-N 1 3 288.460 3.675 20 0 CHADHO CCCC[N@H+](C)CC1CCN([C@H](C)c2cccnc2)CC1 ZINC000264988545 520401197 /nfs/dbraw/zinc/40/11/97/520401197.db2.gz MJLLWGJNCWXSQL-MRXNPFEDSA-N 1 3 289.467 3.587 20 0 CHADHO CCCC[N@@H+](C)CC1CCN([C@H](C)c2cccnc2)CC1 ZINC000264988545 520401203 /nfs/dbraw/zinc/40/12/03/520401203.db2.gz MJLLWGJNCWXSQL-MRXNPFEDSA-N 1 3 289.467 3.587 20 0 CHADHO CCCCN1CCC([NH2+]Cc2cccc3cccnc32)CC1 ZINC000079000023 520577450 /nfs/dbraw/zinc/57/74/50/520577450.db2.gz KWUBLIZPNOQKFF-UHFFFAOYSA-N 1 3 297.446 3.589 20 0 CHADHO CN(C)[C@@H]1CCC[N@H+](Cc2cc3ccccc3s2)CC1 ZINC000277331911 522042571 /nfs/dbraw/zinc/04/25/71/522042571.db2.gz VQPBLSGCFOHOAZ-OAHLLOKOSA-N 1 3 288.460 3.817 20 0 CHADHO CN(C)[C@@H]1CCC[N@@H+](Cc2cc3ccccc3s2)CC1 ZINC000277331911 522042578 /nfs/dbraw/zinc/04/25/78/522042578.db2.gz VQPBLSGCFOHOAZ-OAHLLOKOSA-N 1 3 288.460 3.817 20 0 CHADHO CC[C@@H](NC1CC[NH+](CC)CC1)c1cccc(Cl)c1 ZINC000037878826 522813582 /nfs/dbraw/zinc/81/35/82/522813582.db2.gz DOBCNRKFLMUXFK-MRXNPFEDSA-N 1 3 280.843 3.865 20 0 CHADHO C[C@H]1CCC[C@H]([NH2+]C2CCN(c3ccncc3)CC2)CC1 ZINC000235707283 524207297 /nfs/dbraw/zinc/20/72/97/524207297.db2.gz PMLBMEFQNOKXPY-HOTGVXAUSA-N 1 3 287.451 3.609 20 0 CHADHO Cc1ccc(C[C@H](C)N[C@@H]2C[C@H]([NH3+])c3ccccc32)s1 ZINC000157454596 524683665 /nfs/dbraw/zinc/68/36/65/524683665.db2.gz QUWDZANNGMCOQL-MZPVMMEZSA-N 1 3 286.444 3.722 20 0 CHADHO C[C@H]1C[C@@H](NCc2ccc(C3CCC3)cc2)CC[N@@H+]1C ZINC000277285125 524809323 /nfs/dbraw/zinc/80/93/23/524809323.db2.gz SXKRIDXUQYEIAK-KSSFIOAISA-N 1 3 272.436 3.526 20 0 CHADHO C[C@H]1C[C@@H](NCc2ccc(C3CCC3)cc2)CC[N@H+]1C ZINC000277285125 524809333 /nfs/dbraw/zinc/80/93/33/524809333.db2.gz SXKRIDXUQYEIAK-KSSFIOAISA-N 1 3 272.436 3.526 20 0 CHADHO CSC1(CNC2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)CC1 ZINC000365106207 525330783 /nfs/dbraw/zinc/33/07/83/525330783.db2.gz CPSVVBDQLBQTLK-HOCLYGCPSA-N 1 3 296.524 3.515 20 0 CHADHO CSC1(C[NH2+]C2CCN([C@H]3CCCC[C@@H]3C)CC2)CC1 ZINC000365106207 525330794 /nfs/dbraw/zinc/33/07/94/525330794.db2.gz CPSVVBDQLBQTLK-HOCLYGCPSA-N 1 3 296.524 3.515 20 0 CHADHO C[C@@H](NC1CCC([NH3+])CC1)c1cccc(Cl)c1Cl ZINC000235182570 525398114 /nfs/dbraw/zinc/39/81/14/525398114.db2.gz ALASNMWTRFVPSO-KPPDAEKUSA-N 1 3 287.234 3.914 20 0 CHADHO C[C@H]([NH2+][C@@H]1C[C@@H]1c1ccccc1)[C@H]1CCCN(C2CCC2)C1 ZINC000291292433 525587963 /nfs/dbraw/zinc/58/79/63/525587963.db2.gz ZZTPDSFCTIYLAE-SMMRIJLZSA-N 1 3 298.474 3.785 20 0 CHADHO C[C@H](N[C@@H]1C[C@@H]1c1ccccc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000291292433 525587971 /nfs/dbraw/zinc/58/79/71/525587971.db2.gz ZZTPDSFCTIYLAE-SMMRIJLZSA-N 1 3 298.474 3.785 20 0 CHADHO C[C@H](N[C@@H]1C[C@@H]1c1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000291292433 525587980 /nfs/dbraw/zinc/58/79/80/525587980.db2.gz ZZTPDSFCTIYLAE-SMMRIJLZSA-N 1 3 298.474 3.785 20 0 CHADHO Fc1cc(Cl)cc(C[NH2+]C2CCN(C3CCC3)CC2)c1 ZINC000275005162 526300686 /nfs/dbraw/zinc/30/06/86/526300686.db2.gz OQSMDSYEOIBRNE-UHFFFAOYSA-N 1 3 296.817 3.586 20 0 CHADHO c1ccc2c(c1)CCCC[C@@H]2NC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000037649275 526501827 /nfs/dbraw/zinc/50/18/27/526501827.db2.gz VUVJMDHBDMLYCS-KXBFYZLASA-N 1 3 284.447 3.528 20 0 CHADHO c1ccc2c(c1)CCCC[C@@H]2NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000037649275 526501832 /nfs/dbraw/zinc/50/18/32/526501832.db2.gz VUVJMDHBDMLYCS-KXBFYZLASA-N 1 3 284.447 3.528 20 0 CHADHO Cc1oc2ccccc2c1C[N@H+]1CCC[C@@H](N(C)C)CC1 ZINC000277359439 526786496 /nfs/dbraw/zinc/78/64/96/526786496.db2.gz FDLYOOABJDHYOQ-OAHLLOKOSA-N 1 3 286.419 3.657 20 0 CHADHO Cc1oc2ccccc2c1C[N@@H+]1CCC[C@@H](N(C)C)CC1 ZINC000277359439 526786501 /nfs/dbraw/zinc/78/65/01/526786501.db2.gz FDLYOOABJDHYOQ-OAHLLOKOSA-N 1 3 286.419 3.657 20 0 CHADHO C[C@@H]([NH2+][C@H]1CCN[C@H](C(C)(C)C)C1)C1CCCCC1 ZINC001246243687 1131429736 /nfs/dbraw/zinc/42/97/36/1131429736.db2.gz HIQDODYKGCOLKY-KBMXLJTQSA-N 1 3 266.473 3.712 20 0 CHADHO C(CC1CCC1)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000090233747 1117757200 /nfs/dbraw/zinc/75/72/00/1117757200.db2.gz BRBATOMVRRWUPJ-UHFFFAOYSA-N 1 3 264.457 3.563 20 0 CHADHO CCCC[C@H](C)[C@@H](C)[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000579877963 1117979769 /nfs/dbraw/zinc/97/97/69/1117979769.db2.gz YMOACVAIBDUHCM-BBWFWOEESA-N 1 3 268.489 3.911 20 0 CHADHO C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@H+](C)CCCN ZINC000146519978 1118252623 /nfs/dbraw/zinc/25/26/23/1118252623.db2.gz UUNCSCKXUHUGTG-NSHDSACASA-N 1 3 289.250 3.595 20 0 CHADHO C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+](C)CCCN ZINC000146519978 1118252627 /nfs/dbraw/zinc/25/26/27/1118252627.db2.gz UUNCSCKXUHUGTG-NSHDSACASA-N 1 3 289.250 3.595 20 0 CHADHO C[C@@H](CCc1ccc(Cl)c(Cl)c1)N(C)CCC[NH3+] ZINC000146519978 1118252632 /nfs/dbraw/zinc/25/26/32/1118252632.db2.gz UUNCSCKXUHUGTG-NSHDSACASA-N 1 3 289.250 3.595 20 0 CHADHO CC(C)[C@H](N[C@H]1CC[NH2+]C[C@H]1C)c1ccc(Cl)cc1 ZINC000261582902 1118462965 /nfs/dbraw/zinc/46/29/65/1118462965.db2.gz GVTGEANQRANKJS-KCXAZCMYSA-N 1 3 280.843 3.625 20 0 CHADHO C[C@H](Cc1ccsc1)N[C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000093516046 1118631384 /nfs/dbraw/zinc/63/13/84/1118631384.db2.gz HMISIGYAFMMJFU-FMKPAKJESA-N 1 3 280.481 3.580 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]CCCN2CCCC[C@H]2C)C[C@@H]1C ZINC000251760320 1125501857 /nfs/dbraw/zinc/50/18/57/1125501857.db2.gz KEOASSPXFQHIME-TWMKSMIVSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)CCC[N@@H+]1CCC[C@H](N2[C@H](C)CC[C@H]2C)C1 ZINC000429324991 1121527439 /nfs/dbraw/zinc/52/74/39/1121527439.db2.gz GXMVEPCUCUXZSU-ZACQAIPSSA-N 1 3 266.473 3.760 20 0 CHADHO CC(C)CCC[N@H+]1CCC[C@H](N2[C@H](C)CC[C@H]2C)C1 ZINC000429324991 1121527444 /nfs/dbraw/zinc/52/74/44/1121527444.db2.gz GXMVEPCUCUXZSU-ZACQAIPSSA-N 1 3 266.473 3.760 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1C[NH2+]CCCN1CCC(C)CC1 ZINC001199012820 1123018195 /nfs/dbraw/zinc/01/81/95/1123018195.db2.gz GLZKLCPNQVNDLO-ZWKOTPCHSA-N 1 3 278.484 3.690 20 0 CHADHO Cc1cccc2c1[C@@H](C)C[C@@H]2NCC[C@@H]([NH3+])C(C)C ZINC000665280666 1123313990 /nfs/dbraw/zinc/31/39/90/1123313990.db2.gz INWJGWNQCAJPJX-IMJJTQAJSA-N 1 3 260.425 3.506 20 0 CHADHO CCC(CC)(CN[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)C(F)(F)F ZINC000865756294 1124010308 /nfs/dbraw/zinc/01/03/08/1124010308.db2.gz IYDDWGMDCFWNHQ-CHWSQXEVSA-N 1 3 292.389 3.572 20 0 CHADHO CCC(CC)(CN[C@@H]1CC[N@H+]2CCC[C@@H]2C1)C(F)(F)F ZINC000865756294 1124010313 /nfs/dbraw/zinc/01/03/13/1124010313.db2.gz IYDDWGMDCFWNHQ-CHWSQXEVSA-N 1 3 292.389 3.572 20 0 CHADHO CC[C@H]1CCC[N@@H+](C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001171639741 1132081132 /nfs/dbraw/zinc/08/11/32/1132081132.db2.gz RIKJUTQFGXBLIJ-AWEZNQCLSA-N 1 3 266.473 3.760 20 0 CHADHO CC[C@H]1CCC[N@H+](C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001171639741 1132081139 /nfs/dbraw/zinc/08/11/39/1132081139.db2.gz RIKJUTQFGXBLIJ-AWEZNQCLSA-N 1 3 266.473 3.760 20 0 CHADHO CC[C@@H]1c2ccsc2CC[N@H+]1CC[C@H]1CCCN1C ZINC000247329635 1125656656 /nfs/dbraw/zinc/65/66/56/1125656656.db2.gz USKOMTPNBBBKMI-UKRRQHHQSA-N 1 3 278.465 3.542 20 0 CHADHO CC[C@@H]1c2ccsc2CC[N@@H+]1CC[C@H]1CCCN1C ZINC000247329635 1125656657 /nfs/dbraw/zinc/65/66/57/1125656657.db2.gz USKOMTPNBBBKMI-UKRRQHHQSA-N 1 3 278.465 3.542 20 0 CHADHO c1cc2c(cccc2CN2CCC[C@@H]([NH+]3CCCC3)CC2)[nH]1 ZINC000093564168 1125770639 /nfs/dbraw/zinc/77/06/39/1125770639.db2.gz GFGSYLXIRWCORS-QGZVFWFLSA-N 1 3 297.446 3.618 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@H]2CC[N@@H+](C)C[C@@H]2C)c1C ZINC000482330898 1126751294 /nfs/dbraw/zinc/75/12/94/1126751294.db2.gz JCTTXEGTVKHEGL-UGSOOPFHSA-N 1 3 299.462 3.523 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@H]2CC[N@H+](C)C[C@@H]2C)c1C ZINC000482330898 1126751296 /nfs/dbraw/zinc/75/12/96/1126751296.db2.gz JCTTXEGTVKHEGL-UGSOOPFHSA-N 1 3 299.462 3.523 20 0 CHADHO CCc1ccc([C@H](C)[NH2+][C@H](CCN(C)C)C(C)(C)C)o1 ZINC000483158468 1126770508 /nfs/dbraw/zinc/77/05/08/1126770508.db2.gz UQGDJDWUOSDTHO-XJKSGUPXSA-N 1 3 280.456 3.859 20 0 CHADHO C[C@@H]1CCC[N@H+](Cc2ccc(CNCc3cc[nH]c3)cc2)C1 ZINC000175697763 1126784684 /nfs/dbraw/zinc/78/46/84/1126784684.db2.gz ZWXZFAKEKRIKED-MRXNPFEDSA-N 1 3 297.446 3.536 20 0 CHADHO C[C@@H]1CCC[N@@H+](Cc2ccc(CNCc3cc[nH]c3)cc2)C1 ZINC000175697763 1126784688 /nfs/dbraw/zinc/78/46/88/1126784688.db2.gz ZWXZFAKEKRIKED-MRXNPFEDSA-N 1 3 297.446 3.536 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1cc2c(s1)CCC2 ZINC000484504835 1126823168 /nfs/dbraw/zinc/82/31/68/1126823168.db2.gz QXHBPJZNGNSFAP-AEGPPILISA-N 1 3 292.492 3.760 20 0 CHADHO CC(C)[C@@H](CNC[C@H]([NH3+])CCC(C)(C)C)c1cccnc1 ZINC000904363539 1126850339 /nfs/dbraw/zinc/85/03/39/1126850339.db2.gz IBQDZMFYNMQCQS-IAGOWNOFSA-N 1 3 291.483 3.564 20 0 CHADHO C[NH+](C)Cc1cccc(CNCc2cc(Cl)cs2)c1 ZINC000192994330 1126965856 /nfs/dbraw/zinc/96/58/56/1126965856.db2.gz UVDQVARHBGQCCD-UHFFFAOYSA-N 1 3 294.851 3.753 20 0 CHADHO Cc1cccnc1[C@H]([NH2+]CC[C@H]1CCCCN1C)C(C)C ZINC000268098211 1127011478 /nfs/dbraw/zinc/01/14/78/1127011478.db2.gz KDRVOOSMYALLOP-IAGOWNOFSA-N 1 3 289.467 3.551 20 0 CHADHO C[C@@H]([NH2+]C1CCN(CC2CCCC2)CC1)[C@@H]1CC1(C)C ZINC000486989557 1127014575 /nfs/dbraw/zinc/01/45/75/1127014575.db2.gz UKBQPKWOUZGXMX-PBHICJAKSA-N 1 3 278.484 3.665 20 0 CHADHO Cc1cccc([C@@H](C)NC2CC[NH+](C3CCC3)CC2)c1 ZINC000268975032 1127031036 /nfs/dbraw/zinc/03/10/36/1127031036.db2.gz GNRJMTKPCDNRSO-OAHLLOKOSA-N 1 3 272.436 3.663 20 0 CHADHO Cc1ccc([C@@H](C)NC2CC[NH+](C3CCC3)CC2)c(C)c1 ZINC000269001177 1127031821 /nfs/dbraw/zinc/03/18/21/1127031821.db2.gz LOFJUZKLXVBCHE-MRXNPFEDSA-N 1 3 286.463 3.971 20 0 CHADHO C([NH2+]C1CC2(C1)CCCCC2)[C@H]1CCCN(CC2CC2)C1 ZINC000668817879 1127053021 /nfs/dbraw/zinc/05/30/21/1127053021.db2.gz BLCPNZIWEUINFR-QGZVFWFLSA-N 1 3 290.495 3.811 20 0 CHADHO Cc1ccnc([C@@H](C)NCCCC[N@@H+]2CCC[C@@H](C)C2)c1 ZINC000285464730 1127230314 /nfs/dbraw/zinc/23/03/14/1127230314.db2.gz AJVHAGSIKVJGHB-IAGOWNOFSA-N 1 3 289.467 3.553 20 0 CHADHO Cc1ccnc([C@@H](C)NCCCC[N@H+]2CCC[C@@H](C)C2)c1 ZINC000285464730 1127230318 /nfs/dbraw/zinc/23/03/18/1127230318.db2.gz AJVHAGSIKVJGHB-IAGOWNOFSA-N 1 3 289.467 3.553 20 0 CHADHO CC[C@@H](CN[C@@H](CC)c1ccc(OC)cc1)[NH+]1CCCC1 ZINC000360089452 1127488931 /nfs/dbraw/zinc/48/89/31/1127488931.db2.gz UANNJFSODIPWHW-WMZOPIPTSA-N 1 3 290.451 3.610 20 0 CHADHO Cc1cc([C@@H](C)NCc2cccc(C[NH+](C)C)c2)cs1 ZINC000296001809 1127659600 /nfs/dbraw/zinc/65/96/00/1127659600.db2.gz OKKSZGYRPHOJMK-CQSZACIVSA-N 1 3 288.460 3.969 20 0 CHADHO Cc1cnccc1CNCc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000296367950 1127670275 /nfs/dbraw/zinc/67/02/75/1127670275.db2.gz JVARXYGGUKCJIE-UHFFFAOYSA-N 1 3 297.446 3.520 20 0 CHADHO Cc1cnccc1CNCc1cccc(C[N@H+](C)C(C)C)c1 ZINC000296367950 1127670277 /nfs/dbraw/zinc/67/02/77/1127670277.db2.gz JVARXYGGUKCJIE-UHFFFAOYSA-N 1 3 297.446 3.520 20 0 CHADHO CCN(CC)CCC[NH2+][C@@]1(C)CCCc2ccccc21 ZINC001168422797 1127799686 /nfs/dbraw/zinc/79/96/86/1127799686.db2.gz AZFFKPPGAGOPEZ-SFHVURJKSA-N 1 3 274.452 3.560 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1NCc1csc2ccccc12 ZINC000540119432 1127961908 /nfs/dbraw/zinc/96/19/08/1127961908.db2.gz ZCRVNPWAKUADFG-XJKCOSOUSA-N 1 3 288.460 3.720 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1NCc1csc2ccccc12 ZINC000540119432 1127961910 /nfs/dbraw/zinc/96/19/10/1127961910.db2.gz ZCRVNPWAKUADFG-XJKCOSOUSA-N 1 3 288.460 3.720 20 0 CHADHO Cc1ccccc1[C@@H](C)[NH2+]CC[C@H](C)N1CCCCC1 ZINC000544374507 1127970439 /nfs/dbraw/zinc/97/04/39/1127970439.db2.gz RVEZLEBRXLLYEY-DLBZAZTESA-N 1 3 274.452 3.910 20 0 CHADHO CC[C@H](CC(F)(F)F)[NH2+]C1CCN(C2CCCC2)CC1 ZINC000545460868 1128015840 /nfs/dbraw/zinc/01/58/40/1128015840.db2.gz UERPSDMPPXUMAB-GFCCVEGCSA-N 1 3 292.389 3.714 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@H+](C)C[C@@H]1CCCNC1 ZINC000469977568 1128060332 /nfs/dbraw/zinc/06/03/32/1128060332.db2.gz VOJXAKLPIHTNPL-RRFJBIMHSA-N 1 3 294.870 3.763 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@@H+](C)C[C@@H]1CCCNC1 ZINC000469977568 1128060336 /nfs/dbraw/zinc/06/03/36/1128060336.db2.gz VOJXAKLPIHTNPL-RRFJBIMHSA-N 1 3 294.870 3.763 20 0 CHADHO CC[C@H](c1ccccc1)N1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000470958929 1128084523 /nfs/dbraw/zinc/08/45/23/1128084523.db2.gz LXFYLSXUFZWCFY-PKOBYXMFSA-N 1 3 286.463 3.801 20 0 CHADHO CC[C@H](c1ccccc1)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000470958929 1128084527 /nfs/dbraw/zinc/08/45/27/1128084527.db2.gz LXFYLSXUFZWCFY-PKOBYXMFSA-N 1 3 286.463 3.801 20 0 CHADHO C[C@H]1CCCCN1CCC[NH2+][C@H]1CCCC(C)(C)C1 ZINC000252155305 1128120787 /nfs/dbraw/zinc/12/07/87/1128120787.db2.gz NDWCCSVFXITPQB-HOTGVXAUSA-N 1 3 266.473 3.809 20 0 CHADHO [NH3+][C@@H]1C[C@H](NCC[C@@H]2CCCC2(F)F)c2ccccc21 ZINC000925734861 1128139200 /nfs/dbraw/zinc/13/92/00/1128139200.db2.gz BZNAONSPXJUKEQ-GLQYFDAESA-N 1 3 280.362 3.546 20 0 CHADHO C[C@H](NCCC(C)(C)[NH3+])c1cc2ccccc2s1 ZINC000925738623 1128139943 /nfs/dbraw/zinc/13/99/43/1128139943.db2.gz RFIZWRZWHIEOPA-NSHDSACASA-N 1 3 262.422 3.679 20 0 CHADHO CSC1CCC(CN[C@@H](c2ccccc2)[C@@H](C)[NH3+])CC1 ZINC000925802287 1128142407 /nfs/dbraw/zinc/14/24/07/1128142407.db2.gz KYKJLPHWOKLZGS-RKHAHWSXSA-N 1 3 292.492 3.586 20 0 CHADHO CSC1CCC(CN[C@H](c2ccccc2)[C@H](C)[NH3+])CC1 ZINC000925802285 1128142437 /nfs/dbraw/zinc/14/24/37/1128142437.db2.gz KYKJLPHWOKLZGS-DXCHVLGVSA-N 1 3 292.492 3.586 20 0 CHADHO C[C@H]([NH2+]C1CC2(C1)CCCC2)[C@H]1CCCN(C2CCC2)C1 ZINC000926119910 1128156018 /nfs/dbraw/zinc/15/60/18/1128156018.db2.gz SHPSEFMUZOCBNK-HOTGVXAUSA-N 1 3 290.495 3.952 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](C)C2CCCCCC2)C1 ZINC000542476771 1128162656 /nfs/dbraw/zinc/16/26/56/1128162656.db2.gz CCKWKVMHEGCAJF-CVEARBPZSA-N 1 3 266.473 3.667 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H](C)C2CCCCCC2)C1 ZINC000542476772 1128162703 /nfs/dbraw/zinc/16/27/03/1128162703.db2.gz CCKWKVMHEGCAJF-HOTGVXAUSA-N 1 3 266.473 3.667 20 0 CHADHO C[N@@H+]1CCC[C@]2(CCN(Cc3ccc4ccccc4c3)C2)C1 ZINC000559310872 1128230555 /nfs/dbraw/zinc/23/05/55/1128230555.db2.gz GNPIVMICNLZURS-FQEVSTJZSA-N 1 3 294.442 3.758 20 0 CHADHO C[N@H+]1CCC[C@]2(CCN(Cc3ccc4ccccc4c3)C2)C1 ZINC000559310872 1128230558 /nfs/dbraw/zinc/23/05/58/1128230558.db2.gz GNPIVMICNLZURS-FQEVSTJZSA-N 1 3 294.442 3.758 20 0 CHADHO CC(C)(C)N1CCC([NH2+]Cc2ccc3[nH]ccc3c2)CC1 ZINC000229638757 1128237624 /nfs/dbraw/zinc/23/76/24/1128237624.db2.gz JFCQKMLLPUBGJJ-UHFFFAOYSA-N 1 3 285.435 3.520 20 0 CHADHO CCc1ccc(C[NH2+]C[C@@H]2CCCN(C(C)C)C2)s1 ZINC001649175652 1128331299 /nfs/dbraw/zinc/33/12/99/1128331299.db2.gz NLFIGABBFZBRBV-AWEZNQCLSA-N 1 3 280.481 3.521 20 0 CHADHO C[NH2+]CCCN1CCC(CCc2ccc(Cl)cc2)CC1 ZINC001235695200 1128348389 /nfs/dbraw/zinc/34/83/89/1128348389.db2.gz PZYKAURXUABVPQ-UHFFFAOYSA-N 1 3 294.870 3.594 20 0 CHADHO C[C@H](Cc1cccc(Cl)c1)[NH2+][C@H]1CCC[C@H](N(C)C)C1 ZINC000715276140 1128360259 /nfs/dbraw/zinc/36/02/59/1128360259.db2.gz JNFCANDPLGOWJO-COXVUDFISA-N 1 3 294.870 3.733 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@H](C)[C@H]2CCCC[C@H]2C)C1 ZINC000562522487 1128407726 /nfs/dbraw/zinc/40/77/26/1128407726.db2.gz GMIRLWPQSWQHHC-NCOADZHNSA-N 1 3 266.473 3.521 20 0 CHADHO CCC[NH+]1CCC(N[C@@H](c2ccc(C)cc2)C2CC2)CC1 ZINC000037236876 1128425237 /nfs/dbraw/zinc/42/52/37/1128425237.db2.gz OWNLJUGBQAUCBZ-IBGZPJMESA-N 1 3 286.463 3.910 20 0 CHADHO C[C@@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc2c(c1)CCCC2 ZINC000124358836 1128443918 /nfs/dbraw/zinc/44/39/18/1128443918.db2.gz FZQQOLQUSGVXGG-CVEARBPZSA-N 1 3 298.474 3.700 20 0 CHADHO C[C@@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc2c(c1)CCCC2 ZINC000124358836 1128443920 /nfs/dbraw/zinc/44/39/20/1128443920.db2.gz FZQQOLQUSGVXGG-CVEARBPZSA-N 1 3 298.474 3.700 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](c2cccs2)C2CCCC2)C1 ZINC000037644650 1128434176 /nfs/dbraw/zinc/43/41/76/1128434176.db2.gz SZAUIFLXOZCTFI-WMLDXEAASA-N 1 3 292.492 3.911 20 0 CHADHO CCCc1ccc([C@@H](C)NC[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000037649257 1128435088 /nfs/dbraw/zinc/43/50/88/1128435088.db2.gz LTGCRVDHINGBPX-NVXWUHKLSA-N 1 3 286.463 3.774 20 0 CHADHO CCCc1ccc([C@@H](C)NC[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000037649257 1128435091 /nfs/dbraw/zinc/43/50/91/1128435091.db2.gz LTGCRVDHINGBPX-NVXWUHKLSA-N 1 3 286.463 3.774 20 0 CHADHO Cc1ccc([C@H](C)NC[C@@H](C)C[NH+]2CCCC2)cc1C ZINC000062077620 1128436340 /nfs/dbraw/zinc/43/63/40/1128436340.db2.gz CEJNJRLZPKKRFX-PBHICJAKSA-N 1 3 274.452 3.686 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CCC2CCCCC2)CC1 ZINC000125077560 1128447240 /nfs/dbraw/zinc/44/72/40/1128447240.db2.gz AVJSDYWHCXHKQO-UHFFFAOYSA-N 1 3 266.473 3.809 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCN(C(C)C)C2)cc1 ZINC000125977371 1128459516 /nfs/dbraw/zinc/45/95/16/1128459516.db2.gz UGKFDVBTXZFJEY-DLBZAZTESA-N 1 3 274.452 3.766 20 0 CHADHO C[C@H](CCSc1ccccc1)[NH+]1CCC(N(C)C)CC1 ZINC000128017599 1128485665 /nfs/dbraw/zinc/48/56/65/1128485665.db2.gz HMBGWROPKKHIAN-OAHLLOKOSA-N 1 3 292.492 3.583 20 0 CHADHO Cc1cc([C@H](C)NCc2ccc(C[NH3+])cc2)cc(C)c1F ZINC000565363394 1128524311 /nfs/dbraw/zinc/52/43/11/1128524311.db2.gz VWIQTQRCWYTYIK-AWEZNQCLSA-N 1 3 286.394 3.752 20 0 CHADHO C[C@@H](C[NH2+][C@@H]1CCc2cc(F)ccc21)CN1CCCCC1 ZINC000129198202 1128534202 /nfs/dbraw/zinc/53/42/02/1128534202.db2.gz YNOWLPNZNQNLSS-KBXCAEBGSA-N 1 3 290.426 3.525 20 0 CHADHO CC(C)C[C@H](CN1CC[C@@H]([NH3+])C[C@H]1C)c1ccccc1 ZINC000566411164 1128544370 /nfs/dbraw/zinc/54/43/70/1128544370.db2.gz AEYPVCAAVFOLMI-KBAYOESNSA-N 1 3 274.452 3.628 20 0 CHADHO CC(C)C[C@H](C[N@@H+]1CC[C@@H](N)C[C@H]1C)c1ccccc1 ZINC000566411164 1128544372 /nfs/dbraw/zinc/54/43/72/1128544372.db2.gz AEYPVCAAVFOLMI-KBAYOESNSA-N 1 3 274.452 3.628 20 0 CHADHO CC(C)C[C@H](C[N@H+]1CC[C@@H](N)C[C@H]1C)c1ccccc1 ZINC000566411164 1128544373 /nfs/dbraw/zinc/54/43/73/1128544373.db2.gz AEYPVCAAVFOLMI-KBAYOESNSA-N 1 3 274.452 3.628 20 0 CHADHO C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(CC2(C)CCC2)C1 ZINC000556105230 1128547556 /nfs/dbraw/zinc/54/75/56/1128547556.db2.gz VDJDHWVMNDNXAQ-DLBZAZTESA-N 1 3 278.484 3.763 20 0 CHADHO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(CC2(C)CCC2)C1 ZINC000556105230 1128547560 /nfs/dbraw/zinc/54/75/60/1128547560.db2.gz VDJDHWVMNDNXAQ-DLBZAZTESA-N 1 3 278.484 3.763 20 0 CHADHO C[C@@H]1C[C@H](N[C@@H](c2ccc(Cl)cc2)C2CC2)CC[N@@H+]1C ZINC000129714481 1128554421 /nfs/dbraw/zinc/55/44/21/1128554421.db2.gz CSTGYHICZNBFQO-CSMYWGQOSA-N 1 3 292.854 3.863 20 0 CHADHO C[C@@H]1C[C@H](N[C@@H](c2ccc(Cl)cc2)C2CC2)CC[N@H+]1C ZINC000129714481 1128554423 /nfs/dbraw/zinc/55/44/23/1128554423.db2.gz CSTGYHICZNBFQO-CSMYWGQOSA-N 1 3 292.854 3.863 20 0 CHADHO C[C@@H]1CCC[C@H](N2CCC([NH2+][C@H]3CCC[C@H](F)C3)CC2)C1 ZINC000567048019 1128556851 /nfs/dbraw/zinc/55/68/51/1128556851.db2.gz HCJLOTMEFCAOKZ-FZCLSBEQSA-N 1 3 296.474 3.900 20 0 CHADHO [NH3+]C[C@@H](N[C@H]1CCCc2c3ccccc3[nH]c21)C1CCCC1 ZINC000567724433 1128570546 /nfs/dbraw/zinc/57/05/46/1128570546.db2.gz PMUZOHNEDLGBTK-ZWKOTPCHSA-N 1 3 297.446 3.652 20 0 CHADHO C[N@H+](Cc1ccc(C(C)(C)C)cc1)[C@H]1CCCC[C@H]1N ZINC001236211417 1128614714 /nfs/dbraw/zinc/61/47/14/1128614714.db2.gz HWMNYBZHMSXAHL-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO C[N@@H+](Cc1ccc(C(C)(C)C)cc1)[C@H]1CCCC[C@H]1N ZINC001236211417 1128614717 /nfs/dbraw/zinc/61/47/17/1128614717.db2.gz HWMNYBZHMSXAHL-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO CC[C@H](Cc1ccc(C)cc1)[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000569039322 1128596739 /nfs/dbraw/zinc/59/67/39/1128596739.db2.gz TXBAJEUKHBSXDX-RBUKOAKNSA-N 1 3 288.479 3.636 20 0 CHADHO CCCCN1CCC([NH2+]Cc2ccc(C(F)F)cc2)CC1 ZINC000131355032 1128615475 /nfs/dbraw/zinc/61/54/75/1128615475.db2.gz IXENISMXJRISIS-UHFFFAOYSA-N 1 3 296.405 3.978 20 0 CHADHO CCCC[C@H](C)[C@H](C)[NH2+][C@H]1CCC[C@H](N(C)C)C1 ZINC000569884510 1128611532 /nfs/dbraw/zinc/61/15/32/1128611532.db2.gz TXNRINJTJIJDJH-VGWMRTNUSA-N 1 3 254.462 3.664 20 0 CHADHO CN1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccc3ccccc3c2)C1 ZINC000571924234 1128640127 /nfs/dbraw/zinc/64/01/27/1128640127.db2.gz FRIPYTIHRPDDTL-PMACEKPBSA-N 1 3 294.442 3.756 20 0 CHADHO CN1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccc3ccccc3c2)C1 ZINC000571924234 1128640129 /nfs/dbraw/zinc/64/01/29/1128640129.db2.gz FRIPYTIHRPDDTL-PMACEKPBSA-N 1 3 294.442 3.756 20 0 CHADHO Cc1cc(CNCc2ccc([C@H](C)[NH3+])cc2)c(C)s1 ZINC000556934331 1128648403 /nfs/dbraw/zinc/64/84/03/1128648403.db2.gz UWHVHDIAUHQGEP-LBPRGKRZSA-N 1 3 274.433 3.674 20 0 CHADHO Cc1ccccc1-c1cccc(CN2CCC[C@@H](C[NH3+])C2)c1 ZINC000573119621 1128651403 /nfs/dbraw/zinc/65/14/03/1128651403.db2.gz FUTJXFPMFMAAJI-SFHVURJKSA-N 1 3 294.442 3.833 20 0 CHADHO Cc1ccccc1C[C@@H]([NH2+][C@H]1CCNC2(CCC2)C1)C1CC1 ZINC000643547474 1117796519 /nfs/dbraw/zinc/79/65/19/1117796519.db2.gz FXSMSMJTWLXTRS-RBUKOAKNSA-N 1 3 298.474 3.580 20 0 CHADHO CCC[C@@H](N[C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1 ZINC000623339894 1117837020 /nfs/dbraw/zinc/83/70/20/1117837020.db2.gz OMLBFYYSRKPLRI-IAGOWNOFSA-N 1 3 274.452 3.990 20 0 CHADHO CCC[C@@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1 ZINC000623339894 1117837024 /nfs/dbraw/zinc/83/70/24/1117837024.db2.gz OMLBFYYSRKPLRI-IAGOWNOFSA-N 1 3 274.452 3.990 20 0 CHADHO CCC[C@H](N[C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1 ZINC000623339896 1117838099 /nfs/dbraw/zinc/83/80/99/1117838099.db2.gz OMLBFYYSRKPLRI-SJORKVTESA-N 1 3 274.452 3.990 20 0 CHADHO CCC[C@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1 ZINC000623339896 1117838105 /nfs/dbraw/zinc/83/81/05/1117838105.db2.gz OMLBFYYSRKPLRI-SJORKVTESA-N 1 3 274.452 3.990 20 0 CHADHO C[N@@H+]1CC[C@H](NCc2cccc3ccccc32)CC1(C)C ZINC000623385038 1117846561 /nfs/dbraw/zinc/84/65/61/1117846561.db2.gz ZCRGILHZQYAOOT-KRWDZBQOSA-N 1 3 282.431 3.802 20 0 CHADHO C[N@H+]1CC[C@H](NCc2cccc3ccccc32)CC1(C)C ZINC000623385038 1117846565 /nfs/dbraw/zinc/84/65/65/1117846565.db2.gz ZCRGILHZQYAOOT-KRWDZBQOSA-N 1 3 282.431 3.802 20 0 CHADHO C[NH+](C)CC[C@H](NCc1ccc2cc[nH]c2c1)C(C)(C)C ZINC000623422449 1117854124 /nfs/dbraw/zinc/85/41/24/1117854124.db2.gz WYNCHVGOQBDFOL-KRWDZBQOSA-N 1 3 287.451 3.624 20 0 CHADHO c1ccc([C@H](NC2CC[NH+](CC3CC3)CC2)C2CCC2)cc1 ZINC000119235735 1117876732 /nfs/dbraw/zinc/87/67/32/1117876732.db2.gz OINMBJFHLDITMS-FQEVSTJZSA-N 1 3 298.474 3.992 20 0 CHADHO CCCN1C[C@@H]2C[NH+](CC[C@H](C)CC(C)(C)C)C[C@H]2C1 ZINC001208667085 1117905735 /nfs/dbraw/zinc/90/57/35/1117905735.db2.gz XLJKIWQPRSBJLZ-GVDBMIGSSA-N 1 3 280.500 3.722 20 0 CHADHO CCC[NH+]1C[C@@H]2CN(CC[C@H](C)CC(C)(C)C)C[C@H]2C1 ZINC001208667085 1117905736 /nfs/dbraw/zinc/90/57/36/1117905736.db2.gz XLJKIWQPRSBJLZ-GVDBMIGSSA-N 1 3 280.500 3.722 20 0 CHADHO CC(C)Oc1cccc([C@H](C)[NH2+]CC[C@@H]2CCCN2C)c1 ZINC000179683888 1117909913 /nfs/dbraw/zinc/90/99/13/1117909913.db2.gz FZAVAMCPBADCGE-RDJZCZTQSA-N 1 3 290.451 3.609 20 0 CHADHO CCC[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccccc1 ZINC000624119412 1117984766 /nfs/dbraw/zinc/98/47/66/1117984766.db2.gz AWTBKMGPSGUCIL-AEFFLSMTSA-N 1 3 274.452 3.849 20 0 CHADHO CCC[C@H](NC[C@H]1CCCC[N@H+](C)C1)c1ccccc1 ZINC000624119412 1117984770 /nfs/dbraw/zinc/98/47/70/1117984770.db2.gz AWTBKMGPSGUCIL-AEFFLSMTSA-N 1 3 274.452 3.849 20 0 CHADHO CCC[C@H](NC[C@H]1CCCC[N@@H+](C)C1)c1ccccc1 ZINC000624119412 1117984774 /nfs/dbraw/zinc/98/47/74/1117984774.db2.gz AWTBKMGPSGUCIL-AEFFLSMTSA-N 1 3 274.452 3.849 20 0 CHADHO CN1CCCC[C@@H](C[NH2+][C@H]2CCc3ccc(Cl)cc32)C1 ZINC000624121802 1117986024 /nfs/dbraw/zinc/98/60/24/1117986024.db2.gz DFAXQORYFKILPH-GUYCJALGSA-N 1 3 292.854 3.649 20 0 CHADHO C[C@H](c1ccccc1)[C@H](C)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000624121181 1117986084 /nfs/dbraw/zinc/98/60/84/1117986084.db2.gz PPARYTJDHMEOBO-ULQDDVLXSA-N 1 3 274.452 3.500 20 0 CHADHO CCC[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccsc1 ZINC000624123680 1117986886 /nfs/dbraw/zinc/98/68/86/1117986886.db2.gz QHQKMALCDAODSC-GDBMZVCRSA-N 1 3 280.481 3.911 20 0 CHADHO CC[C@H](CCc1ccccc1)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000624124833 1117986908 /nfs/dbraw/zinc/98/69/08/1117986908.db2.gz LYBOPJUAEIFHEC-RTBURBONSA-N 1 3 288.479 3.719 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1nccc2ccccc21 ZINC000624123568 1117987010 /nfs/dbraw/zinc/98/70/10/1117987010.db2.gz OGXPHMDXKJZKOF-HOTGVXAUSA-N 1 3 297.446 3.617 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1cccc(C2CC2)c1 ZINC000624124161 1117987693 /nfs/dbraw/zinc/98/76/93/1117987693.db2.gz YRKQCLSSAZHREB-HOTGVXAUSA-N 1 3 286.463 3.947 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]C[C@H](C)CN2CCCCC2)s1 ZINC000038041634 1118074888 /nfs/dbraw/zinc/07/48/88/1118074888.db2.gz YIRRRCYFSRXNMJ-ZFWWWQNUSA-N 1 3 280.481 3.829 20 0 CHADHO C[C@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc(C2CC2)c1 ZINC000340175833 1118098862 /nfs/dbraw/zinc/09/88/62/1118098862.db2.gz RCQZHMSSVNEHPQ-GJZGRUSLSA-N 1 3 284.447 3.699 20 0 CHADHO C[C@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1cccc(C2CC2)c1 ZINC000340175833 1118098865 /nfs/dbraw/zinc/09/88/65/1118098865.db2.gz RCQZHMSSVNEHPQ-GJZGRUSLSA-N 1 3 284.447 3.699 20 0 CHADHO C[C@@H]1C[C@H](C)CN(CCC[NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)C1 ZINC001648814909 1118222907 /nfs/dbraw/zinc/22/29/07/1118222907.db2.gz UIWRRQCFBNPTRT-MEWRGDBZSA-N 1 3 278.484 3.523 20 0 CHADHO Cc1ccc([C@@H]([NH2+]CC(C)(C)CN(C)C)C2CCC2)o1 ZINC000542670698 1118237650 /nfs/dbraw/zinc/23/76/50/1118237650.db2.gz IYRQFUXNMPTIGO-INIZCTEOSA-N 1 3 278.440 3.607 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1ccc(Cl)s1 ZINC000037649004 1118278661 /nfs/dbraw/zinc/27/86/61/1118278661.db2.gz QAWVEPSWFQTTAG-GHMZBOCLSA-N 1 3 284.856 3.536 20 0 CHADHO CC[C@H](C)C[C@H](CC)[NH2+][C@@H]1CCC[C@H](N(C)C)C1 ZINC000715510948 1118308405 /nfs/dbraw/zinc/30/84/05/1118308405.db2.gz RLNJXOBEGRUFAW-JONQDZQNSA-N 1 3 254.462 3.664 20 0 CHADHO C[C@@H]([NH2+]Cc1ccccc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000306747606 1118340326 /nfs/dbraw/zinc/34/03/26/1118340326.db2.gz FPYBZZMJEUEXHH-XLIONFOSSA-N 1 3 294.442 3.687 20 0 CHADHO C[C@@H](NCc1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000306747606 1118340331 /nfs/dbraw/zinc/34/03/31/1118340331.db2.gz FPYBZZMJEUEXHH-XLIONFOSSA-N 1 3 294.442 3.687 20 0 CHADHO C[C@@H](NCc1ccccc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000306747606 1118340333 /nfs/dbraw/zinc/34/03/33/1118340333.db2.gz FPYBZZMJEUEXHH-XLIONFOSSA-N 1 3 294.442 3.687 20 0 CHADHO CC[N@@H+](C/C=C/c1ccccc1)CCCN1CCCC1 ZINC000580245226 1118407035 /nfs/dbraw/zinc/40/70/35/1118407035.db2.gz FTUHCKLOBVRJIE-XYOKQWHBSA-N 1 3 272.436 3.508 20 0 CHADHO CC[N@H+](C/C=C/c1ccccc1)CCCN1CCCC1 ZINC000580245226 1118407036 /nfs/dbraw/zinc/40/70/36/1118407036.db2.gz FTUHCKLOBVRJIE-XYOKQWHBSA-N 1 3 272.436 3.508 20 0 CHADHO CC[C@H]1CC[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000562878213 1118442219 /nfs/dbraw/zinc/44/22/19/1118442219.db2.gz DYHSLDMJJLTQLC-WMLDXEAASA-N 1 3 264.457 3.562 20 0 CHADHO C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1ccc(Cl)c(F)c1 ZINC000322342861 1118601030 /nfs/dbraw/zinc/60/10/30/1118601030.db2.gz CMNUBZBPLYLCBZ-HLVVYCRESA-N 1 3 296.817 3.755 20 0 CHADHO C[C@@H](c1ccc(Cl)cc1)N(C)C[C@H]1CCC[N@H+](C)C1 ZINC000605421247 1118601192 /nfs/dbraw/zinc/60/11/92/1118601192.db2.gz NFXBEFAAFXVGQI-KBPBESRZSA-N 1 3 280.843 3.675 20 0 CHADHO C[C@@H](c1ccc(Cl)cc1)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000605421247 1118601193 /nfs/dbraw/zinc/60/11/93/1118601193.db2.gz NFXBEFAAFXVGQI-KBPBESRZSA-N 1 3 280.843 3.675 20 0 CHADHO C[C@H]([NH3+])[C@@H]1CCN(Cc2cccc(C3CCCC3)c2)C1 ZINC000656785707 1118657649 /nfs/dbraw/zinc/65/76/49/1118657649.db2.gz IOCHQTHHOSLIRT-KBXCAEBGSA-N 1 3 272.436 3.513 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCC[C@H]1CCCF)CN1CCCCC1 ZINC000510724397 1118797171 /nfs/dbraw/zinc/79/71/71/1118797171.db2.gz XNLLVCPHGPFBNF-IXDOHACOSA-N 1 3 284.463 3.616 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000510756983 1118807489 /nfs/dbraw/zinc/80/74/89/1118807489.db2.gz UIIZUUKPIQAFBW-IXDOHACOSA-N 1 3 284.463 3.759 20 0 CHADHO C[C@@H]1CC[C@H](N[C@@H]2C[C@H]([NH3+])c3ccccc32)C[C@@H]1C ZINC000132140016 1118826256 /nfs/dbraw/zinc/82/62/56/1118826256.db2.gz NWTWGZOFAMPNCJ-WCGFVAAJSA-N 1 3 258.409 3.546 20 0 CHADHO CC(C)(C)C[C@H](N[C@@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000133714308 1118866527 /nfs/dbraw/zinc/86/65/27/1118866527.db2.gz JLLMRKUTMFKQBI-SJORKVTESA-N 1 3 274.452 3.896 20 0 CHADHO C[C@H](C[NH2+]C1CCN(C2CCCCC2)CC1)CC(F)F ZINC000647226698 1118896717 /nfs/dbraw/zinc/89/67/17/1118896717.db2.gz TYFHUENLIINJEP-ZDUSSCGKSA-N 1 3 288.426 3.664 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN(CCCc2cccc(C)c2)C1 ZINC000181132780 1118904489 /nfs/dbraw/zinc/90/44/89/1118904489.db2.gz UTRRBYDZSCPTFV-IBGZPJMESA-N 1 3 288.479 3.591 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN(CCCc2cccc(C)c2)C1 ZINC000181132780 1118904490 /nfs/dbraw/zinc/90/44/90/1118904490.db2.gz UTRRBYDZSCPTFV-IBGZPJMESA-N 1 3 288.479 3.591 20 0 CHADHO CN(C)CC(C)(C)C[N@@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001207276508 1118999764 /nfs/dbraw/zinc/99/97/64/1118999764.db2.gz YMBWZEGYIOZXHV-INIZCTEOSA-N 1 3 278.415 3.550 20 0 CHADHO CN(C)CC(C)(C)C[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001207276508 1118999767 /nfs/dbraw/zinc/99/97/67/1118999767.db2.gz YMBWZEGYIOZXHV-INIZCTEOSA-N 1 3 278.415 3.550 20 0 CHADHO C[C@@]1(C[NH3+])CCN(Cc2ccc(-c3ccccc3)cc2)C1 ZINC000261605693 1119063833 /nfs/dbraw/zinc/06/38/33/1119063833.db2.gz CUWJMQYZQVHNHD-IBGZPJMESA-N 1 3 280.415 3.524 20 0 CHADHO CC[C@H](c1ccccc1)N1CCC[C@H]([C@@H]2CCC[NH2+]2)C1 ZINC000037916047 1119183074 /nfs/dbraw/zinc/18/30/74/1119183074.db2.gz UHVJWNUOGIZLET-OKZBNKHCSA-N 1 3 272.436 3.602 20 0 CHADHO Cc1ccc([C@@H](C)C[NH2+]C[C@@H]2CCCN(C(C)C)C2)cc1 ZINC000628213897 1128829411 /nfs/dbraw/zinc/82/94/11/1128829411.db2.gz CKKCBVHHZZEKGB-ROUUACIJSA-N 1 3 288.479 3.809 20 0 CHADHO CCC1(C)CCC([NH2+]C[C@H]2CCN(C(C)C)C2)CC1 ZINC000685455720 1119610624 /nfs/dbraw/zinc/61/06/24/1119610624.db2.gz TXYPBLDYXBHGRS-KLAILNCOSA-N 1 3 266.473 3.665 20 0 CHADHO CCN(Cc1ccc(C[NH+](C)C)cc1)[C@H](C)c1cccnc1 ZINC000685469953 1119612710 /nfs/dbraw/zinc/61/27/10/1119612710.db2.gz XUFBYINMCGMJQP-MRXNPFEDSA-N 1 3 297.446 3.726 20 0 CHADHO CCCc1ccc(C[N@@H+]2CCC[C@@H]3CN(C)CC[C@@H]32)cc1 ZINC000685470718 1119612803 /nfs/dbraw/zinc/61/28/03/1119612803.db2.gz LBZSUMNTSXDGKY-MOPGFXCFSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1ccc(C[N@H+]2CCC[C@@H]3CN(C)CC[C@@H]32)cc1 ZINC000685470718 1119612804 /nfs/dbraw/zinc/61/28/04/1119612804.db2.gz LBZSUMNTSXDGKY-MOPGFXCFSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1ccc(CN2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)cc1 ZINC000685470718 1119612807 /nfs/dbraw/zinc/61/28/07/1119612807.db2.gz LBZSUMNTSXDGKY-MOPGFXCFSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1ccc(CN2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)cc1 ZINC000685470718 1119612808 /nfs/dbraw/zinc/61/28/08/1119612808.db2.gz LBZSUMNTSXDGKY-MOPGFXCFSA-N 1 3 286.463 3.555 20 0 CHADHO C[C@H](CC[NH2+][C@H](C)C(C)(C)C(F)F)N1CCCCC1 ZINC000657973296 1119657838 /nfs/dbraw/zinc/65/78/38/1119657838.db2.gz PQJGHMIQGLMOSI-CHWSQXEVSA-N 1 3 276.415 3.520 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1cc([O-])cc(F)c1 ZINC000924526481 1119693872 /nfs/dbraw/zinc/69/38/72/1119693872.db2.gz GAEWHAUVKZQWHB-KGLIPLIRSA-N 1 3 296.430 3.692 20 0 CHADHO CSCC1(CC[NH2+]C2CCN(CCC(C)C)CC2)CC1 ZINC000926690076 1119813517 /nfs/dbraw/zinc/81/35/17/1119813517.db2.gz UYFCQERUBIIHQJ-UHFFFAOYSA-N 1 3 298.540 3.620 20 0 CHADHO C[C@H](NCC[C@H]1CCC[N@H+](C)C1)c1ccc(F)cc1Cl ZINC000414188347 1119931213 /nfs/dbraw/zinc/93/12/13/1119931213.db2.gz QOTKGYLAJVPRKP-QWHCGFSZSA-N 1 3 298.833 3.862 20 0 CHADHO C[C@H](NCC[C@H]1CCC[N@@H+](C)C1)c1ccc(F)cc1Cl ZINC000414188347 1119931214 /nfs/dbraw/zinc/93/12/14/1119931214.db2.gz QOTKGYLAJVPRKP-QWHCGFSZSA-N 1 3 298.833 3.862 20 0 CHADHO C[C@@H]1C[N@H+](CC[C@@H]2CCCCN2C)[C@@H]1c1ccccc1 ZINC000472590619 1119989246 /nfs/dbraw/zinc/98/92/46/1119989246.db2.gz GTRYHWVICPDSGD-NJAFHUGGSA-N 1 3 272.436 3.554 20 0 CHADHO C[C@@H]1C[N@@H+](CC[C@@H]2CCCCN2C)[C@@H]1c1ccccc1 ZINC000472590619 1119989250 /nfs/dbraw/zinc/98/92/50/1119989250.db2.gz GTRYHWVICPDSGD-NJAFHUGGSA-N 1 3 272.436 3.554 20 0 CHADHO Clc1ccc(CN2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)s1 ZINC000647543221 1120005034 /nfs/dbraw/zinc/00/50/34/1120005034.db2.gz JQVZKISHFQNFTH-CHWSQXEVSA-N 1 3 298.883 3.613 20 0 CHADHO CC[C@H](C[C@@H](C)CC)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000624119503 1120051815 /nfs/dbraw/zinc/05/18/15/1120051815.db2.gz DGAGCGGXFAHHBB-HRCADAONSA-N 1 3 254.462 3.523 20 0 CHADHO CC[NH+]1CCC(N[C@@H]2CCCc3c4ccccc4[nH]c32)CC1 ZINC000204973736 1120062849 /nfs/dbraw/zinc/06/28/49/1120062849.db2.gz PYNWHOMNBXDSEH-GOSISDBHSA-N 1 3 297.446 3.619 20 0 CHADHO CC(C)CCC[C@@H](C)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000624120781 1120065766 /nfs/dbraw/zinc/06/57/66/1120065766.db2.gz GWJCFKLOZJORDE-HZPDHXFCSA-N 1 3 254.462 3.523 20 0 CHADHO CN(C)[C@H]1CCC[C@H]([NH2+]CC2CCC(C)(C)CC2)C1 ZINC000715540340 1120081335 /nfs/dbraw/zinc/08/13/35/1120081335.db2.gz BXSGNFPZERMAIQ-HOTGVXAUSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@H](c1ccc(F)cc1)[N@H+](C)CC[C@H]1CCCCN1C ZINC000472763746 1120165266 /nfs/dbraw/zinc/16/52/66/1120165266.db2.gz NIBZMXJGWWIEQP-RHSMWYFYSA-N 1 3 278.415 3.693 20 0 CHADHO C[C@H](c1ccc(F)cc1)[N@@H+](C)CC[C@H]1CCCCN1C ZINC000472763746 1120165267 /nfs/dbraw/zinc/16/52/67/1120165267.db2.gz NIBZMXJGWWIEQP-RHSMWYFYSA-N 1 3 278.415 3.693 20 0 CHADHO CC(C)COc1ccc([C@H](C)[NH2+]C[C@@H](C)CN(C)C)cc1 ZINC000314277383 1120182197 /nfs/dbraw/zinc/18/21/97/1120182197.db2.gz JKSIECTWKGDTRJ-CVEARBPZSA-N 1 3 292.467 3.570 20 0 CHADHO CC(C)(C)[NH+]1CCC(Nc2ccnc3ccccc32)CC1 ZINC000110250168 1120219817 /nfs/dbraw/zinc/21/98/17/1120219817.db2.gz JAHPHOSGHZEYGF-UHFFFAOYSA-N 1 3 283.419 3.910 20 0 CHADHO CC[C@H](CC(F)F)CN1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000659945180 1120300858 /nfs/dbraw/zinc/30/08/58/1120300858.db2.gz SYPRBKRUEYIMKL-HUUCEWRRSA-N 1 3 288.426 3.618 20 0 CHADHO CSCCCCCC[NH2+][C@H]1CCNC[C@@H]1C1CCCC1 ZINC000925637738 1120501788 /nfs/dbraw/zinc/50/17/88/1120501788.db2.gz QVZHUDRTXOYSHP-SJORKVTESA-N 1 3 298.540 3.668 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)CCSC2CCCCC2)C[C@@H]1C ZINC000500093429 1120508939 /nfs/dbraw/zinc/50/89/39/1120508939.db2.gz SGQOYUCSZTYTOO-HOTGVXAUSA-N 1 3 298.540 3.857 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)CCSC2CCCCC2)C[C@@H]1C ZINC000500093429 1120508941 /nfs/dbraw/zinc/50/89/41/1120508941.db2.gz SGQOYUCSZTYTOO-HOTGVXAUSA-N 1 3 298.540 3.857 20 0 CHADHO C[C@H]1CCCCN1CCC[NH2+][C@@H]1CCc2ccccc21 ZINC000019913089 1120549311 /nfs/dbraw/zinc/54/93/11/1120549311.db2.gz AULFMTJKMCQIKL-MAUKXSAKSA-N 1 3 272.436 3.528 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@@H]1CCCC(C)(C)CC1 ZINC000226331364 1120552393 /nfs/dbraw/zinc/55/23/93/1120552393.db2.gz OSHYQKXHZFCEJG-OAHLLOKOSA-N 1 3 254.462 3.665 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CC[C@@]3(CC[N@H+](C)C3)C2)cc1 ZINC000429017187 1120616994 /nfs/dbraw/zinc/61/69/94/1120616994.db2.gz DUAZEDRIBQACLK-QFBILLFUSA-N 1 3 286.463 3.899 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CC[C@@]3(CC[N@@H+](C)C3)C2)cc1 ZINC000429017187 1120616996 /nfs/dbraw/zinc/61/69/96/1120616996.db2.gz DUAZEDRIBQACLK-QFBILLFUSA-N 1 3 286.463 3.899 20 0 CHADHO CC1=C(C)CN([C@@H](C)CC[N@@H+]2CCC(C)=C(C)C2)CC1 ZINC000483380212 1120664665 /nfs/dbraw/zinc/66/46/65/1120664665.db2.gz PIOGPBQCCMSOFD-SFHVURJKSA-N 1 3 276.468 3.849 20 0 CHADHO CC1=C(C)CN([C@@H](C)CC[N@H+]2CCC(C)=C(C)C2)CC1 ZINC000483380212 1120664668 /nfs/dbraw/zinc/66/46/68/1120664668.db2.gz PIOGPBQCCMSOFD-SFHVURJKSA-N 1 3 276.468 3.849 20 0 CHADHO CC[NH+](CC)C[C@H]1CCN(C[C@H](C)Cc2ccccc2)C1 ZINC000248547136 1120878076 /nfs/dbraw/zinc/87/80/76/1120878076.db2.gz FAOUDDGZQBFAMT-IEBWSBKVSA-N 1 3 288.479 3.529 20 0 CHADHO CCN(CC)C[C@H]1CC[N@H+](C[C@H](C)Cc2ccccc2)C1 ZINC000248547136 1120878080 /nfs/dbraw/zinc/87/80/80/1120878080.db2.gz FAOUDDGZQBFAMT-IEBWSBKVSA-N 1 3 288.479 3.529 20 0 CHADHO CCN(CC)C[C@H]1CC[N@@H+](C[C@H](C)Cc2ccccc2)C1 ZINC000248547136 1120878084 /nfs/dbraw/zinc/87/80/84/1120878084.db2.gz FAOUDDGZQBFAMT-IEBWSBKVSA-N 1 3 288.479 3.529 20 0 CHADHO CC1(C)C[C@]1(CN[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000663368034 1120947851 /nfs/dbraw/zinc/94/78/51/1120947851.db2.gz MSYGIGYMSCAWCH-NSHGMRRFSA-N 1 3 298.474 3.571 20 0 CHADHO CC1(C)C[C@]1(CN[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000663368034 1120947855 /nfs/dbraw/zinc/94/78/55/1120947855.db2.gz MSYGIGYMSCAWCH-NSHGMRRFSA-N 1 3 298.474 3.571 20 0 CHADHO FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663466328 1120980682 /nfs/dbraw/zinc/98/06/82/1120980682.db2.gz RAQGFPNTGVEPIY-BZSNNMDCSA-N 1 3 296.474 3.616 20 0 CHADHO CCC[C@@H]([NH2+]C[C@H]1CCCN(CC2CC2)C1)C1CCC1 ZINC000663466206 1120981054 /nfs/dbraw/zinc/98/10/54/1120981054.db2.gz PKIPYTHMCCEQGS-SJLPKXTDSA-N 1 3 278.484 3.667 20 0 CHADHO CCN(CC)Cc1cc([C@H](C)[NH2+]CC2CC2)ccc1OC ZINC000182312473 1128955874 /nfs/dbraw/zinc/95/58/74/1128955874.db2.gz AYMCKQHLTVRMTC-AWEZNQCLSA-N 1 3 290.451 3.598 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@H]1C[C@H](C)CC(C)(C)C1 ZINC000300402529 1121018684 /nfs/dbraw/zinc/01/86/84/1121018684.db2.gz ULSJPSOYJNHICZ-GJZGRUSLSA-N 1 3 254.462 3.521 20 0 CHADHO Cc1oc2ccccc2c1C[NH2+]CCCN1CCCCC1 ZINC000123216301 1121263461 /nfs/dbraw/zinc/26/34/61/1121263461.db2.gz KRCIPVFSOPCEOK-UHFFFAOYSA-N 1 3 286.419 3.707 20 0 CHADHO CC[C@H](CN[C@@H]1C[C@H](C)c2ccccc21)[NH+]1CCCC1 ZINC000675642496 1121330782 /nfs/dbraw/zinc/33/07/82/1121330782.db2.gz PJNXTRHCIBXHDB-HDMKZQKVSA-N 1 3 272.436 3.699 20 0 CHADHO CC1CC[NH+](C[C@H]2CCCN(CC3(C)CCC3)C2)CC1 ZINC000432941696 1121489606 /nfs/dbraw/zinc/48/96/06/1121489606.db2.gz XJIKOQQZIHRHDB-QGZVFWFLSA-N 1 3 278.484 3.621 20 0 CHADHO Cc1cc(C)c(/C=C\CNC[C@H]2CCC[N@H+](C)C2)c(C)c1 ZINC001177795138 1121751588 /nfs/dbraw/zinc/75/15/88/1121751588.db2.gz OJEMHLGXXCDQPU-GNJLHFKMSA-N 1 3 286.463 3.556 20 0 CHADHO Cc1cc(C)c(/C=C\CNC[C@H]2CCC[N@@H+](C)C2)c(C)c1 ZINC001177795138 1121751584 /nfs/dbraw/zinc/75/15/84/1121751584.db2.gz OJEMHLGXXCDQPU-GNJLHFKMSA-N 1 3 286.463 3.556 20 0 CHADHO CCN(Cc1csc2ccccc12)[C@H]1CCC[NH2+]CC1 ZINC000345195406 1121852696 /nfs/dbraw/zinc/85/26/96/1121852696.db2.gz AWRAQNHHKQOXLA-HNNXBMFYSA-N 1 3 288.460 3.865 20 0 CHADHO c1ccc2c(c1)cccc2C1CCN(C[C@@H]2CC[NH2+]C2)CC1 ZINC000647882998 1121894246 /nfs/dbraw/zinc/89/42/46/1121894246.db2.gz YMPFWNQPKMYGBU-MRXNPFEDSA-N 1 3 294.442 3.629 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(C3CC3)cc2)[C@@H](C)C1 ZINC001179906656 1121928865 /nfs/dbraw/zinc/92/88/65/1121928865.db2.gz ZLGOKHIDONMNLM-HNAYVOBHSA-N 1 3 286.463 3.726 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2ccc(C3CC3)cc2)[C@@H](C)C1 ZINC001179906656 1121928872 /nfs/dbraw/zinc/92/88/72/1121928872.db2.gz ZLGOKHIDONMNLM-HNAYVOBHSA-N 1 3 286.463 3.726 20 0 CHADHO C[NH+](C)CCCC1CCN(Cc2ccccc2Cl)CC1 ZINC000501768620 1122006192 /nfs/dbraw/zinc/00/61/92/1122006192.db2.gz CKTAHHIPEGHCHF-UHFFFAOYSA-N 1 3 294.870 3.894 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1C[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC001203263048 1122078423 /nfs/dbraw/zinc/07/84/23/1122078423.db2.gz FIIKEEAWIXTPLZ-QXAKKESOSA-N 1 3 290.495 3.690 20 0 CHADHO CC(C)c1ccccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)N2C ZINC000774367443 1122157248 /nfs/dbraw/zinc/15/72/48/1122157248.db2.gz LFKXQSPIEOYBBU-ALOPSCKCSA-N 1 3 272.436 3.525 20 0 CHADHO C[C@H](C[NH2+]C[C@H]1C[C@@H]1c1ccccc1)CN1CCCCC1 ZINC000503031144 1122162815 /nfs/dbraw/zinc/16/28/15/1122162815.db2.gz CIOZUEFZNYRGBT-BHIYHBOVSA-N 1 3 286.463 3.502 20 0 CHADHO CC[NH+]1CCC(CNC2(c3ccccc3Cl)CC2)CC1 ZINC001182533358 1122173396 /nfs/dbraw/zinc/17/33/96/1122173396.db2.gz OJZHQALXLKLARD-UHFFFAOYSA-N 1 3 292.854 3.651 20 0 CHADHO CN1C[C@@H]2CC[C@H]([NH2+]C3CCC(c4ccccc4)CC3)[C@H]2C1 ZINC001184387484 1122273000 /nfs/dbraw/zinc/27/30/00/1122273000.db2.gz LFGSNAGWLOPSSI-TZCBXBLLSA-N 1 3 298.474 3.643 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+]C1CC(c2ccc(F)cc2)C1 ZINC001184418415 1122275844 /nfs/dbraw/zinc/27/58/44/1122275844.db2.gz OEODUPVESZQSBD-NXVRBGIVSA-N 1 3 292.442 3.782 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+]C[C@H]1C(C)=CCC[C@H]1C ZINC001184418059 1122276242 /nfs/dbraw/zinc/27/62/42/1122276242.db2.gz KJIUUZUBFWHYAA-IKGGRYGDSA-N 1 3 266.473 3.689 20 0 CHADHO CCN(CC)CCC[NH2+][C@H]1CC[C@@H](c2ccccc2)C1 ZINC000436276930 1122529669 /nfs/dbraw/zinc/52/96/69/1122529669.db2.gz VSONNHYLKDJVBV-MSOLQXFVSA-N 1 3 274.452 3.644 20 0 CHADHO C[C@H](C[NH2+][C@H]1CC[C@@H](c2ccccc2)C1)CN1CCCC1 ZINC000436276876 1122532745 /nfs/dbraw/zinc/53/27/45/1122532745.db2.gz VSERVRBETYRFMK-QRQLOZEOSA-N 1 3 286.463 3.644 20 0 CHADHO C[C@@]1(c2ccccc2)CC[C@H]([NH2+]CCCN2CCCC2)C1 ZINC000437776271 1122655641 /nfs/dbraw/zinc/65/56/41/1122655641.db2.gz OYFUNVWVKMMFHO-RBUKOAKNSA-N 1 3 286.463 3.572 20 0 CHADHO CC(C)[C@H](CSc1ccccc1)[NH2+]C[C@@H](C)CN(C)C ZINC000425938316 1122668507 /nfs/dbraw/zinc/66/85/07/1122668507.db2.gz WUYLPMMWBPXAGE-WBVHZDCISA-N 1 3 294.508 3.591 20 0 CHADHO C[C@H](C[NH2+][C@H](C)c1ccc(OC(C)(C)C)cc1)CN(C)C ZINC000425947103 1122676242 /nfs/dbraw/zinc/67/62/42/1122676242.db2.gz ZHISNVOOKZCYCW-HUUCEWRRSA-N 1 3 292.467 3.712 20 0 CHADHO c1ccc([C@H]2C[C@@H]2NC2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167965814 1122817475 /nfs/dbraw/zinc/81/74/75/1122817475.db2.gz NGDNLINFNQUUOQ-NOSIKRSBSA-N 1 3 296.458 3.538 20 0 CHADHO c1ccc([C@H]2C[C@@H]2NC2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167965814 1122817480 /nfs/dbraw/zinc/81/74/80/1122817480.db2.gz NGDNLINFNQUUOQ-NOSIKRSBSA-N 1 3 296.458 3.538 20 0 CHADHO CC(C)CN1CCC([NH2+]C/C=C\c2ccc(F)cc2)CC1 ZINC001199144707 1123021561 /nfs/dbraw/zinc/02/15/61/1123021561.db2.gz VKPMPQWYOWMKGO-ARJAWSKDSA-N 1 3 290.426 3.549 20 0 CHADHO C[C@@H](C[NH2+]C[C@H](C)CN1CCCC1)CC1CCCCC1 ZINC001199403581 1123029864 /nfs/dbraw/zinc/02/98/64/1123029864.db2.gz VYWVHKRHBGWJHG-SJORKVTESA-N 1 3 280.500 3.914 20 0 CHADHO CC[C@H](c1ccccc1)N(C)CC[C@H]1CCCC[N@@H+]1C ZINC000441342232 1123080150 /nfs/dbraw/zinc/08/01/50/1123080150.db2.gz YDGIDQNXYXRKFQ-QZTJIDSGSA-N 1 3 274.452 3.944 20 0 CHADHO CC[C@H](c1ccccc1)N(C)CC[C@H]1CCCC[N@H+]1C ZINC000441342232 1123080156 /nfs/dbraw/zinc/08/01/56/1123080156.db2.gz YDGIDQNXYXRKFQ-QZTJIDSGSA-N 1 3 274.452 3.944 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@@H+]1C[C@H]1CC=CCC1 ZINC001201423675 1123098279 /nfs/dbraw/zinc/09/82/79/1123098279.db2.gz RKHFGWQSRIHNPJ-OKZBNKHCSA-N 1 3 276.468 3.682 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@H+]1C[C@H]1CC=CCC1 ZINC001201423675 1123098280 /nfs/dbraw/zinc/09/82/80/1123098280.db2.gz RKHFGWQSRIHNPJ-OKZBNKHCSA-N 1 3 276.468 3.682 20 0 CHADHO CC(C)CC[N@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001201630551 1123129257 /nfs/dbraw/zinc/12/92/57/1123129257.db2.gz VSTNFXUACFUNGB-UHFFFAOYSA-N 1 3 266.473 3.761 20 0 CHADHO CC(C)CC[N@@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001201630551 1123129260 /nfs/dbraw/zinc/12/92/60/1123129260.db2.gz VSTNFXUACFUNGB-UHFFFAOYSA-N 1 3 266.473 3.761 20 0 CHADHO CN(C)CC1(C[NH2+]C/C=C/c2ccc(F)cc2)CCCC1 ZINC001201929582 1123157743 /nfs/dbraw/zinc/15/77/43/1123157743.db2.gz OIANMZWCINJMDV-AATRIKPKSA-N 1 3 290.426 3.551 20 0 CHADHO Cc1ccc(CCN[C@@H]2C[C@@H]([NH3+])c3ccccc32)cc1C ZINC000665245285 1123252240 /nfs/dbraw/zinc/25/22/40/1123252240.db2.gz DJZLGFCVOVPHDN-RTBURBONSA-N 1 3 280.415 3.580 20 0 CHADHO C[C@H]1CC[C@@H]([NH2+]CC2(N)CCCC2)c2sccc21 ZINC000665246566 1123254183 /nfs/dbraw/zinc/25/41/83/1123254183.db2.gz IXAGBNNXZWLHHK-WCQYABFASA-N 1 3 264.438 3.548 20 0 CHADHO CCC[C@@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccsc1 ZINC000191200562 1123396647 /nfs/dbraw/zinc/39/66/47/1123396647.db2.gz YGFOEIHFJVIEKP-CZUORRHYSA-N 1 3 278.465 3.663 20 0 CHADHO CCC[C@@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1ccsc1 ZINC000191200562 1123396649 /nfs/dbraw/zinc/39/66/49/1123396649.db2.gz YGFOEIHFJVIEKP-CZUORRHYSA-N 1 3 278.465 3.663 20 0 CHADHO CC[NH+]1CCC(N(C)Cc2c(C)cc(C)cc2C)CC1 ZINC000157457625 1129128754 /nfs/dbraw/zinc/12/87/54/1129128754.db2.gz UAIIAFATAHPWNZ-UHFFFAOYSA-N 1 3 274.452 3.528 20 0 CHADHO C[NH+](C)[C@@H]1CCCN(CCc2ccc3ccccc3c2)CC1 ZINC000429529986 1123547836 /nfs/dbraw/zinc/54/78/36/1123547836.db2.gz QXTGBPQIYPDVMX-HXUWFJFHSA-N 1 3 296.458 3.798 20 0 CHADHO CN(C)[C@@H]1CCC[N@H+](CCc2ccc3ccccc3c2)CC1 ZINC000429529986 1123547839 /nfs/dbraw/zinc/54/78/39/1123547839.db2.gz QXTGBPQIYPDVMX-HXUWFJFHSA-N 1 3 296.458 3.798 20 0 CHADHO CN(C)[C@@H]1CCC[N@@H+](CCc2ccc3ccccc3c2)CC1 ZINC000429529986 1123547843 /nfs/dbraw/zinc/54/78/43/1123547843.db2.gz QXTGBPQIYPDVMX-HXUWFJFHSA-N 1 3 296.458 3.798 20 0 CHADHO C[C@@H](c1cccc2ccccc21)N1CC[C@]2(CC[NH2+]C2)C1 ZINC000313870182 1129129371 /nfs/dbraw/zinc/12/93/71/1129129371.db2.gz QSRIHCMKEZARSW-KXBFYZLASA-N 1 3 280.415 3.586 20 0 CHADHO CCN1CCC[C@H](C[NH2+]C[C@@H](c2ccccc2)C(C)C)C1 ZINC000474604003 1123557754 /nfs/dbraw/zinc/55/77/54/1123557754.db2.gz PYMCCEIBJHDQEA-IEBWSBKVSA-N 1 3 288.479 3.748 20 0 CHADHO C[C@@H]1CCN1[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168038977 1123559065 /nfs/dbraw/zinc/55/90/65/1123559065.db2.gz AQGNHSLKJBKQKB-XLMAVXFVSA-N 1 3 272.436 3.522 20 0 CHADHO C[C@@H]1CCN1[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168038977 1123559070 /nfs/dbraw/zinc/55/90/70/1123559070.db2.gz AQGNHSLKJBKQKB-XLMAVXFVSA-N 1 3 272.436 3.522 20 0 CHADHO CCCN1CC[C@@H](C[NH2+]C[C@H](c2ccccc2)C(C)C)C1 ZINC000474633561 1123562914 /nfs/dbraw/zinc/56/29/14/1123562914.db2.gz ZEBDNFBZAIHXDV-HKUYNNGSSA-N 1 3 288.479 3.748 20 0 CHADHO Cc1cc(C)c(C[N@H+]2CCC[C@H](N(C)C)CC2)c(C)c1 ZINC000429533152 1123563480 /nfs/dbraw/zinc/56/34/80/1123563480.db2.gz ZICLNDPGPQVAAD-KRWDZBQOSA-N 1 3 274.452 3.528 20 0 CHADHO Cc1cc(C)c(C[N@@H+]2CCC[C@H](N(C)C)CC2)c(C)c1 ZINC000429533152 1123563482 /nfs/dbraw/zinc/56/34/82/1123563482.db2.gz ZICLNDPGPQVAAD-KRWDZBQOSA-N 1 3 274.452 3.528 20 0 CHADHO Cc1cc(C)c(CN2CCC[C@H]([NH+](C)C)CC2)c(C)c1 ZINC000429533152 1123563486 /nfs/dbraw/zinc/56/34/86/1123563486.db2.gz ZICLNDPGPQVAAD-KRWDZBQOSA-N 1 3 274.452 3.528 20 0 CHADHO Cc1ccc([C@@H](C)N[C@@H]2CC[N@H+](C)C(C)(C)C2)s1 ZINC000858106879 1123631825 /nfs/dbraw/zinc/63/18/25/1123631825.db2.gz CICXDQKOTPINGE-CHWSQXEVSA-N 1 3 266.454 3.580 20 0 CHADHO Cc1ccc([C@@H](C)N[C@@H]2CC[N@@H+](C)C(C)(C)C2)s1 ZINC000858106879 1123631827 /nfs/dbraw/zinc/63/18/27/1123631827.db2.gz CICXDQKOTPINGE-CHWSQXEVSA-N 1 3 266.454 3.580 20 0 CHADHO C[C@H]1C[C@@H](C[NH3+])CN1Cc1cc(-c2ccccc2)cs1 ZINC000469860034 1123757842 /nfs/dbraw/zinc/75/78/42/1123757842.db2.gz DRITXTWZOYNUOG-KBPBESRZSA-N 1 3 286.444 3.584 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](CC(C)C)c2cccs2)C1 ZINC000163279693 1129143927 /nfs/dbraw/zinc/14/39/27/1129143927.db2.gz HXWZUZZBHDYOGB-GJZGRUSLSA-N 1 3 280.481 3.767 20 0 CHADHO CN(C)[C@H]1CCC[N@H+](Cc2cccc3ccccc32)CC1 ZINC000429549917 1123822261 /nfs/dbraw/zinc/82/22/61/1123822261.db2.gz QDZKIUNUSASGIK-SFHVURJKSA-N 1 3 282.431 3.756 20 0 CHADHO CN(C)[C@H]1CCC[N@@H+](Cc2cccc3ccccc32)CC1 ZINC000429549917 1123822262 /nfs/dbraw/zinc/82/22/62/1123822262.db2.gz QDZKIUNUSASGIK-SFHVURJKSA-N 1 3 282.431 3.756 20 0 CHADHO C[NH+](C)[C@H]1CCCN(Cc2cccc3ccccc32)CC1 ZINC000429549917 1123822265 /nfs/dbraw/zinc/82/22/65/1123822265.db2.gz QDZKIUNUSASGIK-SFHVURJKSA-N 1 3 282.431 3.756 20 0 CHADHO CC(C)[C@@H](C[N@H+]1CCC[C@@H](N(C)C)CC1)c1ccccc1 ZINC000475218632 1123824738 /nfs/dbraw/zinc/82/47/38/1123824738.db2.gz ZERBOVYNGZOLCF-RTBURBONSA-N 1 3 288.479 3.842 20 0 CHADHO CC(C)[C@@H](C[N@@H+]1CCC[C@@H](N(C)C)CC1)c1ccccc1 ZINC000475218632 1123824734 /nfs/dbraw/zinc/82/47/34/1123824734.db2.gz ZERBOVYNGZOLCF-RTBURBONSA-N 1 3 288.479 3.842 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN(c2ccnc3ccc(C)cc32)C1 ZINC000302181820 1123959862 /nfs/dbraw/zinc/95/98/62/1123959862.db2.gz ZXADJZLQXJOCMP-MRXNPFEDSA-N 1 3 297.446 3.711 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN(c2ccnc3ccc(C)cc32)C1 ZINC000302181820 1123959865 /nfs/dbraw/zinc/95/98/65/1123959865.db2.gz ZXADJZLQXJOCMP-MRXNPFEDSA-N 1 3 297.446 3.711 20 0 CHADHO C(C[C@H]1CCCS1)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000865726300 1124009140 /nfs/dbraw/zinc/00/91/40/1124009140.db2.gz WTXWSODZYCLQJL-QGZVFWFLSA-N 1 3 296.524 3.659 20 0 CHADHO C[NH+]1CCC2(CCN(c3ccnc4ccccc43)CC2)CC1 ZINC000866054759 1124031322 /nfs/dbraw/zinc/03/13/22/1124031322.db2.gz ITSUQUIAKUFAKL-UHFFFAOYSA-N 1 3 295.430 3.547 20 0 CHADHO CC[N@H+](CCCN1CCCCC1)Cc1cccc(F)c1 ZINC000444591882 1124044201 /nfs/dbraw/zinc/04/42/01/1124044201.db2.gz OLXUTEPHDOSWRR-UHFFFAOYSA-N 1 3 278.415 3.524 20 0 CHADHO CC[N@@H+](CCCN1CCCCC1)Cc1cccc(F)c1 ZINC000444591882 1124044205 /nfs/dbraw/zinc/04/42/05/1124044205.db2.gz OLXUTEPHDOSWRR-UHFFFAOYSA-N 1 3 278.415 3.524 20 0 CHADHO CCC[NH+]1CCC(N(C)CCc2ccccc2CC)CC1 ZINC000444649405 1124047843 /nfs/dbraw/zinc/04/78/43/1124047843.db2.gz MDJKYFZLNYEIHP-UHFFFAOYSA-N 1 3 288.479 3.598 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)CCc2ccc(Cl)cc2)C[C@H]1C ZINC000445209746 1124076738 /nfs/dbraw/zinc/07/67/38/1124076738.db2.gz HADYZFVIYSCSPC-PBHICJAKSA-N 1 3 294.870 3.687 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)CCc2ccc(Cl)cc2)C[C@H]1C ZINC000445209746 1124076743 /nfs/dbraw/zinc/07/67/43/1124076743.db2.gz HADYZFVIYSCSPC-PBHICJAKSA-N 1 3 294.870 3.687 20 0 CHADHO CC(C)C(C[NH2+]C1CCN(C(C)(C)C)CC1)C(C)C ZINC000193340012 1124125892 /nfs/dbraw/zinc/12/58/92/1124125892.db2.gz CVDLPMUKGJHYQR-UHFFFAOYSA-N 1 3 268.489 3.767 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1cccc(F)c1 ZINC000446939154 1124128806 /nfs/dbraw/zinc/12/88/06/1124128806.db2.gz ZPWKLGLBUJZAPI-BBWFWOEESA-N 1 3 278.415 3.739 20 0 CHADHO CC[C@@H](NCc1cccc2c1CC[NH2+]C2)c1ccsc1 ZINC000635007591 1129169528 /nfs/dbraw/zinc/16/95/28/1129169528.db2.gz DWBGSVLDKQGMJO-QGZVFWFLSA-N 1 3 286.444 3.635 20 0 CHADHO CC[C@@H](N[C@@H]1CC[NH2+]CC(C)(C)C1)c1cccc(OC)c1 ZINC000635009209 1129169916 /nfs/dbraw/zinc/16/99/16/1129169916.db2.gz GGINPNFLOWOLBZ-NVXWUHKLSA-N 1 3 290.451 3.514 20 0 CHADHO CC1(C)CC(C[NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000527363220 1124574100 /nfs/dbraw/zinc/57/41/00/1124574100.db2.gz UFUIGYZQORPXJC-UHFFFAOYSA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]Cc2cccc3ccoc32)C1 ZINC000449132731 1124654576 /nfs/dbraw/zinc/65/45/76/1124654576.db2.gz VZQIATQUXQZVLX-OAHLLOKOSA-N 1 3 286.419 3.643 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1cccc([O-])c1F ZINC000872017325 1124656594 /nfs/dbraw/zinc/65/65/94/1124656594.db2.gz ZEZNUVHLDOWRQO-ZIAGYGMSSA-N 1 3 296.430 3.692 20 0 CHADHO C[C@H]([NH2+]CC1CC(C)(C)C1)[C@@H]1CCCN(C2CCC2)C1 ZINC000528439843 1124667106 /nfs/dbraw/zinc/66/71/06/1124667106.db2.gz IWYCXAUMWLMRHY-GOEBONIOSA-N 1 3 278.484 3.665 20 0 CHADHO C[C@@H]1CC[C@@H](C)[C@H]([NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000449187348 1124668298 /nfs/dbraw/zinc/66/82/98/1124668298.db2.gz QMDYEKUCJVEUJC-IIDMSEBBSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@H](CSc1ccc(Cl)cc1)N[C@@H]1CCC[NH2+]CC1 ZINC001246099904 1131316979 /nfs/dbraw/zinc/31/69/79/1131316979.db2.gz YZAZSEAQHGRRTJ-TZMCWYRMSA-N 1 3 298.883 3.552 20 0 CHADHO CC(C)[NH+]1CCC(N(C)C[C@H]2CCCCC2(F)F)CC1 ZINC000450338012 1124986223 /nfs/dbraw/zinc/98/62/23/1124986223.db2.gz IPKGIUAYTROPHE-CQSZACIVSA-N 1 3 288.426 3.617 20 0 CHADHO C(=C\c1ccccc1)\CCN1CC[C@H](C[NH+]2CCCC2)C1 ZINC000450429944 1125022041 /nfs/dbraw/zinc/02/20/41/1125022041.db2.gz OGFXQAUBXCEISO-KZIVNFMESA-N 1 3 284.447 3.508 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN(CC/C=C/c2ccccc2)C1 ZINC000450463266 1125028161 /nfs/dbraw/zinc/02/81/61/1125028161.db2.gz NMFGZFIUFNKKET-SSVWKNEZSA-N 1 3 286.463 3.754 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN(CC/C=C/c2ccccc2)C1 ZINC000450463266 1125028170 /nfs/dbraw/zinc/02/81/70/1125028170.db2.gz NMFGZFIUFNKKET-SSVWKNEZSA-N 1 3 286.463 3.754 20 0 CHADHO CCc1cccc(Cl)c1CN(C)CC1CC[NH+](C)CC1 ZINC000475714622 1125276466 /nfs/dbraw/zinc/27/64/66/1125276466.db2.gz KUFFBTDMTNTWTN-UHFFFAOYSA-N 1 3 294.870 3.676 20 0 CHADHO CC1CCC(N2CCC([NH3+])(c3ccc(F)cc3)CC2)CC1 ZINC001168204410 1125411495 /nfs/dbraw/zinc/41/14/95/1125411495.db2.gz PYCLVDATWRWWLX-UHFFFAOYSA-N 1 3 290.426 3.654 20 0 CHADHO Cc1ccc2c(c1)[C@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)CCC2 ZINC001202612365 1125444600 /nfs/dbraw/zinc/44/46/00/1125444600.db2.gz WNAXDCKCOAVGKR-SJLPKXTDSA-N 1 3 286.463 3.835 20 0 CHADHO Cc1ccc2c(c1)[C@H](N[C@@H]1CC[N@H+](C)C(C)(C)C1)CCC2 ZINC001202612365 1125444601 /nfs/dbraw/zinc/44/46/01/1125444601.db2.gz WNAXDCKCOAVGKR-SJLPKXTDSA-N 1 3 286.463 3.835 20 0 CHADHO C[C@@H](N[C@H]1CCC[NH2+]CC1)c1cccc(-c2ccncc2)c1 ZINC000643522913 1129443804 /nfs/dbraw/zinc/44/38/04/1129443804.db2.gz USJOTOGRSXIGNI-BEFAXECRSA-N 1 3 295.430 3.541 20 0 CHADHO CC(C)Cc1cccc([C@@H](C)N[C@@H]2CCC[NH2+]CC2)c1 ZINC000643522681 1129444909 /nfs/dbraw/zinc/44/49/09/1129444909.db2.gz RTXVDVYOHUBGQV-CRAIPNDOSA-N 1 3 274.452 3.678 20 0 CHADHO C[C@@H](CN)C[N@H+](Cc1ccccc1)[C@H]1CCC(C)(C)C1 ZINC001258598470 1129454958 /nfs/dbraw/zinc/45/49/58/1129454958.db2.gz HLTNIRILNWHCLV-RDJZCZTQSA-N 1 3 274.452 3.662 20 0 CHADHO C[C@@H](CN)C[N@@H+](Cc1ccccc1)[C@H]1CCC(C)(C)C1 ZINC001258598470 1129454960 /nfs/dbraw/zinc/45/49/60/1129454960.db2.gz HLTNIRILNWHCLV-RDJZCZTQSA-N 1 3 274.452 3.662 20 0 CHADHO CCN(C)C1CC[NH+]([C@@H]2C[C@H](C)CC(C)(C)C2)CC1 ZINC001258705720 1129536864 /nfs/dbraw/zinc/53/68/64/1129536864.db2.gz YIIKRFXBEBCQEB-GOEBONIOSA-N 1 3 266.473 3.617 20 0 CHADHO Cc1ccc(C2(NC3CC[NH+](C(C)C)CC3)CCC2)cc1 ZINC000647351770 1129574299 /nfs/dbraw/zinc/57/42/99/1129574299.db2.gz TZVKXEYAAPFRAP-UHFFFAOYSA-N 1 3 286.463 3.837 20 0 CHADHO C[C@@H]1SCC[C@@H]1[NH2+]C1CCN([C@H]2CCC[C@@H](C)C2)CC1 ZINC000647357644 1129575021 /nfs/dbraw/zinc/57/50/21/1129575021.db2.gz GELKQOTWADHWBF-OHFALNGGSA-N 1 3 296.524 3.513 20 0 CHADHO CC[C@@H]1C[N@@H+]([C@@H]2CC[C@@](C)(c3ccccc3)C2)CC[C@H]1N ZINC000647497295 1129579478 /nfs/dbraw/zinc/57/94/78/1129579478.db2.gz BXVRCVRNGWELTL-NXWXRZEISA-N 1 3 286.463 3.556 20 0 CHADHO CC[C@@H]1C[N@H+]([C@@H]2CC[C@@](C)(c3ccccc3)C2)CC[C@H]1N ZINC000647497295 1129579481 /nfs/dbraw/zinc/57/94/81/1129579481.db2.gz BXVRCVRNGWELTL-NXWXRZEISA-N 1 3 286.463 3.556 20 0 CHADHO CCC[C@H](NCc1ccc(C[NH3+])cc1)c1ccsc1 ZINC000647803292 1129584855 /nfs/dbraw/zinc/58/48/55/1129584855.db2.gz RRQXTDODSYYNMN-INIZCTEOSA-N 1 3 274.433 3.838 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NC[C@H]2C[C@@H]2c2ccccc2)c2ccccc21 ZINC000647800502 1129584885 /nfs/dbraw/zinc/58/48/85/1129584885.db2.gz CTGYCMXSMAKNAX-UTRMSSBJSA-N 1 3 278.399 3.525 20 0 CHADHO CC1([NH3+])CCN(CCCc2cccc3ccccc32)CC1 ZINC000647924708 1129588414 /nfs/dbraw/zinc/58/84/14/1129588414.db2.gz DUSHUOIDKYQFKW-UHFFFAOYSA-N 1 3 282.431 3.586 20 0 CHADHO C[NH2+]Cc1ccccc1CNCc1ccc(C(C)(C)C)cc1 ZINC000650718476 1129720555 /nfs/dbraw/zinc/72/05/55/1129720555.db2.gz OHGCVGLUPFGIDX-UHFFFAOYSA-N 1 3 296.458 3.993 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H]2CCCCC[C@H]2C)C1 ZINC000651706118 1129745582 /nfs/dbraw/zinc/74/55/82/1129745582.db2.gz TUBYIHJEDTZSGA-ZACQAIPSSA-N 1 3 266.473 3.665 20 0 CHADHO CC[N@@H+]1CC[C@@H](NCc2cccc3ccsc32)[C@@H](C)C1 ZINC000651863665 1129750096 /nfs/dbraw/zinc/75/00/96/1129750096.db2.gz SKNVMJWBSZJXLW-XJKSGUPXSA-N 1 3 288.460 3.721 20 0 CHADHO CC[N@H+]1CC[C@@H](NCc2cccc3ccsc32)[C@@H](C)C1 ZINC000651863665 1129750098 /nfs/dbraw/zinc/75/00/98/1129750098.db2.gz SKNVMJWBSZJXLW-XJKSGUPXSA-N 1 3 288.460 3.721 20 0 CHADHO CN(Cc1ccc(F)cc1)Cc1ccc(C[NH+](C)C)cc1 ZINC000768173939 1129838937 /nfs/dbraw/zinc/83/89/37/1129838937.db2.gz GYYTUGQNHOBLDL-UHFFFAOYSA-N 1 3 286.394 3.519 20 0 CHADHO CCCCCC1CCC([NH2+][C@@H]2CCNC[C@H]2C)CC1 ZINC001246211256 1131401268 /nfs/dbraw/zinc/40/12/68/1131401268.db2.gz QDHSTUFRWVWEFV-RDHHWEPZSA-N 1 3 266.473 3.713 20 0 CHADHO Cc1cccc(C)c1CCNC1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903123926 1130116757 /nfs/dbraw/zinc/11/67/57/1130116757.db2.gz DFDXUMXCSGGQFK-JLYLLQBASA-N 1 3 298.474 3.593 20 0 CHADHO Cc1cccc(C)c1CCNC1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1 ZINC000903123926 1130116759 /nfs/dbraw/zinc/11/67/59/1130116759.db2.gz DFDXUMXCSGGQFK-JLYLLQBASA-N 1 3 298.474 3.593 20 0 CHADHO C[C@@H]1CC[C@@H]([NH2+]C2CCN(CC3CCCCC3)CC2)C1 ZINC001170112323 1130264105 /nfs/dbraw/zinc/26/41/05/1130264105.db2.gz JBOXTHIIWFMBJV-CRAIPNDOSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H]1CC[C@@H](N2CCC([NH3+])(c3cccc(Cl)c3)CC2)C1 ZINC001170119611 1130275212 /nfs/dbraw/zinc/27/52/12/1130275212.db2.gz ZCZVSHRMADFLMK-CZUORRHYSA-N 1 3 292.854 3.778 20 0 CHADHO C[C@H]1CC[C@@H](N2CCC([NH3+])(c3ccc(Cl)cc3)CC2)C1 ZINC001170122409 1130282477 /nfs/dbraw/zinc/28/24/77/1130282477.db2.gz QDTAGZXFWCXVIX-XJKSGUPXSA-N 1 3 292.854 3.778 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2N[C@H]1CC[N@H+](CC2CC2)C1 ZINC000678114369 1130350637 /nfs/dbraw/zinc/35/06/37/1130350637.db2.gz DNHIWLKOJDQTID-HFTRVMKXSA-N 1 3 284.447 3.617 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000678114369 1130350642 /nfs/dbraw/zinc/35/06/42/1130350642.db2.gz DNHIWLKOJDQTID-HFTRVMKXSA-N 1 3 284.447 3.617 20 0 CHADHO C[C@@H]1CC[C@@H]([NH+]2CCC3(CN(Cc4ccccc4)C3)CC2)C1 ZINC001170150310 1130357631 /nfs/dbraw/zinc/35/76/31/1130357631.db2.gz NQHGAMZZHVRXAV-IEBWSBKVSA-N 1 3 298.474 3.773 20 0 CHADHO Cc1ccc([C@@H](C)NCc2cccc(C[NH+](C)C)c2)c(C)n1 ZINC000678411391 1130412114 /nfs/dbraw/zinc/41/21/14/1130412114.db2.gz LJCUSKZBXWLHFZ-OAHLLOKOSA-N 1 3 297.446 3.611 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H]2c3ccccc3CC[C@@H]2C)C1 ZINC000678767552 1130451168 /nfs/dbraw/zinc/45/11/68/1130451168.db2.gz NEEZRWRRDITVCO-FRQCXROJSA-N 1 3 286.463 3.632 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H]2c3ccccc3CC[C@@H]2C)C1 ZINC000678767552 1130451170 /nfs/dbraw/zinc/45/11/70/1130451170.db2.gz NEEZRWRRDITVCO-FRQCXROJSA-N 1 3 286.463 3.632 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H]2c3ccccc3CC[C@@H]2C)C1 ZINC000678767552 1130451172 /nfs/dbraw/zinc/45/11/72/1130451172.db2.gz NEEZRWRRDITVCO-FRQCXROJSA-N 1 3 286.463 3.632 20 0 CHADHO CCCCN(C)CCC[NH2+][C@H](C)Cc1ccccc1Cl ZINC001170250652 1130474399 /nfs/dbraw/zinc/47/43/99/1130474399.db2.gz QLZXRVVWZRRBIR-OAHLLOKOSA-N 1 3 296.886 3.983 20 0 CHADHO CCCC[N@H+](C)CCCN[C@H](C)Cc1ccccc1Cl ZINC001170250652 1130474400 /nfs/dbraw/zinc/47/44/00/1130474400.db2.gz QLZXRVVWZRRBIR-OAHLLOKOSA-N 1 3 296.886 3.983 20 0 CHADHO CCCC[N@@H+](C)CCCN[C@H](C)Cc1ccccc1Cl ZINC001170250652 1130474403 /nfs/dbraw/zinc/47/44/03/1130474403.db2.gz QLZXRVVWZRRBIR-OAHLLOKOSA-N 1 3 296.886 3.983 20 0 CHADHO CC(C)[N@H+](C)Cc1cccc(CNCc2ccc(O)cc2)c1 ZINC000679401400 1130527473 /nfs/dbraw/zinc/52/74/73/1130527473.db2.gz WYBMRBFCULANMD-UHFFFAOYSA-N 1 3 298.430 3.522 20 0 CHADHO CC(C)[N@@H+](C)Cc1cccc(CNCc2ccc(O)cc2)c1 ZINC000679401400 1130527478 /nfs/dbraw/zinc/52/74/78/1130527478.db2.gz WYBMRBFCULANMD-UHFFFAOYSA-N 1 3 298.430 3.522 20 0 CHADHO c1cc2c(cccc2C[N@@H+]2CCCC23CCNCC3)s1 ZINC001235143916 1130714862 /nfs/dbraw/zinc/71/48/62/1130714862.db2.gz GNSRIWGIPOMUQP-UHFFFAOYSA-N 1 3 286.444 3.619 20 0 CHADHO c1cc2c(cccc2C[N@H+]2CCCC23CCNCC3)s1 ZINC001235143916 1130714868 /nfs/dbraw/zinc/71/48/68/1130714868.db2.gz GNSRIWGIPOMUQP-UHFFFAOYSA-N 1 3 286.444 3.619 20 0 CHADHO c1cc2c(cccc2CN2CCCCC23CC[NH2+]CC3)o1 ZINC001235191224 1130720897 /nfs/dbraw/zinc/72/08/97/1130720897.db2.gz ONAFEVVRYXMPDW-UHFFFAOYSA-N 1 3 284.403 3.541 20 0 CHADHO c1cc2c(cccc2C[N@@H+]2CCCCC23CCNCC3)o1 ZINC001235191224 1130720898 /nfs/dbraw/zinc/72/08/98/1130720898.db2.gz ONAFEVVRYXMPDW-UHFFFAOYSA-N 1 3 284.403 3.541 20 0 CHADHO c1cc2c(cccc2C[N@H+]2CCCCC23CCNCC3)o1 ZINC001235191224 1130720904 /nfs/dbraw/zinc/72/09/04/1130720904.db2.gz ONAFEVVRYXMPDW-UHFFFAOYSA-N 1 3 284.403 3.541 20 0 CHADHO CC(C)c1ccc(C[N@@H+]2CCCCC23CCNCC3)cc1 ZINC001235191758 1130723196 /nfs/dbraw/zinc/72/31/96/1130723196.db2.gz YJINOLCZVKOGSA-UHFFFAOYSA-N 1 3 286.463 3.918 20 0 CHADHO CC(C)c1ccc(C[N@H+]2CCCCC23CCNCC3)cc1 ZINC001235191758 1130723199 /nfs/dbraw/zinc/72/31/99/1130723199.db2.gz YJINOLCZVKOGSA-UHFFFAOYSA-N 1 3 286.463 3.918 20 0 CHADHO CC(C)c1ccc(CN2CCCCC23CC[NH2+]CC3)cc1 ZINC001235191758 1130723205 /nfs/dbraw/zinc/72/32/05/1130723205.db2.gz YJINOLCZVKOGSA-UHFFFAOYSA-N 1 3 286.463 3.918 20 0 CHADHO CC/C=C\CCCCC[N@@H+]1CC[C@@]2(C1)CNCC[C@H]2F ZINC001235402319 1130738749 /nfs/dbraw/zinc/73/87/49/1130738749.db2.gz IWNDTQHDWOOAOA-DSLCMKTCSA-N 1 3 282.447 3.537 20 0 CHADHO CC/C=C\CCCCC[N@H+]1CC[C@@]2(C1)CNCC[C@H]2F ZINC001235402319 1130738753 /nfs/dbraw/zinc/73/87/53/1130738753.db2.gz IWNDTQHDWOOAOA-DSLCMKTCSA-N 1 3 282.447 3.537 20 0 CHADHO CC/C=C\CCCCC[N@@H+]1CC[C@]2(C1)CNCC[C@H]2F ZINC001235402322 1130739327 /nfs/dbraw/zinc/73/93/27/1130739327.db2.gz IWNDTQHDWOOAOA-NMBNSIPYSA-N 1 3 282.447 3.537 20 0 CHADHO CC/C=C\CCCCC[N@H+]1CC[C@]2(C1)CNCC[C@H]2F ZINC001235402322 1130739332 /nfs/dbraw/zinc/73/93/32/1130739332.db2.gz IWNDTQHDWOOAOA-NMBNSIPYSA-N 1 3 282.447 3.537 20 0 CHADHO c1ccc(CCN(CCC[NH+]2CCCCC2)C2CC2)cc1 ZINC000781883054 1130744251 /nfs/dbraw/zinc/74/42/51/1130744251.db2.gz KVCFUYBSHWKYTI-UHFFFAOYSA-N 1 3 286.463 3.570 20 0 CHADHO CC[C@H](N)C[NH+]1CCC(CCc2ccc(Cl)cc2)CC1 ZINC001235694995 1130769661 /nfs/dbraw/zinc/76/96/61/1130769661.db2.gz MPRKDDRCGWYJOD-KRWDZBQOSA-N 1 3 294.870 3.722 20 0 CHADHO CN(Cc1cccc2c3ccccc3oc21)C[C@@H]1CC[NH2+]C1 ZINC001235841437 1130787540 /nfs/dbraw/zinc/78/75/40/1130787540.db2.gz FUNFWGRGEZDREZ-CQSZACIVSA-N 1 3 294.398 3.627 20 0 CHADHO [NH3+]CC[C@@H]1CCCN1Cc1cccc(Oc2ccccc2)c1 ZINC001235925587 1130806363 /nfs/dbraw/zinc/80/63/63/1130806363.db2.gz WJJXBPZUDJBRFJ-KRWDZBQOSA-N 1 3 296.414 3.792 20 0 CHADHO Cc1ccc(CN(C)C[C@@H]2CCC[NH2+]C2)c2ccccc12 ZINC001235952476 1130814659 /nfs/dbraw/zinc/81/46/59/1130814659.db2.gz XVVUOXAGHXEFFN-MRXNPFEDSA-N 1 3 282.431 3.580 20 0 CHADHO CC(C)c1ccccc1C[NH2+]C1CCN(CC2CC2)CC1 ZINC000783316579 1130816024 /nfs/dbraw/zinc/81/60/24/1130816024.db2.gz PGHJCFMTOWJWAD-UHFFFAOYSA-N 1 3 286.463 3.774 20 0 CHADHO Cc1c(C[N@@H+]2C[C@H](C)C[C@H](N)C2)cccc1-c1ccccc1 ZINC001236052432 1130840747 /nfs/dbraw/zinc/84/07/47/1130840747.db2.gz QVVREKPCLJIMHY-BEFAXECRSA-N 1 3 294.442 3.831 20 0 CHADHO Cc1c(C[N@H+]2C[C@H](C)C[C@H](N)C2)cccc1-c1ccccc1 ZINC001236052432 1130840753 /nfs/dbraw/zinc/84/07/53/1130840753.db2.gz QVVREKPCLJIMHY-BEFAXECRSA-N 1 3 294.442 3.831 20 0 CHADHO Cc1c(C[N@@H+]2C[C@@H](C)C[C@H](N)C2)cccc1-c1ccccc1 ZINC001236052437 1130841034 /nfs/dbraw/zinc/84/10/34/1130841034.db2.gz QVVREKPCLJIMHY-KXBFYZLASA-N 1 3 294.442 3.831 20 0 CHADHO Cc1c(C[N@H+]2C[C@@H](C)C[C@H](N)C2)cccc1-c1ccccc1 ZINC001236052437 1130841041 /nfs/dbraw/zinc/84/10/41/1130841041.db2.gz QVVREKPCLJIMHY-KXBFYZLASA-N 1 3 294.442 3.831 20 0 CHADHO CCC[N@H+](Cc1ccc2cc(O)ccc2c1)C1CCNCC1 ZINC001236181816 1130879367 /nfs/dbraw/zinc/87/93/67/1130879367.db2.gz GVQDKQDQRBXOBQ-UHFFFAOYSA-N 1 3 298.430 3.509 20 0 CHADHO CCC[N@@H+](Cc1ccc2cc(O)ccc2c1)C1CCNCC1 ZINC001236181816 1130879371 /nfs/dbraw/zinc/87/93/71/1130879371.db2.gz GVQDKQDQRBXOBQ-UHFFFAOYSA-N 1 3 298.430 3.509 20 0 CHADHO CC[C@H](N)C[N@H+](C)[C@H](C)c1cccc2ccccc21 ZINC001236189355 1130881043 /nfs/dbraw/zinc/88/10/43/1130881043.db2.gz LRJLSBCUDYAWJQ-HIFRSBDPSA-N 1 3 256.393 3.570 20 0 CHADHO CC[C@H](N)C[N@@H+](C)[C@H](C)c1cccc2ccccc21 ZINC001236189355 1130881050 /nfs/dbraw/zinc/88/10/50/1130881050.db2.gz LRJLSBCUDYAWJQ-HIFRSBDPSA-N 1 3 256.393 3.570 20 0 CHADHO C[N@H+](Cc1cccc2[nH]cc(Cl)c21)[C@H]1CCCC[C@H]1N ZINC001236215741 1130889347 /nfs/dbraw/zinc/88/93/47/1130889347.db2.gz XRNVXUSRSKHQMI-HIFRSBDPSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@@H+](Cc1cccc2[nH]cc(Cl)c21)[C@H]1CCCC[C@H]1N ZINC001236215741 1130889357 /nfs/dbraw/zinc/88/93/57/1130889357.db2.gz XRNVXUSRSKHQMI-HIFRSBDPSA-N 1 3 291.826 3.523 20 0 CHADHO CN(Cc1ccc(Cl)cc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236225055 1130896700 /nfs/dbraw/zinc/89/67/00/1130896700.db2.gz ZLAKIVUQAXJTHM-JOCQHMNTSA-N 1 3 287.234 3.695 20 0 CHADHO CN(Cc1cccc(C(C)(C)C)c1)C1(C)CC[NH2+]CC1 ZINC001236225707 1130897977 /nfs/dbraw/zinc/89/79/77/1130897977.db2.gz CTGBGKIFVAXNFU-UHFFFAOYSA-N 1 3 274.452 3.558 20 0 CHADHO C[N@H+](Cc1cccc(C(C)(C)C)c1)C1(C)CCNCC1 ZINC001236225707 1130897984 /nfs/dbraw/zinc/89/79/84/1130897984.db2.gz CTGBGKIFVAXNFU-UHFFFAOYSA-N 1 3 274.452 3.558 20 0 CHADHO C[N@@H+](Cc1cccc(C(C)(C)C)c1)C1(C)CCNCC1 ZINC001236225707 1130897990 /nfs/dbraw/zinc/89/79/90/1130897990.db2.gz CTGBGKIFVAXNFU-UHFFFAOYSA-N 1 3 274.452 3.558 20 0 CHADHO Cc1ccc(C[N@H+](C[C@@H]2CCCNC2)C2CCCC2)cc1 ZINC001236375524 1130923378 /nfs/dbraw/zinc/92/33/78/1130923378.db2.gz ZTHVMYMYHIRRIJ-GOSISDBHSA-N 1 3 286.463 3.739 20 0 CHADHO Cc1ccc(C[N@@H+](C[C@@H]2CCCNC2)C2CCCC2)cc1 ZINC001236375524 1130923380 /nfs/dbraw/zinc/92/33/80/1130923380.db2.gz ZTHVMYMYHIRRIJ-GOSISDBHSA-N 1 3 286.463 3.739 20 0 CHADHO CC(C)C[NH2+]Cc1ccc(-c2cccc(CN(C)C)n2)cc1 ZINC001236429366 1130939840 /nfs/dbraw/zinc/93/98/40/1130939840.db2.gz LAASENSIEVIHMV-UHFFFAOYSA-N 1 3 297.446 3.556 20 0 CHADHO c1cc(CN(C[C@@H]2CCC[NH2+]C2)C2CC2)c2cccccc1-2 ZINC001236601971 1130982454 /nfs/dbraw/zinc/98/24/54/1130982454.db2.gz RGFKEJOWILDANZ-MRXNPFEDSA-N 1 3 294.442 3.755 20 0 CHADHO C[C@]1(C[NH3+])CCN(Cc2ccc(-c3cccs3)cc2)C1 ZINC001236605917 1130983468 /nfs/dbraw/zinc/98/34/68/1130983468.db2.gz WXRDEAUFRLIKCL-QGZVFWFLSA-N 1 3 286.444 3.586 20 0 CHADHO CCCN(Cc1cc(C)cc(SC)c1)C[C@@H]1CC[NH2+]C1 ZINC001236843957 1131021197 /nfs/dbraw/zinc/02/11/97/1131021197.db2.gz NQEFRNJDANUPBE-OAHLLOKOSA-N 1 3 292.492 3.538 20 0 CHADHO CCCN(Cc1ccc(F)c(C2CC2)c1)C[C@H]1CC[NH2+]C1 ZINC001236843537 1131021541 /nfs/dbraw/zinc/02/15/41/1131021541.db2.gz JSGNCSLJVSACJF-HNNXBMFYSA-N 1 3 290.426 3.525 20 0 CHADHO CC[C@H](N)C[N@H+](C)Cc1ccccc1-c1ccc(F)cc1 ZINC001236869896 1131027534 /nfs/dbraw/zinc/02/75/34/1131027534.db2.gz MXVWWQZFJPHNDL-KRWDZBQOSA-N 1 3 286.394 3.662 20 0 CHADHO CC[C@H](N)C[N@@H+](C)Cc1ccccc1-c1ccc(F)cc1 ZINC001236869896 1131027536 /nfs/dbraw/zinc/02/75/36/1131027536.db2.gz MXVWWQZFJPHNDL-KRWDZBQOSA-N 1 3 286.394 3.662 20 0 CHADHO CC[C@H](N)C[N@H+](C)Cc1ccccc1-c1ccccc1C ZINC001236871146 1131028144 /nfs/dbraw/zinc/02/81/44/1131028144.db2.gz XWBCMZPBAKHGPQ-KRWDZBQOSA-N 1 3 282.431 3.831 20 0 CHADHO CC[C@H](N)C[N@@H+](C)Cc1ccccc1-c1ccccc1C ZINC001236871146 1131028150 /nfs/dbraw/zinc/02/81/50/1131028150.db2.gz XWBCMZPBAKHGPQ-KRWDZBQOSA-N 1 3 282.431 3.831 20 0 CHADHO Cc1ccc(CN2CC[C@H]3[NH2+]CCC[C@@H]3C2)c2ccccc12 ZINC001237389110 1131093649 /nfs/dbraw/zinc/09/36/49/1131093649.db2.gz FSMDPPCAMJERQM-YLJYHZDGSA-N 1 3 294.442 3.722 20 0 CHADHO Cc1ccc2ccccc2c1CN1CC[C@@H]2[NH2+]CCC[C@H]2C1 ZINC001237408184 1131098015 /nfs/dbraw/zinc/09/80/15/1131098015.db2.gz ZAFWLDFHUKQROJ-PXNSSMCTSA-N 1 3 294.442 3.722 20 0 CHADHO CCN1CCC[C@H](C[NH2+][C@@H]2CC(C)(C)Cc3occc32)C1 ZINC001116293566 1131140255 /nfs/dbraw/zinc/14/02/55/1131140255.db2.gz SGOLPDYPYRLKCA-GDBMZVCRSA-N 1 3 290.451 3.615 20 0 CHADHO CCN1CCC[C@H](C[NH2+][C@H]2CC(C)(C)Cc3occc32)C1 ZINC001116293569 1131139983 /nfs/dbraw/zinc/13/99/83/1131139983.db2.gz SGOLPDYPYRLKCA-ZBFHGGJFSA-N 1 3 290.451 3.615 20 0 CHADHO C[C@]1(CCN[C@@H]2C[C@@H]([NH3+])c3ccccc32)CC1(Cl)Cl ZINC000817935823 1131188153 /nfs/dbraw/zinc/18/81/53/1131188153.db2.gz FAIBXGITOSXONM-MCIONIFRSA-N 1 3 299.245 3.695 20 0 CHADHO C[C@H](CSC(C)(C)C)NCC1([NH3+])CCCCCC1 ZINC000817944029 1131189028 /nfs/dbraw/zinc/18/90/28/1131189028.db2.gz WODHDSVXIIOEOP-CYBMUJFWSA-N 1 3 272.502 3.548 20 0 CHADHO C[C@@H](NCc1ccc(CC[NH3+])cc1)c1csc(Cl)c1 ZINC000817949397 1131189182 /nfs/dbraw/zinc/18/91/82/1131189182.db2.gz QDDGZOCSHMQWNQ-LLVKDONJSA-N 1 3 294.851 3.754 20 0 CHADHO CCOc1cccc([C@@H](C)NCc2ccc3c(c2)C[NH2+]C3)c1 ZINC000817969011 1131194091 /nfs/dbraw/zinc/19/40/91/1131194091.db2.gz PHMFNHMSESGBCZ-CQSZACIVSA-N 1 3 296.414 3.539 20 0 CHADHO CC[C@@H](NCC[C@H](C)[NH2+]C)c1cccc2ccccc21 ZINC001118122009 1131211174 /nfs/dbraw/zinc/21/11/74/1131211174.db2.gz MSIXNNQEYLZDOZ-KBXCAEBGSA-N 1 3 270.420 3.879 20 0 CHADHO CCCC[C@@H]1C[C@H]([NH2+]C2CCC(C)(C)CC2)CCN1 ZINC001246308138 1131457979 /nfs/dbraw/zinc/45/79/79/1131457979.db2.gz JCBPLUBQTZWWTD-HZPDHXFCSA-N 1 3 266.473 3.856 20 0 CHADHO CCCCCC[C@@H](CCC)[NH2+][C@H](C(C)C)C1CNC1 ZINC001246512629 1131538860 /nfs/dbraw/zinc/53/88/60/1131538860.db2.gz BBVBKBWAAYGWTA-IAGOWNOFSA-N 1 3 268.489 3.959 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@H](C)c1ccc(F)cc1C ZINC000844922700 1131608504 /nfs/dbraw/zinc/60/85/04/1131608504.db2.gz CRKIYWNIUMIXCG-CQSZACIVSA-N 1 3 286.394 3.704 20 0 CHADHO CCCC[C@@H](CCC)N1CCC[C@@]2(CCCC[NH2+]2)C1 ZINC001246614201 1131718806 /nfs/dbraw/zinc/71/88/06/1131718806.db2.gz MTPRYGRWUWOGBW-SJORKVTESA-N 1 3 266.473 3.953 20 0 CHADHO CCCC[C@@H](CCC)[N@@H+]1CCC[C@@]2(CCCCN2)C1 ZINC001246614201 1131718810 /nfs/dbraw/zinc/71/88/10/1131718810.db2.gz MTPRYGRWUWOGBW-SJORKVTESA-N 1 3 266.473 3.953 20 0 CHADHO CCCC[C@@H](CCC)[N@H+]1CCC[C@@]2(CCCCN2)C1 ZINC001246614201 1131718813 /nfs/dbraw/zinc/71/88/13/1131718813.db2.gz MTPRYGRWUWOGBW-SJORKVTESA-N 1 3 266.473 3.953 20 0 CHADHO C[N@H+](CCCN)C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246682840 1131780595 /nfs/dbraw/zinc/78/05/95/1131780595.db2.gz XBHXYYBVNVRSMG-UHFFFAOYSA-N 1 3 280.843 3.647 20 0 CHADHO C[N@@H+](CCCN)C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246682840 1131780601 /nfs/dbraw/zinc/78/06/01/1131780601.db2.gz XBHXYYBVNVRSMG-UHFFFAOYSA-N 1 3 280.843 3.647 20 0 CHADHO CCCCC[C@H](CCC)[N@@H+]1CC[C@]2(C1)CNCC[C@@H]2F ZINC001246693717 1131781932 /nfs/dbraw/zinc/78/19/32/1131781932.db2.gz QGRVIHYNLIELSU-YESZJQIVSA-N 1 3 284.463 3.759 20 0 CHADHO CCCCC[C@H](CCC)[N@H+]1CC[C@]2(C1)CNCC[C@@H]2F ZINC001246693717 1131781940 /nfs/dbraw/zinc/78/19/40/1131781940.db2.gz QGRVIHYNLIELSU-YESZJQIVSA-N 1 3 284.463 3.759 20 0 CHADHO CCCCC(CCCC)[N@@H+]1C[C@@H](CF)[C@H](C2(N)CC2)C1 ZINC001246698416 1131782577 /nfs/dbraw/zinc/78/25/77/1131782577.db2.gz XWNICBXKUHTFET-GDBMZVCRSA-N 1 3 284.463 3.744 20 0 CHADHO CCCCC(CCCC)[N@H+]1C[C@@H](CF)[C@H](C2(N)CC2)C1 ZINC001246698416 1131782581 /nfs/dbraw/zinc/78/25/81/1131782581.db2.gz XWNICBXKUHTFET-GDBMZVCRSA-N 1 3 284.463 3.744 20 0 CHADHO CC(C)(C)[C@H]1C[C@H]([NH+]2CCCCCCCC2)CCN1 ZINC001246920301 1131816804 /nfs/dbraw/zinc/81/68/04/1131816804.db2.gz MEKIOXYNERZKIJ-HZPDHXFCSA-N 1 3 266.473 3.809 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@H+](C)[C@H]2CC[C@H](C)CC2)CCN1 ZINC001246995025 1131839033 /nfs/dbraw/zinc/83/90/33/1131839033.db2.gz FELLKIDXSUHQBZ-QBPKDAKJSA-N 1 3 266.473 3.808 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@@H+](C)[C@H]2CC[C@H](C)CC2)CCN1 ZINC001246995025 1131839038 /nfs/dbraw/zinc/83/90/38/1131839038.db2.gz FELLKIDXSUHQBZ-QBPKDAKJSA-N 1 3 266.473 3.808 20 0 CHADHO CC[C@H]([NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)C1CC1 ZINC000716727472 1132030126 /nfs/dbraw/zinc/03/01/26/1132030126.db2.gz LGTSGQBTJDKTNI-LEAZDLGRSA-N 1 3 298.474 3.818 20 0 CHADHO C[NH+]1C(C)(C)CC(N[C@@H]2C[C@H]2c2ccccc2)CC1(C)C ZINC001171622931 1132067392 /nfs/dbraw/zinc/06/73/92/1132067392.db2.gz DBNJSORHMCQKGG-DLBZAZTESA-N 1 3 286.463 3.784 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@@H]2C[C@H]2c2ccccc2)CC1(C)C ZINC001171622931 1132067396 /nfs/dbraw/zinc/06/73/96/1132067396.db2.gz DBNJSORHMCQKGG-DLBZAZTESA-N 1 3 286.463 3.784 20 0 CHADHO C[C@@H]([NH2+]C1CC(C)(C)N(C)C(C)(C)C1)C1CCCC1 ZINC001171622936 1132068029 /nfs/dbraw/zinc/06/80/29/1132068029.db2.gz DGYZUKWBWMRLJU-CYBMUJFWSA-N 1 3 266.473 3.806 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccc(F)c(Cl)c1)C2 ZINC001172100516 1132125011 /nfs/dbraw/zinc/12/50/11/1132125011.db2.gz DDWVXPCWORFFSQ-ZSOGYDGISA-N 1 3 296.817 3.584 20 0 CHADHO Cc1cccc([C@@H](C)N[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC001172100222 1132126127 /nfs/dbraw/zinc/12/61/27/1132126127.db2.gz BIYNADVETDPSBW-NRSFXHEJSA-N 1 3 272.436 3.661 20 0 CHADHO Cc1cccc([C@@H](C)N[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC001172100222 1132126130 /nfs/dbraw/zinc/12/61/30/1132126130.db2.gz BIYNADVETDPSBW-NRSFXHEJSA-N 1 3 272.436 3.661 20 0 CHADHO C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](NCc1ccccc1C1CC1)C2 ZINC001172102611 1132128408 /nfs/dbraw/zinc/12/84/08/1132128408.db2.gz NKEZSZVVCALOTA-NNZMDNLPSA-N 1 3 284.447 3.669 20 0 CHADHO C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H](NCc1ccccc1C1CC1)C2 ZINC001172102611 1132128411 /nfs/dbraw/zinc/12/84/11/1132128411.db2.gz NKEZSZVVCALOTA-NNZMDNLPSA-N 1 3 284.447 3.669 20 0 CHADHO CC[C@H](CC(C)C)[NH+]1CCC(N)(Cc2ccccc2)CC1 ZINC001172399182 1132222304 /nfs/dbraw/zinc/22/23/04/1132222304.db2.gz JRNINPYJGOQMAU-GOSISDBHSA-N 1 3 288.479 3.847 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+][C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172537832 1132276476 /nfs/dbraw/zinc/27/64/76/1132276476.db2.gz VSPIHPDYLOYEOA-GUDVDZBRSA-N 1 3 286.463 3.787 20 0 CHADHO CC(C)[N@H+](CCCN)C1CCC(Cc2ccccc2)CC1 ZINC001172818452 1132317186 /nfs/dbraw/zinc/31/71/86/1132317186.db2.gz MISCRSPOFOZMOL-UHFFFAOYSA-N 1 3 288.479 3.847 20 0 CHADHO CC(C)[N@@H+](CCCN)C1CCC(Cc2ccccc2)CC1 ZINC001172818452 1132317190 /nfs/dbraw/zinc/31/71/90/1132317190.db2.gz MISCRSPOFOZMOL-UHFFFAOYSA-N 1 3 288.479 3.847 20 0 CHADHO Fc1ccc([C@@H]2CC[N@H+](Cc3cc4cnccc4[nH]3)C2)cc1 ZINC001232016564 1132411318 /nfs/dbraw/zinc/41/13/18/1132411318.db2.gz ZMBAEMRZGIDLAV-CQSZACIVSA-N 1 3 295.361 3.692 20 0 CHADHO Fc1ccc([C@@H]2CC[N@@H+](Cc3cc4cnccc4[nH]3)C2)cc1 ZINC001232016564 1132411321 /nfs/dbraw/zinc/41/13/21/1132411321.db2.gz ZMBAEMRZGIDLAV-CQSZACIVSA-N 1 3 295.361 3.692 20 0 CHADHO C[C@@H](CC(c1ccccc1)c1ccccc1)[NH2+]C1CC(N)C1 ZINC001173209982 1132416655 /nfs/dbraw/zinc/41/66/55/1132416655.db2.gz IFECRCCYPFYSNL-MNNVXMFVSA-N 1 3 294.442 3.676 20 0 CHADHO C[C@@H](CC(c1ccccc1)c1ccccc1)NC1CC([NH3+])C1 ZINC001173209982 1132416659 /nfs/dbraw/zinc/41/66/59/1132416659.db2.gz IFECRCCYPFYSNL-MNNVXMFVSA-N 1 3 294.442 3.676 20 0 CHADHO CN(C)Cc1cc(F)cc(C[NH+]2CCC(C)(C)CC2)c1 ZINC001232147297 1132427344 /nfs/dbraw/zinc/42/73/44/1132427344.db2.gz NNXKBXJJKVPQHA-UHFFFAOYSA-N 1 3 278.415 3.509 20 0 CHADHO CCC1CC[NH+](Cc2cc(F)cc(CN(C)C)c2)CC1 ZINC001232145209 1132427646 /nfs/dbraw/zinc/42/76/46/1132427646.db2.gz YGCYZPGGSWYYSB-UHFFFAOYSA-N 1 3 278.415 3.509 20 0 CHADHO CCC(CC)[N@H+](C)Cc1cc(F)cc(CN(C)C)c1 ZINC001232146390 1132428679 /nfs/dbraw/zinc/42/86/79/1132428679.db2.gz PCJGEZXRVPNRJF-UHFFFAOYSA-N 1 3 266.404 3.508 20 0 CHADHO CCC(CC)[N@@H+](C)Cc1cc(F)cc(CN(C)C)c1 ZINC001232146390 1132428681 /nfs/dbraw/zinc/42/86/81/1132428681.db2.gz PCJGEZXRVPNRJF-UHFFFAOYSA-N 1 3 266.404 3.508 20 0 CHADHO CC[C@@H]1CC[C@H]([NH2+]C2CCN(C[C@H]3CC=CCC3)CC2)C1 ZINC001173275159 1132438785 /nfs/dbraw/zinc/43/87/85/1132438785.db2.gz LMQAUAPBHWUGLH-AOIWGVFYSA-N 1 3 290.495 3.975 20 0 CHADHO Cc1c(C)c(C)c(C[N@@H+]2CCCC[C@@H](CN)C2)c(C)c1C ZINC001206632061 1132544927 /nfs/dbraw/zinc/54/49/27/1132544927.db2.gz FLXBGECAFNLAJP-SFHVURJKSA-N 1 3 288.479 3.790 20 0 CHADHO Cc1c(C)c(C)c(C[N@H+]2CCCC[C@@H](CN)C2)c(C)c1C ZINC001206632061 1132544934 /nfs/dbraw/zinc/54/49/34/1132544934.db2.gz FLXBGECAFNLAJP-SFHVURJKSA-N 1 3 288.479 3.790 20 0 CHADHO Cc1ccsc1C[N@@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001204020879 1133398687 /nfs/dbraw/zinc/39/86/87/1133398687.db2.gz LRSRQTBMDHEFLK-INIZCTEOSA-N 1 3 292.492 3.897 20 0 CHADHO Cc1ccsc1C[N@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001204020879 1133398691 /nfs/dbraw/zinc/39/86/91/1133398691.db2.gz LRSRQTBMDHEFLK-INIZCTEOSA-N 1 3 292.492 3.897 20 0 CHADHO [NH3+][C@H]1CCCN(Cc2ccc(-c3ccc(F)cc3)cc2)CC1 ZINC001205102619 1133529734 /nfs/dbraw/zinc/52/97/34/1133529734.db2.gz URTRJSUCYMNABP-IBGZPJMESA-N 1 3 298.405 3.806 20 0 CHADHO [NH3+][C@H]1CCCN(Cc2ccc3c(c2)Cc2ccccc2-3)CC1 ZINC001205110713 1133530724 /nfs/dbraw/zinc/53/07/24/1133530724.db2.gz YZCPNBJIQOLLQH-SFHVURJKSA-N 1 3 292.426 3.571 20 0 CHADHO C[C@H]1c2ccccc2CCN1Cc1cc2c(s1)CC[NH2+]C2 ZINC001205164629 1133539723 /nfs/dbraw/zinc/53/97/23/1133539723.db2.gz JSACXPUJCZEJDD-ZDUSSCGKSA-N 1 3 298.455 3.513 20 0 CHADHO CCCCOc1ccc(CN2CCC[C@](C)([NH3+])CC2)cc1 ZINC001205266429 1133552391 /nfs/dbraw/zinc/55/23/91/1133552391.db2.gz ULDSVAKNTDBWIB-SFHVURJKSA-N 1 3 290.451 3.569 20 0 CHADHO CCSc1ccccc1CN1CCC[C@@](C)([NH3+])CC1 ZINC001205296407 1133555445 /nfs/dbraw/zinc/55/54/45/1133555445.db2.gz OMDSFMVWAASEEZ-MRXNPFEDSA-N 1 3 278.465 3.502 20 0 CHADHO CCC(C)(C)c1ccc(CN2CC[C@H](C)[C@H](C[NH3+])C2)cc1 ZINC001205305516 1133558017 /nfs/dbraw/zinc/55/80/17/1133558017.db2.gz SBEDSRHZOUYPBR-DOTOQJQBSA-N 1 3 288.479 3.791 20 0 CHADHO Cc1ccc(-c2ccc(C[N@H+]3CCNCC[C@H]3C)cc2)cc1 ZINC001205332365 1133563750 /nfs/dbraw/zinc/56/37/50/1133563750.db2.gz PSAZFIAAMVSUAX-QGZVFWFLSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1ccc(-c2ccc(C[N@@H+]3CCNCC[C@H]3C)cc2)cc1 ZINC001205332365 1133563753 /nfs/dbraw/zinc/56/37/53/1133563753.db2.gz PSAZFIAAMVSUAX-QGZVFWFLSA-N 1 3 294.442 3.846 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]CCCN2CCCC[C@@H]2C)C[C@@H]1C ZINC000084981665 1133582357 /nfs/dbraw/zinc/58/23/57/1133582357.db2.gz KEOASSPXFQHIME-QZWWFDLISA-N 1 3 266.473 3.665 20 0 CHADHO Cc1ccc(Cl)c(CN2CCC[C@@H](C[NH3+])[C@H](C)C2)c1F ZINC001205996564 1133639474 /nfs/dbraw/zinc/63/94/74/1133639474.db2.gz XHMVOSPLNGEWBR-OLZOCXBDSA-N 1 3 298.833 3.594 20 0 CHADHO CCC(C)(C)c1ccc(CN2CC[C@@H]([NH3+])[C@@H](F)CC2)cc1 ZINC001206188833 1133669184 /nfs/dbraw/zinc/66/91/84/1133669184.db2.gz VZVAGOMCYCUIMZ-DLBZAZTESA-N 1 3 292.442 3.635 20 0 CHADHO CCC(C)(C)c1ccc(CN2CC[C@H]([NH3+])[C@@H](F)CC2)cc1 ZINC001206188840 1133669265 /nfs/dbraw/zinc/66/92/65/1133669265.db2.gz VZVAGOMCYCUIMZ-IRXDYDNUSA-N 1 3 292.442 3.635 20 0 CHADHO CC(C)[N@H+](CCCC1CCCC1)[C@@H]1CCCNCC1 ZINC001206583779 1133722462 /nfs/dbraw/zinc/72/24/62/1133722462.db2.gz WKIGSISZVWRQBB-QGZVFWFLSA-N 1 3 266.473 3.809 20 0 CHADHO CC(C)[N@@H+](CCCC1CCCC1)[C@@H]1CCCNCC1 ZINC001206583779 1133722468 /nfs/dbraw/zinc/72/24/68/1133722468.db2.gz WKIGSISZVWRQBB-QGZVFWFLSA-N 1 3 266.473 3.809 20 0 CHADHO Cc1cc(CN(C(C)C)[C@H]2CCC[NH2+]CC2)c(C)s1 ZINC001206588545 1133722848 /nfs/dbraw/zinc/72/28/48/1133722848.db2.gz AZULUKVBPODXMH-INIZCTEOSA-N 1 3 280.481 3.717 20 0 CHADHO C[C@H](CC[NH2+][C@H]1CCC[C@H]1c1ccc(Cl)cc1)N(C)C ZINC001206827734 1133752496 /nfs/dbraw/zinc/75/24/96/1133752496.db2.gz RFEREIJOZDQEIE-COXVUDFISA-N 1 3 294.870 3.906 20 0 CHADHO CN(CCCc1cccc(Cl)c1)CCC[NH+]1CCCC1 ZINC001207590030 1133824014 /nfs/dbraw/zinc/82/40/14/1133824014.db2.gz ZGDQYHRYYIQXKI-UHFFFAOYSA-N 1 3 294.870 3.690 20 0 CHADHO C1=C[C@@H]2C[C@H]1C[C@H]2C[N@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001207627229 1133832088 /nfs/dbraw/zinc/83/20/88/1133832088.db2.gz UNYOHMFZXPXQFZ-RDGPPVDQSA-N 1 3 288.479 3.539 20 0 CHADHO C1=C[C@@H]2C[C@H]1C[C@H]2C[N@@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001207627229 1133832096 /nfs/dbraw/zinc/83/20/96/1133832096.db2.gz UNYOHMFZXPXQFZ-RDGPPVDQSA-N 1 3 288.479 3.539 20 0 CHADHO CS[C@H](C)CCN(C)C1CC[NH+](C2CCCCC2)CC1 ZINC001208151737 1133887210 /nfs/dbraw/zinc/88/72/10/1133887210.db2.gz XXYDJLWVJDWVOO-OAHLLOKOSA-N 1 3 298.540 3.857 20 0 CHADHO CS[C@H](C)CC[N@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001208151737 1133887215 /nfs/dbraw/zinc/88/72/15/1133887215.db2.gz XXYDJLWVJDWVOO-OAHLLOKOSA-N 1 3 298.540 3.857 20 0 CHADHO CS[C@H](C)CC[N@@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001208151737 1133887218 /nfs/dbraw/zinc/88/72/18/1133887218.db2.gz XXYDJLWVJDWVOO-OAHLLOKOSA-N 1 3 298.540 3.857 20 0 CHADHO CCN(Cc1ccccc1)C1CC[NH+](CCC2CC2)CC1 ZINC001208684174 1133927199 /nfs/dbraw/zinc/92/71/99/1133927199.db2.gz SFWQIBUIIBFDTQ-UHFFFAOYSA-N 1 3 286.463 3.773 20 0 CHADHO CC/C=C\CCCCCCN1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001209289119 1134003914 /nfs/dbraw/zinc/00/39/14/1134003914.db2.gz YYZOUFPTEJYXLT-OSFIAYCASA-N 1 3 278.484 3.787 20 0 CHADHO C[N@H+](CCCN1CCCCC1)CCc1ccccc1Cl ZINC001209450817 1134023671 /nfs/dbraw/zinc/02/36/71/1134023671.db2.gz MEUAWJIOAGSGSP-UHFFFAOYSA-N 1 3 294.870 3.690 20 0 CHADHO C[N@@H+](CCCN1CCCCC1)CCc1ccccc1Cl ZINC001209450817 1134023678 /nfs/dbraw/zinc/02/36/78/1134023678.db2.gz MEUAWJIOAGSGSP-UHFFFAOYSA-N 1 3 294.870 3.690 20 0 CHADHO CN(C)Cc1ccccc1NC1=CC[C@H]([NH+]2CCCC2)CC1 ZINC001210711992 1134278906 /nfs/dbraw/zinc/27/89/06/1134278906.db2.gz NMAMJPWKOIHBAC-SFHVURJKSA-N 1 3 299.462 3.692 20 0 CHADHO C[C@H](CC[N@@H+]1CCC[C@]12CCCNC2)CC(C)(C)C ZINC001222232324 1135211327 /nfs/dbraw/zinc/21/13/27/1135211327.db2.gz UXMSJFJFCIHRBD-WBVHZDCISA-N 1 3 266.473 3.667 20 0 CHADHO C[C@H](CC[N@H+]1CCC[C@]12CCCNC2)CC(C)(C)C ZINC001222232324 1135211331 /nfs/dbraw/zinc/21/13/31/1135211331.db2.gz UXMSJFJFCIHRBD-WBVHZDCISA-N 1 3 266.473 3.667 20 0 CHADHO CSc1ccc(CN2CCC[C@@]23CCC[NH2+]CC3)cc1 ZINC001222307728 1135222206 /nfs/dbraw/zinc/22/22/06/1135222206.db2.gz ARXYWOIOSGKNED-QGZVFWFLSA-N 1 3 290.476 3.517 20 0 CHADHO C[C@@H](C[N@@H+]1CC[C@H]2CNCC[C@H]21)c1cccc2ccccc21 ZINC001222616190 1135256651 /nfs/dbraw/zinc/25/66/51/1135256651.db2.gz ZCXRELJYXOTHKF-RIFZZMRRSA-N 1 3 294.442 3.627 20 0 CHADHO C[C@@H](C[N@H+]1CC[C@H]2CNCC[C@H]21)c1cccc2ccccc21 ZINC001222616190 1135256654 /nfs/dbraw/zinc/25/66/54/1135256654.db2.gz ZCXRELJYXOTHKF-RIFZZMRRSA-N 1 3 294.442 3.627 20 0 CHADHO CC[C@H](N[C@H]1CCC[C@@H]([NH+](C)C)C1)c1cccc(C)c1 ZINC000353525785 529670336 /nfs/dbraw/zinc/67/03/36/529670336.db2.gz ZEWIBWPEGSGPNQ-KSZLIROESA-N 1 3 274.452 3.909 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1cccc(C)c1 ZINC000353525785 529670338 /nfs/dbraw/zinc/67/03/38/529670338.db2.gz ZEWIBWPEGSGPNQ-KSZLIROESA-N 1 3 274.452 3.909 20 0 CHADHO C[C@H]([NH2+]CC1(CN(C)C)CCCC1)c1ccc(Cl)nc1 ZINC000183953982 262001674 /nfs/dbraw/zinc/00/16/74/262001674.db2.gz UJSANUYLHDADLO-ZDUSSCGKSA-N 1 3 295.858 3.508 20 0 CHADHO C[NH+](C)Cc1ccc(CN[C@H]2CCc3ccccc32)cc1 ZINC000171127955 335055960 /nfs/dbraw/zinc/05/59/60/335055960.db2.gz WBOMSIHOJOKEAL-IBGZPJMESA-N 1 3 280.415 3.525 20 0 CHADHO CCCC[C@@H]([NH2+]C[C@@H](C)CN(C)C)c1ccccc1 ZINC000311854318 262342335 /nfs/dbraw/zinc/34/23/35/262342335.db2.gz TUSBPGRUHSMJMU-NVXWUHKLSA-N 1 3 262.441 3.705 20 0 CHADHO CCCC[C@@H](NC[C@@H](C)C[NH+](C)C)c1ccccc1 ZINC000311854318 262342337 /nfs/dbraw/zinc/34/23/37/262342337.db2.gz TUSBPGRUHSMJMU-NVXWUHKLSA-N 1 3 262.441 3.705 20 0 CHADHO CCCCC[C@@H](C)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000020547005 171244587 /nfs/dbraw/zinc/24/45/87/171244587.db2.gz BEQPKLYHTYCRMF-CYBMUJFWSA-N 1 3 254.462 3.854 20 0 CHADHO CCCCOc1ccc(C[NH2+]CC(C)(C)CN(C)C)cc1 ZINC000020552573 171247934 /nfs/dbraw/zinc/24/79/34/171247934.db2.gz HWLJFCANHCTFSL-UHFFFAOYSA-N 1 3 292.467 3.543 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+]C1CCCCCCC1 ZINC000021813435 171330967 /nfs/dbraw/zinc/33/09/67/171330967.db2.gz KYRHJXXKOYQUQZ-MRXNPFEDSA-N 1 3 266.473 3.953 20 0 CHADHO C[C@H](C[NH2+][C@H](C)c1ccc(F)cc1)CN1CCCCC1 ZINC000038041769 174042989 /nfs/dbraw/zinc/04/29/89/174042989.db2.gz KFXAHBKCQMMYIG-HUUCEWRRSA-N 1 3 278.415 3.598 20 0 CHADHO CCCCCN1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000078776036 177385549 /nfs/dbraw/zinc/38/55/49/177385549.db2.gz TVZUXKBSGSXYMV-QGZVFWFLSA-N 1 3 266.473 3.765 20 0 CHADHO [NH3+]CCCN(Cc1cnc2ccccc2c1)CC1CCCC1 ZINC000352541543 227050759 /nfs/dbraw/zinc/05/07/59/227050759.db2.gz ZBARVUWBESMNDR-UHFFFAOYSA-N 1 3 297.446 3.576 20 0 CHADHO CC(C)C[C@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccccc1 ZINC000037649390 260115650 /nfs/dbraw/zinc/11/56/50/260115650.db2.gz DBPKWUUGGDONMT-APWZRJJASA-N 1 3 286.463 3.848 20 0 CHADHO CC(C)C[C@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1ccccc1 ZINC000037649390 260115651 /nfs/dbraw/zinc/11/56/51/260115651.db2.gz DBPKWUUGGDONMT-APWZRJJASA-N 1 3 286.463 3.848 20 0 CHADHO CC[NH+](CC)Cc1ccccc1CN[C@H](C)c1ccncc1 ZINC000074335612 260165047 /nfs/dbraw/zinc/16/50/47/260165047.db2.gz UROXRCFOWFTVEZ-MRXNPFEDSA-N 1 3 297.446 3.774 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+]C2CCC(c3ccccc3)CC2)C1 ZINC000093211227 260273228 /nfs/dbraw/zinc/27/32/28/260273228.db2.gz LENXAQPDWIYRHD-FPQWYMTMSA-N 1 3 272.436 3.572 20 0 CHADHO Cc1ccc([C@@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c(C)c1 ZINC000088163968 260280548 /nfs/dbraw/zinc/28/05/48/260280548.db2.gz QAIPJTKUGXBJGW-CSNJMZFVSA-N 1 3 286.463 3.969 20 0 CHADHO Cc1ccc([C@@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c(C)c1 ZINC000088163968 260280550 /nfs/dbraw/zinc/28/05/50/260280550.db2.gz QAIPJTKUGXBJGW-CSNJMZFVSA-N 1 3 286.463 3.969 20 0 CHADHO CC[C@H]([NH2+]C1CCN(C2CCCC2)CC1)C1CCCC1 ZINC000449181905 260282910 /nfs/dbraw/zinc/28/29/10/260282910.db2.gz JAMVUMMAXYOAGF-SFHVURJKSA-N 1 3 278.484 3.952 20 0 CHADHO C[C@H](CN[C@H]1C[C@H](C)c2ccccc21)C[NH+]1CCCC1 ZINC000313585317 260303264 /nfs/dbraw/zinc/30/32/64/260303264.db2.gz YKVXSEWYLRDOJQ-VKJFTORMSA-N 1 3 272.436 3.556 20 0 CHADHO C[C@H](C[NH2+][C@H]1C[C@H](C)c2ccccc21)CN1CCCC1 ZINC000313585317 260303265 /nfs/dbraw/zinc/30/32/65/260303265.db2.gz YKVXSEWYLRDOJQ-VKJFTORMSA-N 1 3 272.436 3.556 20 0 CHADHO CC[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)c1ccc(Cl)cc1 ZINC000222936077 260478519 /nfs/dbraw/zinc/47/85/19/260478519.db2.gz CQGQQLZBNCWHFM-ILXRZTDVSA-N 1 3 266.816 3.651 20 0 CHADHO c1ccc2c(c1)CCC[C@H]2[N@@H+]1CC[C@H](CN2CCCCC2)C1 ZINC000173602907 261166476 /nfs/dbraw/zinc/16/64/76/261166476.db2.gz BSBSADLMZWLCMY-YLJYHZDGSA-N 1 3 298.474 3.872 20 0 CHADHO c1ccc2c(c1)CCC[C@H]2[N@H+]1CC[C@H](CN2CCCCC2)C1 ZINC000173602907 261166478 /nfs/dbraw/zinc/16/64/78/261166478.db2.gz BSBSADLMZWLCMY-YLJYHZDGSA-N 1 3 298.474 3.872 20 0 CHADHO c1ccc2c(c1)CCC[C@H]2N1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000173602907 261166480 /nfs/dbraw/zinc/16/64/80/261166480.db2.gz BSBSADLMZWLCMY-YLJYHZDGSA-N 1 3 298.474 3.872 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]2[NH2+][C@@H]2CCN3CCC[C@@H]3C2)cc1 ZINC000161605736 261253847 /nfs/dbraw/zinc/25/38/47/261253847.db2.gz LLSWZHQRDQURBB-AKHDSKFASA-N 1 3 284.447 3.539 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]2N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000161605736 261253849 /nfs/dbraw/zinc/25/38/49/261253849.db2.gz LLSWZHQRDQURBB-AKHDSKFASA-N 1 3 284.447 3.539 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]2N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000161605736 261253850 /nfs/dbraw/zinc/25/38/50/261253850.db2.gz LLSWZHQRDQURBB-AKHDSKFASA-N 1 3 284.447 3.539 20 0 CHADHO Cc1cncc([C@@H](C)NCCCC[N@@H+]2CCC[C@H](C)C2)c1 ZINC000184281067 262014673 /nfs/dbraw/zinc/01/46/73/262014673.db2.gz PBWLWDIIHPGPKT-DOTOQJQBSA-N 1 3 289.467 3.553 20 0 CHADHO Cc1cncc([C@@H](C)NCCCC[N@H+]2CCC[C@H](C)C2)c1 ZINC000184281067 262014675 /nfs/dbraw/zinc/01/46/75/262014675.db2.gz PBWLWDIIHPGPKT-DOTOQJQBSA-N 1 3 289.467 3.553 20 0 CHADHO CC[NH+]1CCC(CCN[C@H](C)c2sccc2OC)CC1 ZINC000186178237 262083924 /nfs/dbraw/zinc/08/39/24/262083924.db2.gz PNPONISZIPTLST-CYBMUJFWSA-N 1 3 296.480 3.529 20 0 CHADHO CC(C)N(C)CCC[NH2+]C1CCC(C(C)(C)C)CC1 ZINC000221792558 262297131 /nfs/dbraw/zinc/29/71/31/262297131.db2.gz WSJUPMUNECXGRB-UHFFFAOYSA-N 1 3 268.489 3.911 20 0 CHADHO Cc1ccc([C@H]2CCC[N@H+]2C[C@H](N)CC(C)C)s1 ZINC000414685988 263032315 /nfs/dbraw/zinc/03/23/15/263032315.db2.gz ADMRAPHIJKUZLQ-ZIAGYGMSSA-N 1 3 266.454 3.567 20 0 CHADHO Cc1ccc([C@H]2CCC[N@@H+]2C[C@H](N)CC(C)C)s1 ZINC000414685988 263032316 /nfs/dbraw/zinc/03/23/16/263032316.db2.gz ADMRAPHIJKUZLQ-ZIAGYGMSSA-N 1 3 266.454 3.567 20 0 CHADHO Cc1cc(Cl)cc(C)c1CN(C)[C@@H]1CCC[NH2+]CC1 ZINC000414756989 263039622 /nfs/dbraw/zinc/03/96/22/263039622.db2.gz WMXMADWAVJZLSY-OAHLLOKOSA-N 1 3 280.843 3.531 20 0 CHADHO CC(C)C[C@H](Cc1cccc(Cl)c1)[NH2+]C1CCNCC1 ZINC000414783316 263046887 /nfs/dbraw/zinc/04/68/87/263046887.db2.gz QMVJWOFTGZZMIM-QGZVFWFLSA-N 1 3 294.870 3.639 20 0 CHADHO Cc1ccccc1-c1cccc(C[NH2+]C2CCNCC2)c1 ZINC000414793215 263049590 /nfs/dbraw/zinc/04/95/90/263049590.db2.gz UBMBKEUQJUVJIU-UHFFFAOYSA-N 1 3 280.415 3.504 20 0 CHADHO COc1ccccc1/C=C/CNCc1ccc([C@@H](C)[NH3+])cc1 ZINC000414808134 263052541 /nfs/dbraw/zinc/05/25/41/263052541.db2.gz KIIKUTSTNHLZGB-KEDPEKRHSA-N 1 3 296.414 3.518 20 0 CHADHO Cc1ccc(CNCc2ccc([C@@H](C)[NH3+])cc2)c(C)c1 ZINC000414808477 263052641 /nfs/dbraw/zinc/05/26/41/263052641.db2.gz KPSNQQHOMYQCRS-OAHLLOKOSA-N 1 3 268.404 3.613 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+]CCCc1c(F)cccc1Cl ZINC000414811456 263053110 /nfs/dbraw/zinc/05/31/10/263053110.db2.gz WJBRQPVZGNKSIB-LRDDRELGSA-N 1 3 298.833 3.519 20 0 CHADHO C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@H](C)[C@H]1CCCNC1 ZINC000414827685 263055920 /nfs/dbraw/zinc/05/59/20/263055920.db2.gz YDOOGPVZEJMZRA-ZACQAIPSSA-N 1 3 288.479 3.721 20 0 CHADHO C[C@H](CNCC1([NH3+])CCCCC1)c1cccc(Cl)c1 ZINC000414844230 263058448 /nfs/dbraw/zinc/05/84/48/263058448.db2.gz PGBHFGPXNGHKRD-CYBMUJFWSA-N 1 3 280.843 3.695 20 0 CHADHO [NH3+]C1(CN[C@H]2CCC[C@H]2c2ccccc2)CCCCC1 ZINC000414848034 263064320 /nfs/dbraw/zinc/06/43/20/263064320.db2.gz VPQQTJFCWLWHAO-IRXDYDNUSA-N 1 3 272.436 3.574 20 0 CHADHO [NH3+]C1(CN[C@H]2CCC[C@@H]2c2ccccc2)CCCCC1 ZINC000414848037 263064454 /nfs/dbraw/zinc/06/44/54/263064454.db2.gz VPQQTJFCWLWHAO-SJORKVTESA-N 1 3 272.436 3.574 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@@H]2[NH2+]C[C@@]2(C)CCCNC2)cc1 ZINC000414903623 263111441 /nfs/dbraw/zinc/11/14/41/263111441.db2.gz ISBSVDNDTUICAS-FHWLQOOXSA-N 1 3 286.463 3.610 20 0 CHADHO Fc1ccc(C2CCC([NH2+][C@H]3CCCNCC3)CC2)cc1 ZINC000414907970 263114403 /nfs/dbraw/zinc/11/44/03/263114403.db2.gz CHQLIOKJBBNCKK-NXYGQSRBSA-N 1 3 290.426 3.584 20 0 CHADHO c1cc(-c2ccccc2)oc1CNCCC[C@H]1CCC[NH2+]1 ZINC000414969724 263171115 /nfs/dbraw/zinc/17/11/15/263171115.db2.gz JIMCILHMYUWOQQ-INIZCTEOSA-N 1 3 284.403 3.568 20 0 CHADHO CCc1cccc(Cl)c1CNCCC[C@@H]1CCC[NH2+]1 ZINC000414971636 263172979 /nfs/dbraw/zinc/17/29/79/263172979.db2.gz WSUBBCUACSOKCQ-CQSZACIVSA-N 1 3 280.843 3.524 20 0 CHADHO Cc1cc([C@H](C)[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)cs1 ZINC000453133911 263193831 /nfs/dbraw/zinc/19/38/31/263193831.db2.gz NIFJEBUWWVPVRQ-NWANDNLSSA-N 1 3 266.454 3.580 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H](CC)c2cccc(F)c2)C1 ZINC000187818743 263269608 /nfs/dbraw/zinc/26/96/08/263269608.db2.gz QBFSEBPVEQRNBC-PBHICJAKSA-N 1 3 278.415 3.598 20 0 CHADHO c1ccc(C[C@H](N[C@@H]2CCC[NH2+]CC2)c2ccccc2)cc1 ZINC000415088417 263271331 /nfs/dbraw/zinc/27/13/31/263271331.db2.gz LYEYWNNDXOXJJU-UXHICEINSA-N 1 3 294.442 3.702 20 0 CHADHO CCC[C@H](CN[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000368401745 267169247 /nfs/dbraw/zinc/16/92/47/267169247.db2.gz GCSYTGGPFPHRNV-CEXWTWQISA-N 1 3 286.463 3.787 20 0 CHADHO CCC[C@H](CN[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000368401745 267169250 /nfs/dbraw/zinc/16/92/50/267169250.db2.gz GCSYTGGPFPHRNV-CEXWTWQISA-N 1 3 286.463 3.787 20 0 CHADHO Cc1ccccc1C[C@H]([NH2+][C@@H]1CCN2CCC[C@@H]2C1)C1CC1 ZINC000370534159 267327016 /nfs/dbraw/zinc/32/70/16/267327016.db2.gz RFULLVQBNROCHS-AQNXPRMDSA-N 1 3 298.474 3.533 20 0 CHADHO Cc1ccccc1C[C@H](N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)C1CC1 ZINC000370534159 267327018 /nfs/dbraw/zinc/32/70/18/267327018.db2.gz RFULLVQBNROCHS-AQNXPRMDSA-N 1 3 298.474 3.533 20 0 CHADHO Cc1ccccc1C[C@H](N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)C1CC1 ZINC000370534159 267327019 /nfs/dbraw/zinc/32/70/19/267327019.db2.gz RFULLVQBNROCHS-AQNXPRMDSA-N 1 3 298.474 3.533 20 0 CHADHO CC(C)=CCC[C@H](C)[NH2+]Cc1cccc(CN(C)C)c1 ZINC000531688000 328021715 /nfs/dbraw/zinc/02/17/15/328021715.db2.gz BQKYJFRXWOONMU-INIZCTEOSA-N 1 3 274.452 3.973 20 0 CHADHO C[C@@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccccc1C(C)(C)C ZINC000534353146 328048303 /nfs/dbraw/zinc/04/83/03/328048303.db2.gz PNKIVLVYJXORCQ-CVEARBPZSA-N 1 3 288.479 3.977 20 0 CHADHO C[C@@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccccc1C(C)(C)C ZINC000534353146 328048305 /nfs/dbraw/zinc/04/83/05/328048305.db2.gz PNKIVLVYJXORCQ-CVEARBPZSA-N 1 3 288.479 3.977 20 0 CHADHO CCSc1cccc(CN2CCC(CC[NH2+]C)CC2)c1 ZINC000414654519 328209491 /nfs/dbraw/zinc/20/94/91/328209491.db2.gz CDMOPAQNMFUELW-UHFFFAOYSA-N 1 3 292.492 3.620 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CNCc2ccc(Cl)cc2)cc1 ZINC000414807706 328232384 /nfs/dbraw/zinc/23/23/84/328232384.db2.gz JHJWCLIVYXAUFG-GFCCVEGCSA-N 1 3 274.795 3.650 20 0 CHADHO C[C@H](CCC1CCCCC1)[NH2+][C@H]1CCC[C@@H](N)C1 ZINC000414928605 328273402 /nfs/dbraw/zinc/27/34/02/328273402.db2.gz QIWYHDBFDFQNFP-BMFZPTHFSA-N 1 3 252.446 3.595 20 0 CHADHO Cc1cccc([C@@H](N[C@H]2CCC[NH2+]CC2)C(C)(C)C)c1 ZINC000415082799 328302535 /nfs/dbraw/zinc/30/25/35/328302535.db2.gz OVYWXPYBAFSJFY-DLBZAZTESA-N 1 3 274.452 3.814 20 0 CHADHO C[C@@H]1Cc2ccccc2[C@H]1NCc1ccc(C[NH+](C)C)cc1 ZINC000111410930 328354632 /nfs/dbraw/zinc/35/46/32/328354632.db2.gz CWRVUUXHIQGKMF-QRWLVFNGSA-N 1 3 294.442 3.771 20 0 CHADHO C[C@@H]1Cc2ccccc2[C@H]1[NH2+]Cc1ccc(CN(C)C)cc1 ZINC000111410930 328354634 /nfs/dbraw/zinc/35/46/34/328354634.db2.gz CWRVUUXHIQGKMF-QRWLVFNGSA-N 1 3 294.442 3.771 20 0 CHADHO C[N@@H+]1CCC[C@H](CN[C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000534973199 328372205 /nfs/dbraw/zinc/37/22/05/328372205.db2.gz BZPBISDWAUXOKP-DYVFJYSZSA-N 1 3 292.854 3.649 20 0 CHADHO C[N@H+]1CCC[C@H](CN[C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000534973199 328372206 /nfs/dbraw/zinc/37/22/06/328372206.db2.gz BZPBISDWAUXOKP-DYVFJYSZSA-N 1 3 292.854 3.649 20 0 CHADHO Cc1ccsc1[C@H](C)[NH2+]C[C@@H](C)CN1CCCCC1 ZINC000070091861 328386815 /nfs/dbraw/zinc/38/68/15/328386815.db2.gz PIKHIAGYVFTMAA-HIFRSBDPSA-N 1 3 280.481 3.829 20 0 CHADHO C[NH+](C)CCCC1CCN(C/C=C\c2ccccc2)CC1 ZINC000255867938 327021994 /nfs/dbraw/zinc/02/19/94/327021994.db2.gz FWFGLDJEPWOLMI-XFFZJAGNSA-N 1 3 286.463 3.754 20 0 CHADHO Cc1cc(N2C[C@H]([NH+]3CCCC3)C[C@H]2C)c2ccccc2n1 ZINC000557735456 327023644 /nfs/dbraw/zinc/02/36/44/327023644.db2.gz YTMACBCRUUNDQQ-HZPDHXFCSA-N 1 3 295.430 3.606 20 0 CHADHO CC1CCC([NH2+]CCCN2C[C@H](C)C[C@@H](C)C2)CC1 ZINC000568930672 327024504 /nfs/dbraw/zinc/02/45/04/327024504.db2.gz ACVOWLPDUFCBIU-JCCCHCCOSA-N 1 3 266.473 3.523 20 0 CHADHO CC[NH+](CC)CCCN1C[C@H](c2ccccc2)C[C@H]1C ZINC000558724374 327117679 /nfs/dbraw/zinc/11/76/79/327117679.db2.gz CRDLEJZEGOULEJ-SJLPKXTDSA-N 1 3 274.452 3.596 20 0 CHADHO CCN(CC)CCC[N@@H+]1C[C@H](c2ccccc2)C[C@H]1C ZINC000558724374 327117681 /nfs/dbraw/zinc/11/76/81/327117681.db2.gz CRDLEJZEGOULEJ-SJLPKXTDSA-N 1 3 274.452 3.596 20 0 CHADHO CCN(CC)CCC[N@H+]1C[C@H](c2ccccc2)C[C@H]1C ZINC000558724374 327117682 /nfs/dbraw/zinc/11/76/82/327117682.db2.gz CRDLEJZEGOULEJ-SJLPKXTDSA-N 1 3 274.452 3.596 20 0 CHADHO c1cc2c(s1)CCC[C@@H]2N[C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000093453180 327119046 /nfs/dbraw/zinc/11/90/46/327119046.db2.gz MJXZEOSNXMFYOX-BVUBDWEXSA-N 1 3 290.476 3.636 20 0 CHADHO CC1=CC[C@@H](NCCC[NH+](C(C)C)C(C)C)CC1 ZINC000559919798 327271672 /nfs/dbraw/zinc/27/16/72/327271672.db2.gz STFDEXWUEYGEQF-MRXNPFEDSA-N 1 3 252.446 3.584 20 0 CHADHO CC1=CC[C@@H]([NH2+]CCCN(C(C)C)C(C)C)CC1 ZINC000559919798 327271674 /nfs/dbraw/zinc/27/16/74/327271674.db2.gz STFDEXWUEYGEQF-MRXNPFEDSA-N 1 3 252.446 3.584 20 0 CHADHO CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000560550146 327323695 /nfs/dbraw/zinc/32/36/95/327323695.db2.gz VAXHAPCYSUGSNW-FZCLSBEQSA-N 1 3 278.484 3.664 20 0 CHADHO CC(C)c1ccc([C@@H](C)N2CC[C@](C)(C[NH3+])C2)cc1 ZINC000261617660 327359563 /nfs/dbraw/zinc/35/95/63/327359563.db2.gz UFYLVRFYPWAYJS-RHSMWYFYSA-N 1 3 260.425 3.542 20 0 CHADHO CC(C)c1ccc([C@@H](C)[N@@H+]2CC[C@](C)(CN)C2)cc1 ZINC000261617660 327359564 /nfs/dbraw/zinc/35/95/64/327359564.db2.gz UFYLVRFYPWAYJS-RHSMWYFYSA-N 1 3 260.425 3.542 20 0 CHADHO CC(C)c1ccc([C@@H](C)[N@H+]2CC[C@](C)(CN)C2)cc1 ZINC000261617660 327359566 /nfs/dbraw/zinc/35/95/66/327359566.db2.gz UFYLVRFYPWAYJS-RHSMWYFYSA-N 1 3 260.425 3.542 20 0 CHADHO CC[C@@H]1CC[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000562878211 327521227 /nfs/dbraw/zinc/52/12/27/327521227.db2.gz DYHSLDMJJLTQLC-PBHICJAKSA-N 1 3 264.457 3.562 20 0 CHADHO CCc1ccc(CNCCCC[NH+]2C[C@H](C)C[C@@H](C)C2)o1 ZINC000532112809 328699098 /nfs/dbraw/zinc/69/90/98/328699098.db2.gz PXVCNTPOEFDRHL-HZPDHXFCSA-N 1 3 292.467 3.690 20 0 CHADHO CCC[C@H]([NH2+]C1CCN(c2ccncc2)CC1)C1CCC1 ZINC000324776070 328793437 /nfs/dbraw/zinc/79/34/37/328793437.db2.gz FEZKNTCTTRQXFP-SFHVURJKSA-N 1 3 287.451 3.609 20 0 CHADHO CCC[C@H]([NH2+]CC1(CN(C)C)CCCC1)c1ccccn1 ZINC000183952884 329255238 /nfs/dbraw/zinc/25/52/38/329255238.db2.gz SGROWWQHACOLDX-INIZCTEOSA-N 1 3 289.467 3.634 20 0 CHADHO C[C@@H](CCC1CC1)[NH2+]C1CCN(C2CCCC2)CC1 ZINC000186374442 329343819 /nfs/dbraw/zinc/34/38/19/329343819.db2.gz JLVSQBWFNMURNF-AWEZNQCLSA-N 1 3 264.457 3.562 20 0 CHADHO C1CC2(CCCC2)[C@@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000189145344 329376478 /nfs/dbraw/zinc/37/64/78/329376478.db2.gz DLPSSCRREVQOIO-QGZVFWFLSA-N 1 3 276.468 3.706 20 0 CHADHO CC[C@H](C)C[NH2+]C1CCN([C@H]2CCCC[C@@H]2C)CC1 ZINC000421393026 329820718 /nfs/dbraw/zinc/82/07/18/329820718.db2.gz YIRZCKJCRZDQEK-ZOBUZTSGSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)(CC[NH3+])NCc1ccc(-c2ccccc2)s1 ZINC000422564769 330149433 /nfs/dbraw/zinc/14/94/33/330149433.db2.gz WTAYLQCORNATCV-UHFFFAOYSA-N 1 3 274.433 3.632 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@@H]1NCC1(c2ccc(Cl)cc2)CC1 ZINC000422703998 330151172 /nfs/dbraw/zinc/15/11/72/330151172.db2.gz OKKCLIDEBKUKMZ-CVEARBPZSA-N 1 3 292.854 3.621 20 0 CHADHO c1csc([C@@H](NC2C[C@H]3CC[C@@H](C2)[NH2+]3)C2CCCC2)c1 ZINC000422711054 330151380 /nfs/dbraw/zinc/15/13/80/330151380.db2.gz GPJKTFRTTAZWTJ-MYSGWJLTSA-N 1 3 290.476 3.852 20 0 CHADHO Cc1ccc(CCN[C@@H]2C[C@H]([NH3+])c3ccccc32)c(C)c1 ZINC000422707619 330151439 /nfs/dbraw/zinc/15/14/39/330151439.db2.gz WSNYVOYWKGJWRI-RBUKOAKNSA-N 1 3 280.415 3.580 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@H]2CC[NH2+]CC[C@H]2C)c1C ZINC000422735169 330152651 /nfs/dbraw/zinc/15/26/51/330152651.db2.gz DLYJUUXYDBBREF-ACJLOTCBSA-N 1 3 299.462 3.571 20 0 CHADHO C[C@H](N[C@@H]1CCC[NH2+]CC1)c1ccc2ccccc2c1 ZINC000422746644 330153013 /nfs/dbraw/zinc/15/30/13/330153013.db2.gz NZXLYESHWBGTIB-KBXCAEBGSA-N 1 3 268.404 3.633 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000422752922 330153343 /nfs/dbraw/zinc/15/33/43/330153343.db2.gz HWXNFPQQHZRGLA-HOTGVXAUSA-N 1 3 282.431 3.534 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCC(c1ccccc1)c1ccccc1 ZINC000422752922 330153344 /nfs/dbraw/zinc/15/33/44/330153344.db2.gz HWXNFPQQHZRGLA-HOTGVXAUSA-N 1 3 282.431 3.534 20 0 CHADHO C[C@H](N[C@@H](C)[C@H]1CCC[NH2+]C1)c1ccc2c(c1)CCCC2 ZINC000422759009 330153592 /nfs/dbraw/zinc/15/35/92/330153592.db2.gz FHXVPLIVNKCQDC-DOXZYTNZSA-N 1 3 286.463 3.604 20 0 CHADHO C[C@@H](N[C@@H](C)CCC[NH3+])c1cccc(Cl)c1Cl ZINC000422756311 330153636 /nfs/dbraw/zinc/15/36/36/330153636.db2.gz HUNFVJFCDVAAFJ-VHSXEESVSA-N 1 3 275.223 3.771 20 0 CHADHO C[C@@H](N)C[C@H](C)[NH2+]CC1(c2ccc(F)cc2)CCCCC1 ZINC000422760994 330153776 /nfs/dbraw/zinc/15/37/76/330153776.db2.gz MDKTYAWMWHPZRK-CABCVRRESA-N 1 3 292.442 3.743 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCC1(c2ccc(F)cc2)CCCCC1 ZINC000422760994 330153777 /nfs/dbraw/zinc/15/37/77/330153777.db2.gz MDKTYAWMWHPZRK-CABCVRRESA-N 1 3 292.442 3.743 20 0 CHADHO Clc1ccc([C@H](N[C@H]2CCC[NH2+]CC2)C2CC2)cc1 ZINC000422761697 330153849 /nfs/dbraw/zinc/15/38/49/330153849.db2.gz MCDXQLAFRCRDOI-JKSUJKDBSA-N 1 3 278.827 3.523 20 0 CHADHO C[C@H](N[C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1cccs1 ZINC000422766238 330153870 /nfs/dbraw/zinc/15/38/70/330153870.db2.gz RBCPHVJAWONDDL-IMJJTQAJSA-N 1 3 286.444 3.892 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H](C)c1cccc2ccccc21 ZINC000422773209 330154381 /nfs/dbraw/zinc/15/43/81/330154381.db2.gz ZLVZVVPNXHAEAV-BFHYXJOUSA-N 1 3 256.393 3.616 20 0 CHADHO CC[C@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)C(C)(C)c1ccccc1 ZINC000422793387 330155669 /nfs/dbraw/zinc/15/56/69/330155669.db2.gz YDBFJIJQGUOBMA-WFFDWFOESA-N 1 3 286.463 3.615 20 0 CHADHO c1ccc(C2(CN[C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)CCC2)cc1 ZINC000422802459 330155869 /nfs/dbraw/zinc/15/58/69/330155869.db2.gz BNLBVJGYWCZBIS-GBESFXJTSA-N 1 3 298.474 3.619 20 0 CHADHO CCCC[C@H](CCC)[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000422841000 330157224 /nfs/dbraw/zinc/15/72/24/330157224.db2.gz UZUBBECBQPXECF-HIFRSBDPSA-N 1 3 277.456 3.858 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](c1cccc(F)c1)C(C)(C)C ZINC000422840439 330157247 /nfs/dbraw/zinc/15/72/47/330157247.db2.gz SYCIOPBGPDRYJK-HUBLWGQQSA-N 1 3 266.404 3.628 20 0 CHADHO [NH3+][C@H]1CCC[C@@H]1NCC1(c2ccc(Cl)cc2)CCCC1 ZINC000422882325 330158956 /nfs/dbraw/zinc/15/89/56/330158956.db2.gz RXAHXCGQXWQJNK-HOTGVXAUSA-N 1 3 292.854 3.621 20 0 CHADHO C[C@H](CN[C@@H]1CCC[C@H]1[NH3+])c1c(Cl)cccc1Cl ZINC000422879288 330159020 /nfs/dbraw/zinc/15/90/20/330159020.db2.gz MDMVRRXRKXYKPC-OASPWFOLSA-N 1 3 287.234 3.566 20 0 CHADHO c1ccc([C@H]2CCCC[C@@H]2NC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000422896055 330159588 /nfs/dbraw/zinc/15/95/88/330159588.db2.gz HFBYXJKYXFULJN-VEHMJYNQSA-N 1 3 284.447 3.585 20 0 CHADHO [NH3+][C@H]1CCC[C@H]1NCC1(Sc2ccccc2)CCCC1 ZINC000422912489 330160191 /nfs/dbraw/zinc/16/01/91/330160191.db2.gz WGZPJMVBIQPXBT-JKSUJKDBSA-N 1 3 290.476 3.561 20 0 CHADHO C[C@H]([NH3+])[C@H](Cc1ccccc1)N[C@@H]1C[C@@H]1C1CCCCC1 ZINC000422917528 330160254 /nfs/dbraw/zinc/16/02/54/330160254.db2.gz GDBWDDZVPHVDBF-KLIQENQMSA-N 1 3 286.463 3.503 20 0 CHADHO c1ccc(C[C@@H]2C[C@@H]2N[C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000422919128 330160484 /nfs/dbraw/zinc/16/04/84/330160484.db2.gz JLISXMPSUVNIEP-IVDHNXQLSA-N 1 3 298.474 3.518 20 0 CHADHO CC[C@@H](N[C@H](C)CCCC[NH3+])c1cc(F)ccc1F ZINC000422923638 330160643 /nfs/dbraw/zinc/16/06/43/330160643.db2.gz SEOIBZPXVWYSKK-IAQYHMDHSA-N 1 3 270.367 3.523 20 0 CHADHO c1ccc(C[C@@H]2C[C@@H]2N[C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000422919130 330160654 /nfs/dbraw/zinc/16/06/54/330160654.db2.gz JLISXMPSUVNIEP-WAPOTWQKSA-N 1 3 298.474 3.518 20 0 CHADHO C[C@@H](N)C[C@@H](C)[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC000422989887 330162903 /nfs/dbraw/zinc/16/29/03/330162903.db2.gz MKTHQGBHYXQWJL-RCDYEMGKSA-N 1 3 274.452 3.602 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NCC2(Cc3ccccc3)CC2)c2ccccc21 ZINC000422996449 330163481 /nfs/dbraw/zinc/16/34/81/330163481.db2.gz MDFMBAPNBFNUNB-RTBURBONSA-N 1 3 292.426 3.744 20 0 CHADHO CC(C)C[C@H](N[C@H](C)C[C@H](C)[NH3+])c1cccs1 ZINC000422950265 330163677 /nfs/dbraw/zinc/16/36/77/330163677.db2.gz VOQKSMQPUJEONA-XQQFMLRXSA-N 1 3 254.443 3.551 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000422954081 330164084 /nfs/dbraw/zinc/16/40/84/330164084.db2.gz HFUVOSMFPMETBN-RWEMILLDSA-N 1 3 287.234 3.696 20 0 CHADHO CC(C)c1ccc2c(c1)[C@H]([NH2+]C1CCNCC1)CCC2 ZINC000423027271 330166003 /nfs/dbraw/zinc/16/60/03/330166003.db2.gz RGYTYHVDRVLKKN-GOSISDBHSA-N 1 3 272.436 3.529 20 0 CHADHO C[C@@H](N)C[C@H](C)[NH2+]CC1(Cc2ccccc2)CCCC1 ZINC000423044254 330166746 /nfs/dbraw/zinc/16/67/46/330166746.db2.gz QTWVBJDHSHZBGZ-CVEARBPZSA-N 1 3 274.452 3.505 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](CC1CCC1)c1ccccc1 ZINC000423043248 330166773 /nfs/dbraw/zinc/16/67/73/330166773.db2.gz OAENPAOWVDRSOK-VBQJREDUSA-N 1 3 260.425 3.633 20 0 CHADHO c1ccc([C@@H](CC2CCC2)NC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000423041322 330166859 /nfs/dbraw/zinc/16/68/59/330166859.db2.gz ISFMEOFNQUROHY-ZZJWQFMZSA-N 1 3 284.447 3.791 20 0 CHADHO Cc1ccc([C@@H](N[C@@H](C)CCCC[NH3+])c2ccccn2)cc1 ZINC000423082598 330168727 /nfs/dbraw/zinc/16/87/27/330168727.db2.gz DNMLDOQYLBSFAQ-QFBILLFUSA-N 1 3 297.446 3.587 20 0 CHADHO NC[C@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423105647 330170546 /nfs/dbraw/zinc/17/05/46/330170546.db2.gz ZDNWGOWSTUXPQM-SRABZTEZSA-N 1 3 292.854 3.693 20 0 CHADHO C[C@H](C[C@@H]1CCCCC[NH2+]1)NCCc1cccc2[nH]ccc21 ZINC000423116843 330171070 /nfs/dbraw/zinc/17/10/70/330171070.db2.gz RSSFEDSJZFOZAD-WBVHZDCISA-N 1 3 299.462 3.611 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H](C)c1ccc(Oc2cccnc2)cc1 ZINC000423119881 330171184 /nfs/dbraw/zinc/17/11/84/330171184.db2.gz FRIVPTGNYBDXFK-RRFJBIMHSA-N 1 3 299.418 3.650 20 0 CHADHO [NH3+][C@@H]1C[C@H](NC[C@@H](c2ccccc2)C2CC2)c2ccccc21 ZINC000423123514 330171394 /nfs/dbraw/zinc/17/13/94/330171394.db2.gz FCCQLJYHHWJEHF-ZCNNSNEGSA-N 1 3 292.426 3.915 20 0 CHADHO C[C@@]1(CN[C@H]2C[C@@H]([NH3+])c3ccccc32)C[C@H]1c1ccccc1 ZINC000423132982 330171814 /nfs/dbraw/zinc/17/18/14/330171814.db2.gz JTUKESQKTGUGOK-YRPNKDGESA-N 1 3 292.426 3.915 20 0 CHADHO C=Cc1ccc(CCN[C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000423133283 330171939 /nfs/dbraw/zinc/17/19/39/330171939.db2.gz CRWUBTXESCFLQH-HSALFYBXSA-N 1 3 298.474 3.773 20 0 CHADHO C=Cc1ccc(CC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCCN2)cc1 ZINC000423133283 330171940 /nfs/dbraw/zinc/17/19/40/330171940.db2.gz CRWUBTXESCFLQH-HSALFYBXSA-N 1 3 298.474 3.773 20 0 CHADHO NC[C@H]1CCCC[C@H]1[NH2+]CCc1cc2ccccc2s1 ZINC000423138053 330172301 /nfs/dbraw/zinc/17/23/01/330172301.db2.gz RXHFYUXEXBOCCY-GDBMZVCRSA-N 1 3 288.460 3.551 20 0 CHADHO c1ccc([C@@H]2C[C@H]2C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCCN2)cc1 ZINC000423138454 330172360 /nfs/dbraw/zinc/17/23/60/330172360.db2.gz STYZJRVKVNKCIL-VYJAJWGXSA-N 1 3 298.474 3.691 20 0 CHADHO CC(C)=CCC[C@H](C)[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000423152169 330173159 /nfs/dbraw/zinc/17/31/59/330173159.db2.gz DSWVYVAQRWPAKQ-KBPBESRZSA-N 1 3 275.440 3.634 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@H]1CCCC(C)(C)C1 ZINC000423165682 330173939 /nfs/dbraw/zinc/17/39/39/330173939.db2.gz QBLFUPDPNRBDTC-ZFWWWQNUSA-N 1 3 289.467 3.716 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[C@H](C)C1 ZINC000423164396 330173978 /nfs/dbraw/zinc/17/39/78/330173978.db2.gz OKWDFDBSCIUSIT-YXWQFLTLSA-N 1 3 289.467 3.714 20 0 CHADHO N[C@@H]1CCCCC[C@@H]1[NH2+][C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000423172175 330174442 /nfs/dbraw/zinc/17/44/42/330174442.db2.gz RREDUPNXZUJVLI-QPKOPYBWSA-N 1 3 296.817 3.585 20 0 CHADHO NC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000423170963 330174493 /nfs/dbraw/zinc/17/44/93/330174493.db2.gz ZCFFOLYRRNUVEG-WTTBNOFXSA-N 1 3 292.854 3.693 20 0 CHADHO Cc1ccc(C[C@@H](NCC2([NH3+])CCCCC2)C2CC2)cc1 ZINC000423176098 330174748 /nfs/dbraw/zinc/17/47/48/330174748.db2.gz GBAPDTOIAHCMES-GOSISDBHSA-N 1 3 286.463 3.567 20 0 CHADHO CC[C@H]([NH2+]CC1(N)CCCCC1)c1cccc(F)c1 ZINC000423176301 330174756 /nfs/dbraw/zinc/17/47/56/330174756.db2.gz GNDOWQRQLGRIIX-HNNXBMFYSA-N 1 3 264.388 3.528 20 0 CHADHO [NH3+]CCCN[C@H](Cc1ccc(Cl)cc1)c1ccccc1 ZINC000423177155 330175177 /nfs/dbraw/zinc/17/51/77/330175177.db2.gz AMBISKJKZOPMRD-QGZVFWFLSA-N 1 3 288.822 3.562 20 0 CHADHO CC(C)CC[C@@H]1CC[C@H]([NH2+][C@H](C)[C@H]2CCCNC2)C1 ZINC000423205173 330177060 /nfs/dbraw/zinc/17/70/60/330177060.db2.gz AZILXZQZPOHECX-NCOADZHNSA-N 1 3 266.473 3.569 20 0 CHADHO Cc1cc(C)c([C@H](C)N[C@@H](C)[C@@H]2CCC[NH2+]C2)cc1C ZINC000423210887 330178126 /nfs/dbraw/zinc/17/81/26/330178126.db2.gz GOWDQHODINRQSM-YESZJQIVSA-N 1 3 274.452 3.651 20 0 CHADHO Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)[C@@H]2CCCNC2)cc1C ZINC000423210887 330178128 /nfs/dbraw/zinc/17/81/28/330178128.db2.gz GOWDQHODINRQSM-YESZJQIVSA-N 1 3 274.452 3.651 20 0 CHADHO C[C@H](N)CC[NH2+][C@H]1CCC[C@@H](c2ccc(Cl)cc2)C1 ZINC000423225569 330179978 /nfs/dbraw/zinc/17/99/78/330179978.db2.gz NGOUJUZLJLTDAA-BJJXKVORSA-N 1 3 280.843 3.693 20 0 CHADHO CC(C)[C@@H](NCC[C@H](C)[NH3+])c1ccc(C(F)(F)F)cc1 ZINC000423224627 330180055 /nfs/dbraw/zinc/18/00/55/330180055.db2.gz JQADXVQDUSKCPY-SMDDNHRTSA-N 1 3 288.357 3.729 20 0 CHADHO Clc1cc2c(c(Cl)c1)[C@H](NCC[C@@H]1CC[NH2+]C1)CC2 ZINC000423251689 330182983 /nfs/dbraw/zinc/18/29/83/330182983.db2.gz SKSLNICWIABMGA-IINYFYTJSA-N 1 3 299.245 3.570 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@H]2CN)c2sccc21 ZINC000423267245 330184315 /nfs/dbraw/zinc/18/43/15/330184315.db2.gz CPJJAPDLRFEWLZ-OSRDXIQISA-N 1 3 278.465 3.794 20 0 CHADHO C[C@@H]1CC[C@H](N[C@@H]2CCCC[C@H]2C[NH3+])c2sccc21 ZINC000423267245 330184317 /nfs/dbraw/zinc/18/43/17/330184317.db2.gz CPJJAPDLRFEWLZ-OSRDXIQISA-N 1 3 278.465 3.794 20 0 CHADHO CC(C)C[C@H](CN)[NH2+][C@@H]1C[C@H](C)Sc2sccc21 ZINC000423271486 330184339 /nfs/dbraw/zinc/18/43/39/330184339.db2.gz XUBAEWPGFOGRMA-DMDPSCGWSA-N 1 3 284.494 3.637 20 0 CHADHO Cc1nc(C(C)C)sc1[C@H](C)N[C@H]1CCCC[C@@H]1C[NH3+] ZINC000423270940 330184428 /nfs/dbraw/zinc/18/44/28/330184428.db2.gz HAEHNDHCZCNDAV-YUTCNCBUSA-N 1 3 295.496 3.743 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@@H]2CN)c2sccc21 ZINC000423267244 330184492 /nfs/dbraw/zinc/18/44/92/330184492.db2.gz CPJJAPDLRFEWLZ-GBOPCIDUSA-N 1 3 278.465 3.794 20 0 CHADHO C[C@@H]1CC[C@H](N[C@@H]2CCCC[C@@H]2C[NH3+])c2sccc21 ZINC000423267244 330184493 /nfs/dbraw/zinc/18/44/93/330184493.db2.gz CPJJAPDLRFEWLZ-GBOPCIDUSA-N 1 3 278.465 3.794 20 0 CHADHO CSc1ccc([C@H](C)N[C@@H]2CCCC[C@H]2C[NH3+])cc1F ZINC000423274147 330184812 /nfs/dbraw/zinc/18/48/12/330184812.db2.gz KCZMRJKCPDZCER-CORIIIEPSA-N 1 3 296.455 3.716 20 0 CHADHO CC[C@@H](CSc1ccc(Cl)cc1)N[C@H](C[NH3+])C1CC1 ZINC000423277469 330185007 /nfs/dbraw/zinc/18/50/07/330185007.db2.gz OEMKGPNPPYFETP-DZGCQCFKSA-N 1 3 298.883 3.538 20 0 CHADHO CCC[C@H](N[C@H]1CCCC[C@H]1C[NH3+])c1ccsc1 ZINC000423279919 330185349 /nfs/dbraw/zinc/18/53/49/330185349.db2.gz SBZOYXAIKAJQJF-QEJZJMRPSA-N 1 3 266.454 3.696 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2cccc(F)c2)cc1 ZINC000423289877 330186394 /nfs/dbraw/zinc/18/63/94/330186394.db2.gz BVYBNEXTLIRYHK-OLZOCXBDSA-N 1 3 272.367 3.696 20 0 CHADHO C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)NCC(C)(C)[NH3+] ZINC000423288915 330186618 /nfs/dbraw/zinc/18/66/18/330186618.db2.gz VRPSPAWJNULWKY-ZDUSSCGKSA-N 1 3 287.451 3.551 20 0 CHADHO CC(C)C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccccn1 ZINC000423292015 330187357 /nfs/dbraw/zinc/18/73/57/330187357.db2.gz KYFDNBMGLRPEGK-HNAYVOBHSA-N 1 3 297.446 3.978 20 0 CHADHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccc2c(c1)COC2 ZINC000423293864 330188093 /nfs/dbraw/zinc/18/80/93/330188093.db2.gz SGAQDBJDYREXML-UONOGXRCSA-N 1 3 296.414 3.587 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H]2CCc3c2cccc3F)cc1 ZINC000423295103 330188319 /nfs/dbraw/zinc/18/83/19/330188319.db2.gz WAYDCUGNSROIDT-XIKOKIGWSA-N 1 3 284.378 3.623 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H]2CCCOc3ccccc32)cc1 ZINC000423295178 330188376 /nfs/dbraw/zinc/18/83/76/330188376.db2.gz WINKCJLCAQSGFI-KDOFPFPSSA-N 1 3 296.414 3.710 20 0 CHADHO C[C@H](C[NH3+])CN[C@H](C)c1cccc(-c2ccccc2)c1 ZINC000423297730 330188552 /nfs/dbraw/zinc/18/85/52/330188552.db2.gz LMZWXIAUGLCXGX-HUUCEWRRSA-N 1 3 268.404 3.599 20 0 CHADHO COc1ccccc1-c1ccc([C@@H](C)NC[C@@H](C)C[NH3+])cc1 ZINC000423302560 330189109 /nfs/dbraw/zinc/18/91/09/330189109.db2.gz VRRMRUMTLBJTBT-LSDHHAIUSA-N 1 3 298.430 3.608 20 0 CHADHO C[C@H]([NH2+]C[C@@H](N)C1CC1)c1ccc(-c2ccccc2)s1 ZINC000423314445 330189703 /nfs/dbraw/zinc/18/97/03/330189703.db2.gz HGTWBMVXYHFZMS-SWLSCSKDSA-N 1 3 286.444 3.803 20 0 CHADHO C[C@@H](NC[C@H]([NH3+])C1CC1)C(c1ccccc1)c1ccccc1 ZINC000423314419 330189750 /nfs/dbraw/zinc/18/97/50/330189750.db2.gz HCRIVQVWYZCQSX-BEFAXECRSA-N 1 3 294.442 3.534 20 0 CHADHO CC(C)Sc1ccc([C@@H](C)[NH2+]C[C@H](N)C2CC2)cc1 ZINC000423317883 330189998 /nfs/dbraw/zinc/18/99/98/330189998.db2.gz KUCZZZNYBGTMSB-WBMJQRKESA-N 1 3 278.465 3.575 20 0 CHADHO C[C@@H](NC[C@@]1(C)CCC[NH2+]C1)c1cccc2ccccc21 ZINC000423318677 330190163 /nfs/dbraw/zinc/19/01/63/330190163.db2.gz CWGRBCUSDWIZDM-BEFAXECRSA-N 1 3 282.431 3.880 20 0 CHADHO C[C@@H]([NH2+]C[C@@]1(C)CCCNC1)c1cccc2ccccc21 ZINC000423318677 330190165 /nfs/dbraw/zinc/19/01/65/330190165.db2.gz CWGRBCUSDWIZDM-BEFAXECRSA-N 1 3 282.431 3.880 20 0 CHADHO NC1(C[NH2+][C@H](CC2CC2)c2ccc(Cl)cc2)CCC1 ZINC000423324073 330190565 /nfs/dbraw/zinc/19/05/65/330190565.db2.gz KCMYDOTXBFWXPT-OAHLLOKOSA-N 1 3 278.827 3.652 20 0 CHADHO C[C@@]1(CN[C@H]2CCCc3c4ccccc4[nH]c32)CCC[NH2+]C1 ZINC000423343023 330192456 /nfs/dbraw/zinc/19/24/56/330192456.db2.gz NILBPYYBWJGXTP-PKOBYXMFSA-N 1 3 297.446 3.525 20 0 CHADHO C[C@@]1(C[NH2+][C@H]2CCCc3c4ccccc4[nH]c32)CCCNC1 ZINC000423343023 330192457 /nfs/dbraw/zinc/19/24/57/330192457.db2.gz NILBPYYBWJGXTP-PKOBYXMFSA-N 1 3 297.446 3.525 20 0 CHADHO c1ccc2c(c1)SCC[C@H]2NCc1ccc2c(c1)C[NH2+]C2 ZINC000423358518 330193791 /nfs/dbraw/zinc/19/37/91/330193791.db2.gz NSCIUPDOMSUYLQ-QGZVFWFLSA-N 1 3 296.439 3.617 20 0 CHADHO C[C@@H]1CC[C@H](N[C@H]2CCC[C@@H]([NH3+])C2)c2sccc21 ZINC000423365879 330194763 /nfs/dbraw/zinc/19/47/63/330194763.db2.gz KUYLTOAWDVBEJG-NMKXLXIOSA-N 1 3 264.438 3.546 20 0 CHADHO Clc1ccc2c(c1)[C@@H](NCc1ccc3c(c1)C[NH2+]C3)CC2 ZINC000423372077 330195321 /nfs/dbraw/zinc/19/53/21/330195321.db2.gz GQMSLAHKXUVHJC-SFHVURJKSA-N 1 3 298.817 3.720 20 0 CHADHO C[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1cc(Cl)cc(Cl)c1 ZINC000423371514 330195346 /nfs/dbraw/zinc/19/53/46/330195346.db2.gz GJQGXTKTTTWXCI-HERUPUMHSA-N 1 3 287.234 3.914 20 0 CHADHO C[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccc2c(c1)CCC2 ZINC000423400439 330195961 /nfs/dbraw/zinc/19/59/61/330195961.db2.gz VITKVNSTKCHFDA-CQSZACIVSA-N 1 3 292.426 3.629 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)N[C@@H]1CC[NH2+]C[C@@H]1C ZINC000423401988 330196256 /nfs/dbraw/zinc/19/62/56/330196256.db2.gz RCMLIJODYBOMEO-JQHSSLGASA-N 1 3 274.452 3.670 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)[NH2+][C@@H]1CCNC[C@@H]1C ZINC000423401988 330196257 /nfs/dbraw/zinc/19/62/57/330196257.db2.gz RCMLIJODYBOMEO-JQHSSLGASA-N 1 3 274.452 3.670 20 0 CHADHO CC[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccsc1 ZINC000423375811 330198763 /nfs/dbraw/zinc/19/87/63/330198763.db2.gz IXJDNSVFOIJFNB-INIZCTEOSA-N 1 3 272.417 3.592 20 0 CHADHO CC(C)c1ccc([C@H](C)[NH2+][C@@H]2CCN[C@H](C)C2)cc1 ZINC000423378084 330199050 /nfs/dbraw/zinc/19/90/50/330199050.db2.gz MDWMTDFVOAXDIY-JKIFEVAISA-N 1 3 260.425 3.601 20 0 CHADHO C[C@@H]([NH2+][C@H]1CCN[C@H](C)C1)C1(c2ccccc2)CCCC1 ZINC000423383447 330199141 /nfs/dbraw/zinc/19/91/41/330199141.db2.gz PDRJRUWTOBXJEC-NUJGCVRESA-N 1 3 286.463 3.617 20 0 CHADHO C[C@H]([NH2+][C@H]1CCN[C@H](C)C1)C1(c2ccccc2)CCCC1 ZINC000423383450 330199170 /nfs/dbraw/zinc/19/91/70/330199170.db2.gz PDRJRUWTOBXJEC-RYRKJORJSA-N 1 3 286.463 3.617 20 0 CHADHO Cc1ccccc1[C@H]([NH2+][C@@H]1CCNC[C@@H]1C)C1CCCC1 ZINC000423386274 330199619 /nfs/dbraw/zinc/19/96/19/330199619.db2.gz GZZPJRJDEHSADI-KFKAGJAMSA-N 1 3 286.463 3.814 20 0 CHADHO Cc1ccccc1[C@H](N[C@@H]1CC[NH2+]C[C@@H]1C)C1CCCC1 ZINC000423386274 330199621 /nfs/dbraw/zinc/19/96/21/330199621.db2.gz GZZPJRJDEHSADI-KFKAGJAMSA-N 1 3 286.463 3.814 20 0 CHADHO CC(C)C[C@H]([NH2+][C@H]1CCN[C@@H](C)C1)c1ccccc1 ZINC000423386867 330200108 /nfs/dbraw/zinc/20/01/08/330200108.db2.gz RUMLAJUXCPTEMV-XIRDDKMYSA-N 1 3 260.425 3.504 20 0 CHADHO CC(C)[C@H]1C[C@H]([NH2+][C@@H]2CCN[C@H](C)C2)c2ccccc21 ZINC000423394085 330200489 /nfs/dbraw/zinc/20/04/89/330200489.db2.gz ZLYSBKLKACQZIM-DTDBQYNISA-N 1 3 272.436 3.601 20 0 CHADHO Cc1nc(C(C)(C)C)sc1[C@H](C)N[C@@H]1CCC[C@H]([NH3+])C1 ZINC000423395101 330200934 /nfs/dbraw/zinc/20/09/34/330200934.db2.gz RRGSBHDTGNMNCM-WCFLWFBJSA-N 1 3 295.496 3.670 20 0 CHADHO C[C@@H](N[C@@H](C)C(c1ccccc1)c1ccccc1)[C@H](C)[NH3+] ZINC000423446105 330202251 /nfs/dbraw/zinc/20/22/51/330202251.db2.gz NUCLVLXZEUMQHG-XHSDSOJGSA-N 1 3 282.431 3.532 20 0 CHADHO C[C@H](CCC[NH3+])N[C@@H](C)c1csc(-c2ccccc2)n1 ZINC000423446306 330202325 /nfs/dbraw/zinc/20/23/25/330202325.db2.gz CMRNIIDZHGQJNH-OLZOCXBDSA-N 1 3 289.448 3.588 20 0 CHADHO CCC[C@H]([NH2+][C@H](C)[C@@H](C)N)c1cccc(C(F)(F)F)c1 ZINC000423451874 330202985 /nfs/dbraw/zinc/20/29/85/330202985.db2.gz VQBVNQTYWMPJNL-GYSYKLTISA-N 1 3 288.357 3.872 20 0 CHADHO C[C@@H](N)[C@@H](C)[NH2+][C@@H](C)c1cccc(OCc2ccccc2)c1 ZINC000423453742 330203208 /nfs/dbraw/zinc/20/32/08/330203208.db2.gz YAFXFTZFAFKZIM-OAGGEKHMSA-N 1 3 298.430 3.652 20 0 CHADHO C[C@H](NC[C@@H]1CCC[C@H]([NH3+])C1)c1ccc(F)cc1Cl ZINC000423455116 330203372 /nfs/dbraw/zinc/20/33/72/330203372.db2.gz DRFFPNCEEMFYJP-LOWVWBTDSA-N 1 3 284.806 3.647 20 0 CHADHO CC[C@@H](N)C[NH2+][C@@H](C)c1sc(-c2ccccc2)nc1C ZINC000423461086 330204056 /nfs/dbraw/zinc/20/40/56/330204056.db2.gz JHQSEJHIKBIDFD-SMDDNHRTSA-N 1 3 289.448 3.506 20 0 CHADHO CC[C@@H](N)C[NH2+][C@H](c1ccc(C(F)(F)F)cc1)C(C)C ZINC000423465184 330204429 /nfs/dbraw/zinc/20/44/29/330204429.db2.gz MOZPEOAPIBQJDC-KGLIPLIRSA-N 1 3 288.357 3.729 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CNCC[C@@H]1c1ccc(F)cc1)C(C)(C)C ZINC000423466687 330204581 /nfs/dbraw/zinc/20/45/81/330204581.db2.gz ITXGDAZIHXKYSW-JLJPHGGASA-N 1 3 292.442 3.543 20 0 CHADHO CC[C@H](N[C@@H](CCC[NH3+])c1ccccc1)c1ccncc1 ZINC000423499048 330208159 /nfs/dbraw/zinc/20/81/59/330208159.db2.gz ADUMSZOYWSDFLP-ROUUACIJSA-N 1 3 283.419 3.603 20 0 CHADHO C[C@H](NCCC[NH2+]C1CC1)c1cccc2ccccc21 ZINC000423529937 330210265 /nfs/dbraw/zinc/21/02/65/330210265.db2.gz QQDZWYXRFCKJFM-AWEZNQCLSA-N 1 3 268.404 3.633 20 0 CHADHO C[C@H]([NH2+]CCCNC1CC1)c1cccc2ccccc21 ZINC000423529937 330210266 /nfs/dbraw/zinc/21/02/66/330210266.db2.gz QQDZWYXRFCKJFM-AWEZNQCLSA-N 1 3 268.404 3.633 20 0 CHADHO C[C@H]([NH2+]CCCNC1CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423547223 330211404 /nfs/dbraw/zinc/21/14/04/330211404.db2.gz FWYBYGSTMUJHMS-WCFLWFBJSA-N 1 3 298.883 3.625 20 0 CHADHO C[C@H](NCCC[NH2+]C1CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423547223 330211405 /nfs/dbraw/zinc/21/14/05/330211405.db2.gz FWYBYGSTMUJHMS-WCFLWFBJSA-N 1 3 298.883 3.625 20 0 CHADHO CCC(F)(F)C(C)(C)C[NH2+][C@H]1CCC[C@@H](N(C)C)C1 ZINC000527670298 330269755 /nfs/dbraw/zinc/26/97/55/330269755.db2.gz NFDIDDDRGPRPKF-QWHCGFSZSA-N 1 3 276.415 3.520 20 0 CHADHO C1[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)[C@@H]1C1CCC1 ZINC000424193668 330324261 /nfs/dbraw/zinc/32/42/61/330324261.db2.gz KSZBXESPOJPSKS-ZWKOTPCHSA-N 1 3 276.468 3.562 20 0 CHADHO C1[C@@H](NC2CC[NH+](C3CCCCC3)CC2)[C@@H]1C1CCC1 ZINC000424193668 330324262 /nfs/dbraw/zinc/32/42/62/330324262.db2.gz KSZBXESPOJPSKS-ZWKOTPCHSA-N 1 3 276.468 3.562 20 0 CHADHO C[C@@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccc2ccccc2c1 ZINC000044535107 330329919 /nfs/dbraw/zinc/32/99/19/330329919.db2.gz GVFPGJWSLLOYAZ-CVEARBPZSA-N 1 3 282.431 3.832 20 0 CHADHO C[C@@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccc2ccccc2c1 ZINC000044535107 330329920 /nfs/dbraw/zinc/32/99/20/330329920.db2.gz GVFPGJWSLLOYAZ-CVEARBPZSA-N 1 3 282.431 3.832 20 0 CHADHO C[NH+](C)CCCN[C@@H](c1ccc(F)cc1)C1CCCC1 ZINC000536962100 330373640 /nfs/dbraw/zinc/37/36/40/330373640.db2.gz ASYBYAXKTNCPJJ-QGZVFWFLSA-N 1 3 278.415 3.598 20 0 CHADHO C[C@H](N[C@H]1CCCC[C@@H]1C[NH3+])c1ccc(Cl)cc1 ZINC000089139923 330380842 /nfs/dbraw/zinc/38/08/42/330380842.db2.gz ZEIQSOPQFAQGOC-LNSITVRQSA-N 1 3 266.816 3.508 20 0 CHADHO C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C2CCCC2)C1 ZINC000120096478 330384371 /nfs/dbraw/zinc/38/43/71/330384371.db2.gz VVGVLJFAHWKENS-HOTGVXAUSA-N 1 3 264.457 3.515 20 0 CHADHO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(C2CCCC2)C1 ZINC000120096478 330384372 /nfs/dbraw/zinc/38/43/72/330384372.db2.gz VVGVLJFAHWKENS-HOTGVXAUSA-N 1 3 264.457 3.515 20 0 CHADHO C[C@H]1CCCCN1C[C@@H]1CCC[N@@H+](C2CCCC2)C1 ZINC000120096478 330384373 /nfs/dbraw/zinc/38/43/73/330384373.db2.gz VVGVLJFAHWKENS-HOTGVXAUSA-N 1 3 264.457 3.515 20 0 CHADHO C[C@H]1CCCCN1C[C@@H]1CCC[N@H+](C2CCCC2)C1 ZINC000120096478 330384374 /nfs/dbraw/zinc/38/43/74/330384374.db2.gz VVGVLJFAHWKENS-HOTGVXAUSA-N 1 3 264.457 3.515 20 0 CHADHO C[C@H](NC1CCC([NH+]2CCC(C)CC2)CC1)c1ccco1 ZINC000090775390 330396000 /nfs/dbraw/zinc/39/60/00/330396000.db2.gz QWQFKYOCSKUZPN-GTPINHCMSA-N 1 3 290.451 3.973 20 0 CHADHO CCC(C)(C)C[NH2+][C@@H](C)c1ccc(OCCN(C)C)cc1 ZINC000429432210 330546363 /nfs/dbraw/zinc/54/63/63/330546363.db2.gz NMODGKDXWGPDJD-HNNXBMFYSA-N 1 3 292.467 3.714 20 0 CHADHO CC1(C)CCC[C@@H]([NH2+]C2CCN(c3ccncc3)CC2)C1 ZINC000149582609 330575729 /nfs/dbraw/zinc/57/57/29/330575729.db2.gz CXSRQRXCPWMDQQ-MRXNPFEDSA-N 1 3 287.451 3.609 20 0 CHADHO CCC[C@@H]1CCC[C@@H]1[NH2+]Cc1cccc(CN(C)C)c1 ZINC000433153837 330618486 /nfs/dbraw/zinc/61/84/86/330618486.db2.gz XRBFDFJZDSYTAQ-MSOLQXFVSA-N 1 3 274.452 3.807 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCC[C@H](N(C)C)C1)c1cc(F)cc(F)c1 ZINC000449177466 330903888 /nfs/dbraw/zinc/90/38/88/330903888.db2.gz VTCSNAQJLAYUJD-DQYPLSBCSA-N 1 3 296.405 3.531 20 0 CHADHO CSc1ccccc1[C@@H](C)[NH2+]CC(C)(C)CN(C)C ZINC000194830430 331062878 /nfs/dbraw/zinc/06/28/78/331062878.db2.gz UYKSCSYWQZBROV-CYBMUJFWSA-N 1 3 280.481 3.647 20 0 CHADHO Cc1cc([C@H](C)[NH2+]C[C@@H]2CCCN(C(C)C)C2)cs1 ZINC000453113599 331090370 /nfs/dbraw/zinc/09/03/70/331090370.db2.gz UMMPEFPTURWKJS-GJZGRUSLSA-N 1 3 280.481 3.828 20 0 CHADHO CC(C)c1nc([C@@H](C)NCCCC[N@H+](C)C2CC2)cs1 ZINC000453409523 331129718 /nfs/dbraw/zinc/12/97/18/331129718.db2.gz UNNUCGHPJOVPOE-CYBMUJFWSA-N 1 3 295.496 3.792 20 0 CHADHO CC(C)c1nc([C@@H](C)NCCCC[N@@H+](C)C2CC2)cs1 ZINC000453409523 331129719 /nfs/dbraw/zinc/12/97/19/331129719.db2.gz UNNUCGHPJOVPOE-CYBMUJFWSA-N 1 3 295.496 3.792 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)o1 ZINC000195131986 331138041 /nfs/dbraw/zinc/13/80/41/331138041.db2.gz KWKDOKUJPGJKNM-AEFFLSMTSA-N 1 3 298.430 3.761 20 0 CHADHO C(C1CCCC1)N1CCC([NH2+][C@H]2CC[C@@H]2C2CCC2)CC1 ZINC000510668660 332910137 /nfs/dbraw/zinc/91/01/37/332910137.db2.gz STWTZKBVZNWGDL-MOPGFXCFSA-N 1 3 290.495 3.809 20 0 CHADHO CCC[NH+]1CCC(N(C)CCc2cccc(Cl)c2)CC1 ZINC000459325891 331276239 /nfs/dbraw/zinc/27/62/39/331276239.db2.gz LYHXODOQLKYNGA-UHFFFAOYSA-N 1 3 294.870 3.689 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)CCc2cccc(Cl)c2)C[C@H]1C ZINC000459385502 331279523 /nfs/dbraw/zinc/27/95/23/331279523.db2.gz YPNDSKUYMQCEET-RHSMWYFYSA-N 1 3 294.870 3.687 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)CCc2cccc(Cl)c2)C[C@H]1C ZINC000459385502 331279524 /nfs/dbraw/zinc/27/95/24/331279524.db2.gz YPNDSKUYMQCEET-RHSMWYFYSA-N 1 3 294.870 3.687 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)[N@@H+]1CCC[C@@H](N(C)C)CC1 ZINC000459418177 331280614 /nfs/dbraw/zinc/28/06/14/331280614.db2.gz FQONOWJDVXALEU-DNVCBOLYSA-N 1 3 286.463 3.652 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)[N@H+]1CCC[C@@H](N(C)C)CC1 ZINC000459418177 331280615 /nfs/dbraw/zinc/28/06/15/331280615.db2.gz FQONOWJDVXALEU-DNVCBOLYSA-N 1 3 286.463 3.652 20 0 CHADHO CC(C)[C@@H](CN[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000166088506 331306678 /nfs/dbraw/zinc/30/66/78/331306678.db2.gz GYWXZQZCHBRBHL-IPMKNSEASA-N 1 3 286.463 3.643 20 0 CHADHO CC(C)[C@@H](CN[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000166088506 331306679 /nfs/dbraw/zinc/30/66/79/331306679.db2.gz GYWXZQZCHBRBHL-IPMKNSEASA-N 1 3 286.463 3.643 20 0 CHADHO CN(CC[C@@H]1CCCC[N@@H+]1C)C[C@@H]1C[C@H]1c1ccccc1 ZINC000463110806 331340610 /nfs/dbraw/zinc/34/06/10/331340610.db2.gz WGXKSFZPMIXDHW-FHWLQOOXSA-N 1 3 286.463 3.596 20 0 CHADHO CN(CC[C@@H]1CCCC[N@H+]1C)C[C@@H]1C[C@H]1c1ccccc1 ZINC000463110806 331340611 /nfs/dbraw/zinc/34/06/11/331340611.db2.gz WGXKSFZPMIXDHW-FHWLQOOXSA-N 1 3 286.463 3.596 20 0 CHADHO CC1(C)[C@H]([NH2+]CCCN2CCCC2)C[C@H]1c1ccccc1 ZINC000463557988 331349486 /nfs/dbraw/zinc/34/94/86/331349486.db2.gz NZQJMYPYBGWCMQ-ZWKOTPCHSA-N 1 3 286.463 3.644 20 0 CHADHO CC1(C)[C@H](NCCC[NH+]2CCCC2)C[C@H]1c1ccccc1 ZINC000463557988 331349487 /nfs/dbraw/zinc/34/94/87/331349487.db2.gz NZQJMYPYBGWCMQ-ZWKOTPCHSA-N 1 3 286.463 3.644 20 0 CHADHO CCC[NH+]1CCC(CNCc2c(F)cccc2CC)CC1 ZINC000474729439 331596371 /nfs/dbraw/zinc/59/63/71/331596371.db2.gz MGPAVNMOQFWKMS-UHFFFAOYSA-N 1 3 292.442 3.600 20 0 CHADHO CCc1cccc(F)c1CNCCC1CC[NH+](CC)CC1 ZINC000474806492 331599771 /nfs/dbraw/zinc/59/97/71/331599771.db2.gz YDVAUABSIVLPBX-UHFFFAOYSA-N 1 3 292.442 3.600 20 0 CHADHO C[C@H]([NH2+]Cc1cccc(CN(C)C)c1)C1CCCCC1 ZINC000474889389 331602899 /nfs/dbraw/zinc/60/28/99/331602899.db2.gz RHEMYZYQUYZVMR-HNNXBMFYSA-N 1 3 274.452 3.807 20 0 CHADHO C[C@@H]1CCC[C@@H](N2CCC([NH2+]CCC3(C)CC3)CC2)C1 ZINC000475207410 331618216 /nfs/dbraw/zinc/61/82/16/331618216.db2.gz AKYLKHKAZIMHGG-NVXWUHKLSA-N 1 3 278.484 3.809 20 0 CHADHO CC1=CCC[C@@H](C)[C@@H]1C[NH2+]C1CCN(CC(C)C)CC1 ZINC000479547326 331736374 /nfs/dbraw/zinc/73/63/74/331736374.db2.gz WUZCMHFMKJAOKZ-SJLPKXTDSA-N 1 3 278.484 3.689 20 0 CHADHO CC(C)[C@H]1C[C@H](NCCC[N@H+](C)C2CCCCC2)CS1 ZINC000488419645 332006061 /nfs/dbraw/zinc/00/60/61/332006061.db2.gz HGALUJJZROOULT-DOTOQJQBSA-N 1 3 298.540 3.761 20 0 CHADHO CC(C)[C@H]1C[C@H](NCCC[N@@H+](C)C2CCCCC2)CS1 ZINC000488419645 332006063 /nfs/dbraw/zinc/00/60/63/332006063.db2.gz HGALUJJZROOULT-DOTOQJQBSA-N 1 3 298.540 3.761 20 0 CHADHO CC(C)C[NH+]1CCC(N[C@H]2CS[C@H](C(C)(C)C)C2)CC1 ZINC000488429054 332007250 /nfs/dbraw/zinc/00/72/50/332007250.db2.gz IJQJISPOGAMWMU-CVEARBPZSA-N 1 3 298.540 3.617 20 0 CHADHO CC(C)(C)[C@H]1C[C@H](NC2CC[NH+](C(C)(C)C)CC2)CS1 ZINC000488456027 332010763 /nfs/dbraw/zinc/01/07/63/332010763.db2.gz FZXBJFTXASWXRX-LSDHHAIUSA-N 1 3 298.540 3.759 20 0 CHADHO C[C@H](CC[NH2+][C@H]1CS[C@@H](C(C)(C)C)C1)N1CCCCC1 ZINC000488562384 332017590 /nfs/dbraw/zinc/01/75/90/332017590.db2.gz SIPFOBHUOZCSPS-BZUAXINKSA-N 1 3 298.540 3.761 20 0 CHADHO C[C@H](CCN[C@H]1CS[C@@H](C(C)(C)C)C1)[NH+]1CCCCC1 ZINC000488562384 332017591 /nfs/dbraw/zinc/01/75/91/332017591.db2.gz SIPFOBHUOZCSPS-BZUAXINKSA-N 1 3 298.540 3.761 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCc1cccc(-c2ccccc2)c1 ZINC000575749205 335111873 /nfs/dbraw/zinc/11/18/73/335111873.db2.gz NIXZPZFJVHWBNH-LSDHHAIUSA-N 1 3 268.404 3.569 20 0 CHADHO C[NH+](C)CCCC1CCN(c2ccnc3ccccc32)CC1 ZINC000499700991 332591856 /nfs/dbraw/zinc/59/18/56/332591856.db2.gz XMTFWTLJGAEAQA-UHFFFAOYSA-N 1 3 297.446 3.793 20 0 CHADHO C[NH+](C)CCCC1CCN(Cc2cccc(Cl)c2)CC1 ZINC000501770335 332640505 /nfs/dbraw/zinc/64/05/05/332640505.db2.gz OJETVYKOYIZKIM-UHFFFAOYSA-N 1 3 294.870 3.894 20 0 CHADHO CC(C)CSCCNC1CC[NH+](C2CCCCC2)CC1 ZINC000513468684 333021606 /nfs/dbraw/zinc/02/16/06/333021606.db2.gz JCXRNAKPVHSRPJ-UHFFFAOYSA-N 1 3 298.540 3.762 20 0 CHADHO CC(C)CSCC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000513468684 333021607 /nfs/dbraw/zinc/02/16/07/333021607.db2.gz JCXRNAKPVHSRPJ-UHFFFAOYSA-N 1 3 298.540 3.762 20 0 CHADHO c1ccc(CN2C[C@@H]3CCCC[C@H]([NH2+]C4CCC4)[C@@H]3C2)cc1 ZINC000513656744 333029926 /nfs/dbraw/zinc/02/99/26/333029926.db2.gz XBWNRRMEQNUSPT-SXLOBPIMSA-N 1 3 298.474 3.819 20 0 CHADHO CN1CCC(C[N@H+](C)Cc2ccc(C(C)(C)C)s2)CC1 ZINC000513723885 333035743 /nfs/dbraw/zinc/03/57/43/333035743.db2.gz BOOWHFGSQUHGGZ-UHFFFAOYSA-N 1 3 294.508 3.819 20 0 CHADHO CN1CCC(C[N@@H+](C)Cc2ccc(C(C)(C)C)s2)CC1 ZINC000513723885 333035744 /nfs/dbraw/zinc/03/57/44/333035744.db2.gz BOOWHFGSQUHGGZ-UHFFFAOYSA-N 1 3 294.508 3.819 20 0 CHADHO CC(C)(CN[C@@H]1C[C@H]([NH3+])c2ccccc21)C1=CCCC1 ZINC000308771319 333038559 /nfs/dbraw/zinc/03/85/59/333038559.db2.gz SSMDDBHCTHQBNU-DLBZAZTESA-N 1 3 270.420 3.857 20 0 CHADHO CC(C)(C)C[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000309887801 333051057 /nfs/dbraw/zinc/05/10/57/333051057.db2.gz AEGLPDWWRKNWED-SFHVURJKSA-N 1 3 288.479 3.924 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1)C1CC1 ZINC000310019496 333052957 /nfs/dbraw/zinc/05/29/57/333052957.db2.gz QLXWCOULYWROTP-FUHWJXTLSA-N 1 3 286.463 3.677 20 0 CHADHO C[C@H](C[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccccc1)CN1CCCC1 ZINC000516880648 333085016 /nfs/dbraw/zinc/08/50/16/333085016.db2.gz ZFHMTRYCNYZVBT-FPAYPSAMSA-N 1 3 286.463 3.500 20 0 CHADHO C[C@H]([NH2+][C@H]1CCCC[C@H]1C)[C@@H]1CCCN(C2CCC2)C1 ZINC000183185342 333119360 /nfs/dbraw/zinc/11/93/60/333119360.db2.gz KHTIQUILXCCIQQ-HPFXQQBRSA-N 1 3 278.484 3.808 20 0 CHADHO Cc1cccc2c1ncc(C)c2N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000185333342 333138659 /nfs/dbraw/zinc/13/86/59/333138659.db2.gz DPPMUWYZKAXLQM-CVEARBPZSA-N 1 3 295.430 3.525 20 0 CHADHO Cc1cccc2c1ncc(C)c2N1CC[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000185333342 333138660 /nfs/dbraw/zinc/13/86/60/333138660.db2.gz DPPMUWYZKAXLQM-CVEARBPZSA-N 1 3 295.430 3.525 20 0 CHADHO C[C@H](CCC1CC1)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000186371569 333159599 /nfs/dbraw/zinc/15/95/99/333159599.db2.gz NDICNVGFKCFJPK-OAHLLOKOSA-N 1 3 278.484 3.952 20 0 CHADHO C[C@H](NCCCC[NH+](C)C)c1cccc(Cl)c1Cl ZINC000222903288 333201926 /nfs/dbraw/zinc/20/19/26/333201926.db2.gz IMSKZATWHMJJIS-NSHDSACASA-N 1 3 289.250 3.986 20 0 CHADHO CC[NH+]1CCC(CCNCc2sccc2Cl)CC1 ZINC000193127667 333243293 /nfs/dbraw/zinc/24/32/93/333243293.db2.gz ZPZGRGIQAQVFLV-UHFFFAOYSA-N 1 3 286.872 3.613 20 0 CHADHO C[C@H](c1ccc(F)cc1)N1CCC(C[NH+]2CCCC2)CC1 ZINC000194737755 333276798 /nfs/dbraw/zinc/27/67/98/333276798.db2.gz AEXFGDBLCATLRD-OAHLLOKOSA-N 1 3 290.426 3.695 20 0 CHADHO CC(C)C(C[NH2+]C1CCN(c2ccncc2)CC1)C(C)C ZINC000229535610 333305914 /nfs/dbraw/zinc/30/59/14/333305914.db2.gz CTPMQRMYGCPAHF-UHFFFAOYSA-N 1 3 289.467 3.568 20 0 CHADHO CC1=C[C@H](C)C[C@H](C[NH2+]C2CCN(C(C)(C)C)CC2)C1 ZINC000235371625 333368754 /nfs/dbraw/zinc/36/87/54/333368754.db2.gz UXSGJARHUHTGEU-HOCLYGCPSA-N 1 3 278.484 3.831 20 0 CHADHO CC1=C[C@@H](C)C[C@@H](C[NH2+]C2CC(C)(C)NC(C)(C)C2)C1 ZINC000235700083 333371521 /nfs/dbraw/zinc/37/15/21/333371521.db2.gz KBIZBMLAIHHBHM-UKRRQHHQSA-N 1 3 278.484 3.878 20 0 CHADHO C[C@H](NCc1ccc(C[NH3+])cc1)c1ccc(Cl)cc1 ZINC000564212040 333638430 /nfs/dbraw/zinc/63/84/30/333638430.db2.gz OXOPJNBQNUCSCN-LBPRGKRZSA-N 1 3 274.795 3.650 20 0 CHADHO CCCC[C@H](CC)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000069371140 333757893 /nfs/dbraw/zinc/75/78/93/333757893.db2.gz HRTYNYVUTKZDSH-ZDUSSCGKSA-N 1 3 254.462 3.854 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CC(C)(C)C1=CCCC1 ZINC000576146631 335160190 /nfs/dbraw/zinc/16/01/90/335160190.db2.gz ZQCVARUZHPVWHV-CYBMUJFWSA-N 1 3 287.451 3.636 20 0 CHADHO C[C@H](CCc1ccc(Cl)s1)[NH2+]CC1=CCN(C)CC1 ZINC000546656485 334044041 /nfs/dbraw/zinc/04/40/41/334044041.db2.gz PXTWAUCSWWITHM-GFCCVEGCSA-N 1 3 298.883 3.574 20 0 CHADHO C[C@@H](Cc1ccccc1F)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000134111046 334080774 /nfs/dbraw/zinc/08/07/74/334080774.db2.gz WYAQHKXYSNOXGA-ZDUSSCGKSA-N 1 3 292.442 3.656 20 0 CHADHO C[C@@H](Cc1ccccc1F)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000134111046 334080775 /nfs/dbraw/zinc/08/07/75/334080775.db2.gz WYAQHKXYSNOXGA-ZDUSSCGKSA-N 1 3 292.442 3.656 20 0 CHADHO CCCC[N@H+](C)CC1CCN(Cc2ccc(C)o2)CC1 ZINC000134154867 334082254 /nfs/dbraw/zinc/08/22/54/334082254.db2.gz WIARQDOXJMMCLP-UHFFFAOYSA-N 1 3 278.440 3.532 20 0 CHADHO CCCC[N@@H+](C)CC1CCN(Cc2ccc(C)o2)CC1 ZINC000134154867 334082255 /nfs/dbraw/zinc/08/22/55/334082255.db2.gz WIARQDOXJMMCLP-UHFFFAOYSA-N 1 3 278.440 3.532 20 0 CHADHO CC1(C)CCC[C@@H]([NH2+]C2CC(C)(C)NC(C)(C)C2)C1 ZINC000079971882 334164690 /nfs/dbraw/zinc/16/46/90/334164690.db2.gz XMSUEQIOGNPCRH-CYBMUJFWSA-N 1 3 266.473 3.854 20 0 CHADHO CC(C)CC[C@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)C1CC1 ZINC000549228201 334188239 /nfs/dbraw/zinc/18/82/39/334188239.db2.gz HMCGCEVBCWIFBT-AEFFLSMTSA-N 1 3 280.500 3.911 20 0 CHADHO C[C@@H](NCCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccco1 ZINC000246923569 334271741 /nfs/dbraw/zinc/27/17/41/334271741.db2.gz GVJLQFNZAACCHF-BZUAXINKSA-N 1 3 278.440 3.688 20 0 CHADHO C1CC(C([NH2+]C2CCN(C3CCCC3)CC2)C2CCC2)C1 ZINC000549614668 334199766 /nfs/dbraw/zinc/19/97/66/334199766.db2.gz VLDRMNNNYNWOKA-UHFFFAOYSA-N 1 3 290.495 3.952 20 0 CHADHO CC1(C)CC([NH2+][C@H]2CCC[C@@H](C3CC3)C2)CC(C)(C)N1 ZINC000081625781 334200953 /nfs/dbraw/zinc/20/09/53/334200953.db2.gz KDLQVGYITWPBDT-CABCVRRESA-N 1 3 278.484 3.854 20 0 CHADHO C[C@@H]1CN(CC[C@@H]2CCC[N@@H+]2C)CC[C@H]1c1ccccc1 ZINC000245688339 334212698 /nfs/dbraw/zinc/21/26/98/334212698.db2.gz PYKGCJGKGOSFAL-NZSAHSFTSA-N 1 3 286.463 3.596 20 0 CHADHO C[C@@H]1CN(CC[C@@H]2CCC[N@H+]2C)CC[C@H]1c1ccccc1 ZINC000245688339 334212700 /nfs/dbraw/zinc/21/27/00/334212700.db2.gz PYKGCJGKGOSFAL-NZSAHSFTSA-N 1 3 286.463 3.596 20 0 CHADHO C[C@@H](NCCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccoc1 ZINC000246993573 334273548 /nfs/dbraw/zinc/27/35/48/334273548.db2.gz KJCQGVYRYRLZBK-BZUAXINKSA-N 1 3 278.440 3.688 20 0 CHADHO CC(C)C1([NH2+]C2CCN([C@@H]3CCC[C@H](C)C3)CC2)CC1 ZINC000551263336 334243353 /nfs/dbraw/zinc/24/33/53/334243353.db2.gz PWPVXRDJNVZETL-DOTOQJQBSA-N 1 3 278.484 3.808 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H](C)c2ccc(F)cc2)C1 ZINC000247116048 334275878 /nfs/dbraw/zinc/27/58/78/334275878.db2.gz UFIIKVQODBVLKB-CABCVRRESA-N 1 3 278.415 3.597 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)N1CC[C@@H](C[NH+](C)C)C1 ZINC000246457481 334258568 /nfs/dbraw/zinc/25/85/68/334258568.db2.gz YMMMAXTWDBFZJV-CVEARBPZSA-N 1 3 282.431 3.784 20 0 CHADHO C[C@H]([NH2+][C@H]1CCCC[C@H]1C)[C@H]1CCCN(C2CCC2)C1 ZINC000248399811 334300239 /nfs/dbraw/zinc/30/02/39/334300239.db2.gz KHTIQUILXCCIQQ-CVYDXHPNSA-N 1 3 278.484 3.808 20 0 CHADHO CC(C)c1ccc(CN[C@@H]2CC[N@H+](C)[C@H]3CCC[C@@H]32)cc1 ZINC000552247723 334308112 /nfs/dbraw/zinc/30/81/12/334308112.db2.gz YGDQLFSZYRNRKZ-QRVBRYPASA-N 1 3 286.463 3.772 20 0 CHADHO CC(C)c1ccc(CN[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@@H]32)cc1 ZINC000552247723 334308113 /nfs/dbraw/zinc/30/81/13/334308113.db2.gz YGDQLFSZYRNRKZ-QRVBRYPASA-N 1 3 286.463 3.772 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN(CC[C@H](C)c2ccccc2)C1 ZINC000248883082 334320748 /nfs/dbraw/zinc/32/07/48/334320748.db2.gz LGAADYDXDSBSLC-ROUUACIJSA-N 1 3 288.479 3.844 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN(CC[C@H](C)c2ccccc2)C1 ZINC000248883082 334320749 /nfs/dbraw/zinc/32/07/49/334320749.db2.gz LGAADYDXDSBSLC-ROUUACIJSA-N 1 3 288.479 3.844 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+](CC[C@H](C)c2ccccc2)C1 ZINC000248883082 334320750 /nfs/dbraw/zinc/32/07/50/334320750.db2.gz LGAADYDXDSBSLC-ROUUACIJSA-N 1 3 288.479 3.844 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+](CC[C@H](C)c2ccccc2)C1 ZINC000248883082 334320751 /nfs/dbraw/zinc/32/07/51/334320751.db2.gz LGAADYDXDSBSLC-ROUUACIJSA-N 1 3 288.479 3.844 20 0 CHADHO Cc1ccc([C@H](N[C@H]2CC[N@@H+]3CCC[C@H]3C2)C2CC2)cc1 ZINC000251509585 334362585 /nfs/dbraw/zinc/36/25/85/334362585.db2.gz ZIGFLVWAWFEWRG-FHWLQOOXSA-N 1 3 284.447 3.663 20 0 CHADHO Cc1ccc([C@H](N[C@H]2CC[N@H+]3CCC[C@H]3C2)C2CC2)cc1 ZINC000251509585 334362586 /nfs/dbraw/zinc/36/25/86/334362586.db2.gz ZIGFLVWAWFEWRG-FHWLQOOXSA-N 1 3 284.447 3.663 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+][C@H]1CCc2ccccc21 ZINC000251574164 334364634 /nfs/dbraw/zinc/36/46/34/334364634.db2.gz AULFMTJKMCQIKL-QAPCUYQASA-N 1 3 272.436 3.528 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@H]1CC[C@H](C)c2ccccc21 ZINC000251589003 334365062 /nfs/dbraw/zinc/36/50/62/334365062.db2.gz CGADDBONSWXZFN-VBQJREDUSA-N 1 3 260.425 3.555 20 0 CHADHO CSc1ccc([C@H](C)N[C@@H]2CCCC[C@H]2C[NH3+])cc1 ZINC000251781736 334369468 /nfs/dbraw/zinc/36/94/68/334369468.db2.gz SWKWEWISECVSHX-DUVNUKRYSA-N 1 3 278.465 3.577 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H]2CCCC[C@@H]2c2ccccc2)C1 ZINC000252438604 334379942 /nfs/dbraw/zinc/37/99/42/334379942.db2.gz DPTKTCXLTPRJLI-QRQLOZEOSA-N 1 3 286.463 3.644 20 0 CHADHO CC(C)[C@H]1CC[C@H]1[NH2+]C1CCN(CC2CCCC2)CC1 ZINC000572906778 334890202 /nfs/dbraw/zinc/89/02/02/334890202.db2.gz IYZYRGDGCWOPPJ-QZTJIDSGSA-N 1 3 278.484 3.665 20 0 CHADHO CC1=C[C@H](C)C[C@@H](C[N@@H+]2CC[C@@H](C3CCN(C)CC3)C2)C1 ZINC000576438598 335203617 /nfs/dbraw/zinc/20/36/17/335203617.db2.gz RZEAGSXFMMUSNS-KVSKMBFKSA-N 1 3 290.495 3.643 20 0 CHADHO CC1=C[C@H](C)C[C@@H](C[N@H+]2CC[C@@H](C3CCN(C)CC3)C2)C1 ZINC000576438598 335203619 /nfs/dbraw/zinc/20/36/19/335203619.db2.gz RZEAGSXFMMUSNS-KVSKMBFKSA-N 1 3 290.495 3.643 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3N[C@H](C)CC[NH+](C)C ZINC000580672818 335320391 /nfs/dbraw/zinc/32/03/91/335320391.db2.gz OTPHRRANBUXWRA-KDOFPFPSSA-N 1 3 299.462 3.784 20 0 CHADHO C[NH+]1CCC([C@H]2CCN(Cc3ccc(Cl)cc3)C2)CC1 ZINC000577196779 335320856 /nfs/dbraw/zinc/32/08/56/335320856.db2.gz QAQLQLLJHRSDRV-INIZCTEOSA-N 1 3 292.854 3.504 20 0 CHADHO C[C@@H](N)C[C@@H](C)[NH2+]CC1(c2ccccc2)CCCCC1 ZINC000577499441 335360009 /nfs/dbraw/zinc/36/00/09/335360009.db2.gz JSNZGHXRYNNNGR-HZPDHXFCSA-N 1 3 274.452 3.604 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCC1(c2ccccc2)CCCCC1 ZINC000577499441 335360011 /nfs/dbraw/zinc/36/00/11/335360011.db2.gz JSNZGHXRYNNNGR-HZPDHXFCSA-N 1 3 274.452 3.604 20 0 CHADHO Cc1ccc2nccc(N3CCC([NH2+]C(C)C)CC3)c2c1 ZINC000185616388 335954205 /nfs/dbraw/zinc/95/42/05/335954205.db2.gz BHFJCNSZWGAETF-UHFFFAOYSA-N 1 3 283.419 3.510 20 0 CHADHO CC[C@H](C)N1CCCC2(CCC[N@@H+]([C@@H](C)CC)C2)C1 ZINC000581280374 336036183 /nfs/dbraw/zinc/03/61/83/336036183.db2.gz AFPWMKHIULPSAB-PYNWJHIZSA-N 1 3 266.473 3.761 20 0 CHADHO CC[C@H](C)N1CCCC2(CCC[N@H+]([C@@H](C)CC)C2)C1 ZINC000581280374 336036185 /nfs/dbraw/zinc/03/61/85/336036185.db2.gz AFPWMKHIULPSAB-PYNWJHIZSA-N 1 3 266.473 3.761 20 0 CHADHO CC[C@@H](C)N1CCC[C@@]2(CCC[N@@H+]([C@@H](C)CC)C2)C1 ZINC000581280372 336036198 /nfs/dbraw/zinc/03/61/98/336036198.db2.gz AFPWMKHIULPSAB-IXDOHACOSA-N 1 3 266.473 3.761 20 0 CHADHO CC[C@@H](C)N1CCC[C@@]2(CCC[N@H+]([C@@H](C)CC)C2)C1 ZINC000581280372 336036200 /nfs/dbraw/zinc/03/62/00/336036200.db2.gz AFPWMKHIULPSAB-IXDOHACOSA-N 1 3 266.473 3.761 20 0 CHADHO CC[C@@H](C)[N@@H+]1CCC[C@@]2(CCCN([C@@H](C)CC)C2)C1 ZINC000581280372 336036202 /nfs/dbraw/zinc/03/62/02/336036202.db2.gz AFPWMKHIULPSAB-IXDOHACOSA-N 1 3 266.473 3.761 20 0 CHADHO CC[C@@H](C)[N@H+]1CCC[C@@]2(CCCN([C@@H](C)CC)C2)C1 ZINC000581280372 336036204 /nfs/dbraw/zinc/03/62/04/336036204.db2.gz AFPWMKHIULPSAB-IXDOHACOSA-N 1 3 266.473 3.761 20 0 CHADHO Cc1cc([C@H](C)[NH2+]C[C@H](C)CN2CCCCC2)cs1 ZINC000381358970 336060304 /nfs/dbraw/zinc/06/03/04/336060304.db2.gz JVQQHNWSMZDFAK-ZFWWWQNUSA-N 1 3 280.481 3.829 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]C(C2CCC2)C2CCC2)C1 ZINC000581417330 336073304 /nfs/dbraw/zinc/07/33/04/336073304.db2.gz WCQGICOSRHFUCL-OAHLLOKOSA-N 1 3 278.484 3.665 20 0 CHADHO c1cc2cc(C[NH2+]C3CCN(C4CCCC4)CC3)ccc2[nH]1 ZINC000581736132 336140369 /nfs/dbraw/zinc/14/03/69/336140369.db2.gz MKJDVMBXTMOUTP-UHFFFAOYSA-N 1 3 297.446 3.665 20 0 CHADHO CSCC1CCC([NH2+]C[C@@H](C)CN2CCCCC2)CC1 ZINC000385648490 336153236 /nfs/dbraw/zinc/15/32/36/336153236.db2.gz JLPZJJOCCKBSER-KLAILNCOSA-N 1 3 298.540 3.620 20 0 CHADHO CC(C)(C)N1CCC([NH2+][C@H]2CCc3c2cccc3F)CC1 ZINC000211860216 518707596 /nfs/dbraw/zinc/70/75/96/518707596.db2.gz DOLCYLVLARCIGH-KRWDZBQOSA-N 1 3 290.426 3.666 20 0 CHADHO CC(C)(C)[C@H](N[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000127866391 518967677 /nfs/dbraw/zinc/96/76/77/518967677.db2.gz LXFPMWHMQPAMNU-RCCFBDPRSA-N 1 3 286.463 3.990 20 0 CHADHO CC(C)(C)[C@H](N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000127866391 518967680 /nfs/dbraw/zinc/96/76/80/518967680.db2.gz LXFPMWHMQPAMNU-RCCFBDPRSA-N 1 3 286.463 3.990 20 0 CHADHO CC(C)N1CCC([N@H+](C)Cc2cnc3ccccc3c2)CC1 ZINC000337126368 519670180 /nfs/dbraw/zinc/67/01/80/519670180.db2.gz FXIMORDEHOBICQ-UHFFFAOYSA-N 1 3 297.446 3.539 20 0 CHADHO CC(C)N1CCC([N@@H+](C)Cc2cnc3ccccc3c2)CC1 ZINC000337126368 519670183 /nfs/dbraw/zinc/67/01/83/519670183.db2.gz FXIMORDEHOBICQ-UHFFFAOYSA-N 1 3 297.446 3.539 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H](C)c2cccc(F)c2)C1 ZINC000125944667 519676852 /nfs/dbraw/zinc/67/68/52/519676852.db2.gz DAAMAGIQCOKUIR-GJZGRUSLSA-N 1 3 278.415 3.597 20 0 CHADHO C[NH2+]C[C@H]1CCCN([C@H](C)c2ccc3ccccc3c2)C1 ZINC000040592689 522085262 /nfs/dbraw/zinc/08/52/62/522085262.db2.gz HUMWSHVFQIWHNJ-HZPDHXFCSA-N 1 3 282.431 3.832 20 0 CHADHO CN(CCCCC[N@H+](C)Cc1ccoc1)Cc1ccoc1 ZINC000354241434 522726509 /nfs/dbraw/zinc/72/65/09/522726509.db2.gz SZLGCECUFWXVSU-UHFFFAOYSA-N 1 3 290.407 3.607 20 0 CHADHO CN(CCCCC[N@@H+](C)Cc1ccoc1)Cc1ccoc1 ZINC000354241434 522726515 /nfs/dbraw/zinc/72/65/15/522726515.db2.gz SZLGCECUFWXVSU-UHFFFAOYSA-N 1 3 290.407 3.607 20 0 CHADHO CC[C@@H](NCC1CC[NH+](C)CC1)c1cccc(Cl)c1F ZINC000161670800 522821609 /nfs/dbraw/zinc/82/16/09/522821609.db2.gz HZYHFIOLSMWUIA-OAHLLOKOSA-N 1 3 298.833 3.862 20 0 CHADHO CC[C@@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(C)cc1 ZINC000037649154 522867559 /nfs/dbraw/zinc/86/75/59/522867559.db2.gz FCBQOFFGWZJELH-CRAIPNDOSA-N 1 3 272.436 3.520 20 0 CHADHO CC[C@@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc(C)cc1 ZINC000037649154 522867564 /nfs/dbraw/zinc/86/75/64/522867564.db2.gz FCBQOFFGWZJELH-CRAIPNDOSA-N 1 3 272.436 3.520 20 0 CHADHO C[C@H](CCN(C)C)[NH2+][C@@H]1C[C@H](C)Sc2sccc21 ZINC000130479181 524167980 /nfs/dbraw/zinc/16/79/80/524167980.db2.gz YUKUVOMLLIZUBX-NTZNESFSSA-N 1 3 284.494 3.603 20 0 CHADHO C[C@H]([NH2+]CCCN1CCCCC1)c1nccc2ccccc21 ZINC000289581629 525336968 /nfs/dbraw/zinc/33/69/68/525336968.db2.gz DVETYOJXNWBQOM-INIZCTEOSA-N 1 3 297.446 3.761 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCN(C(C)C)C2)s1 ZINC000125724952 525729465 /nfs/dbraw/zinc/72/94/65/525729465.db2.gz MAPPAFRONWLPDY-CABCVRRESA-N 1 3 280.481 3.828 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCN(C(C)C)C2)s1 ZINC000125725184 525923310 /nfs/dbraw/zinc/92/33/10/525923310.db2.gz MAPPAFRONWLPDY-GJZGRUSLSA-N 1 3 280.481 3.828 20 0 CHADHO C[C@H](c1ccc(C(C)(C)C)cc1)N1CCC[C@H](C[NH3+])C1 ZINC000044527693 526043785 /nfs/dbraw/zinc/04/37/85/526043785.db2.gz OVUOBCBANDDYFV-HUUCEWRRSA-N 1 3 274.452 3.716 20 0 CHADHO C[C@@H](c1ccc2ccccc2c1)N1CCC[C@H](C[NH3+])C1 ZINC000044527623 526066046 /nfs/dbraw/zinc/06/60/46/526066046.db2.gz BUYASQPRJLQELC-LSDHHAIUSA-N 1 3 268.404 3.572 20 0 CHADHO CCN1CC[C@@H]([N@H+](C)Cc2ccc3ccccc3n2)C[C@H]1C ZINC000353749437 527755118 /nfs/dbraw/zinc/75/51/18/527755118.db2.gz KYYQWUJWBFSMNV-CRAIPNDOSA-N 1 3 297.446 3.539 20 0 CHADHO CCN1CC[C@@H]([N@@H+](C)Cc2ccc3ccccc3n2)C[C@H]1C ZINC000353749437 527755119 /nfs/dbraw/zinc/75/51/19/527755119.db2.gz KYYQWUJWBFSMNV-CRAIPNDOSA-N 1 3 297.446 3.539 20 0 CHADHO CC(C)CC[C@@H]([NH2+]CC(C)(C)CN(C)C)c1ccoc1 ZINC000353441480 527808648 /nfs/dbraw/zinc/80/86/48/527808648.db2.gz MVVOXAMUILNRBK-MRXNPFEDSA-N 1 3 280.456 3.934 20 0 CHADHO CC1CCN(CCC[NH2+]Cc2ccc3occc3c2)CC1 ZINC000352241083 528241771 /nfs/dbraw/zinc/24/17/71/528241771.db2.gz KAGNUPRXRHQWHL-UHFFFAOYSA-N 1 3 286.419 3.644 20 0 CHADHO C[C@H](N[C@@H]1CCC[NH2+]CC1)c1cccc2ccccc21 ZINC000133579922 1125475868 /nfs/dbraw/zinc/47/58/68/1125475868.db2.gz NMVUHZHQIPSGTL-GOEBONIOSA-N 1 3 268.404 3.633 20 0 CHADHO CC(C)CC[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)C1CC1 ZINC000624123104 1117985359 /nfs/dbraw/zinc/98/53/59/1117985359.db2.gz FYUIYBBVKRODKJ-DOTOQJQBSA-N 1 3 266.473 3.523 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccsc1 ZINC000624123554 1117987127 /nfs/dbraw/zinc/98/71/27/1117987127.db2.gz NZNWQVHZNACVSP-DZGCQCFKSA-N 1 3 266.454 3.521 20 0 CHADHO CC[C@@H](CSC)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000580227158 1118405228 /nfs/dbraw/zinc/40/52/28/1118405228.db2.gz SLTFDGXZBMIRSA-AWEZNQCLSA-N 1 3 284.513 3.515 20 0 CHADHO CC[C@H]([NH2+]CC[C@H]1CCCN1C)c1ccc(Cl)cc1 ZINC000341215227 1118624512 /nfs/dbraw/zinc/62/45/12/1118624512.db2.gz DVAHKMPLQIFBPS-CVEARBPZSA-N 1 3 280.843 3.865 20 0 CHADHO C[NH+](C)C[C@H]1CCN(C2c3ccccc3-c3ccccc32)C1 ZINC000114198574 1125496607 /nfs/dbraw/zinc/49/66/07/1125496607.db2.gz ZUVDZLSLUAGAJY-OAHLLOKOSA-N 1 3 292.426 3.640 20 0 CHADHO CC1=CCC[C@@H](C)[C@H]1C[NH2+]CCCN1CCC(C)CC1 ZINC001199012817 1123018734 /nfs/dbraw/zinc/01/87/34/1123018734.db2.gz GLZKLCPNQVNDLO-MSOLQXFVSA-N 1 3 278.484 3.690 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC[C@@]2(C)C[C@@]2(F)Cl)CC1 ZINC000846031392 1131680379 /nfs/dbraw/zinc/68/03/79/1131680379.db2.gz IHESFVRNRRFLJJ-GJZGRUSLSA-N 1 3 290.854 3.544 20 0 CHADHO CCC[C@@H]1CCCC[N@@H+]1[C@@H]1CCN[C@H](C(C)(C)C)C1 ZINC001246787670 1131782434 /nfs/dbraw/zinc/78/24/34/1131782434.db2.gz FEJFKCBIBBEIJE-OAGGEKHMSA-N 1 3 266.473 3.808 20 0 CHADHO CCC[C@@H]1CCCC[N@H+]1[C@@H]1CCN[C@H](C(C)(C)C)C1 ZINC001246787670 1131782438 /nfs/dbraw/zinc/78/24/38/1131782438.db2.gz FEJFKCBIBBEIJE-OAGGEKHMSA-N 1 3 266.473 3.808 20 0 CHADHO C[C@@H]1C[C@@H](C)C[NH+](C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001171639970 1132081475 /nfs/dbraw/zinc/08/14/75/1132081475.db2.gz XEZFYPRLIUSCMQ-ZIAGYGMSSA-N 1 3 266.473 3.616 20 0 CHADHO CN(C)CC1(C[N@H+](C)Cc2ccc(Cl)cc2)CCCC1 ZINC001208191015 1133902616 /nfs/dbraw/zinc/90/26/16/1133902616.db2.gz JTSKVOBZSODMJT-UHFFFAOYSA-N 1 3 294.870 3.894 20 0 CHADHO CN(C)CC1(C[N@@H+](C)Cc2ccc(Cl)cc2)CCCC1 ZINC001208191015 1133902621 /nfs/dbraw/zinc/90/26/21/1133902621.db2.gz JTSKVOBZSODMJT-UHFFFAOYSA-N 1 3 294.870 3.894 20 0 CHADHO CCCCCCN1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000134872181 1125567517 /nfs/dbraw/zinc/56/75/17/1125567517.db2.gz OKYYRLXRPXQXIA-WBVHZDCISA-N 1 3 264.457 3.515 20 0 CHADHO CCCCCCN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134872181 1125567521 /nfs/dbraw/zinc/56/75/21/1125567521.db2.gz OKYYRLXRPXQXIA-WBVHZDCISA-N 1 3 264.457 3.515 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](C)c2ccc(SC)c(F)c2)C1 ZINC000247106790 1125655088 /nfs/dbraw/zinc/65/50/88/1125655088.db2.gz QGJOWYCIVHVYIH-CHWSQXEVSA-N 1 3 296.455 3.540 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H]2C[C@@H](c3ccccc3)C2(C)C)C1 ZINC000248634469 1125672898 /nfs/dbraw/zinc/67/28/98/1125672898.db2.gz JLWZNUVIVOXXOD-BPQIPLTHSA-N 1 3 286.463 3.500 20 0 CHADHO CCC1(N2CCC2)CC[NH+](CCCSC(C)(C)C)CC1 ZINC000886720285 1125713684 /nfs/dbraw/zinc/71/36/84/1125713684.db2.gz YMTOQOIWUNQOTE-UHFFFAOYSA-N 1 3 298.540 3.859 20 0 CHADHO CCc1ccc([C@H](N[C@H]2CC[NH2+]C[C@H]2C)C(C)C)cc1 ZINC000261734474 1125741150 /nfs/dbraw/zinc/74/11/50/1125741150.db2.gz LKSXSNNRUOBIRR-FHLIZLRMSA-N 1 3 274.452 3.534 20 0 CHADHO CCc1ccc([C@H]([NH2+][C@H]2CCNC[C@H]2C)C(C)C)cc1 ZINC000261734474 1125741154 /nfs/dbraw/zinc/74/11/54/1125741154.db2.gz LKSXSNNRUOBIRR-FHLIZLRMSA-N 1 3 274.452 3.534 20 0 CHADHO Cc1ccccc1[C@H](C(C)C)N(C)C[C@]1(C)CC[NH2+]C1 ZINC000261994346 1125749527 /nfs/dbraw/zinc/74/95/27/1125749527.db2.gz KPJNOLFIMGJWAZ-ZWKOTPCHSA-N 1 3 274.452 3.624 20 0 CHADHO C[C@@H](N[C@H]1C[C@H](C[NH3+])C1)c1cc(F)c(Cl)cc1Cl ZINC000902488315 1130016674 /nfs/dbraw/zinc/01/66/74/1130016674.db2.gz LMOLQQZJPORTIM-IWSPIJDZSA-N 1 3 291.197 3.520 20 0 CHADHO CCCC[C@H](CC)N[C@H](CC[NH+](C)C)c1cccnc1 ZINC000903383779 1130169142 /nfs/dbraw/zinc/16/91/42/1130169142.db2.gz OOOBHUQYIDKCFU-DLBZAZTESA-N 1 3 277.456 3.633 20 0 CHADHO CCCc1cccc(CN2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)c1 ZINC000482006574 1126738453 /nfs/dbraw/zinc/73/84/53/1126738453.db2.gz MFTLANPKNGFUEB-OALUTQOASA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1cccc(CN2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c1 ZINC000482006574 1126738455 /nfs/dbraw/zinc/73/84/55/1126738455.db2.gz MFTLANPKNGFUEB-OALUTQOASA-N 1 3 286.463 3.555 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H]2CCc3c2cccc3F)C1 ZINC000482358669 1126751996 /nfs/dbraw/zinc/75/19/96/1126751996.db2.gz OTNVLTJEAUEFAU-RDTXWAMCSA-N 1 3 290.426 3.523 20 0 CHADHO C[NH+](C)CC[C@H](N[C@@H]1CCc2cc(F)ccc21)C(C)(C)C ZINC000483175389 1126771161 /nfs/dbraw/zinc/77/11/61/1126771161.db2.gz ICWCYXJIJZJTIS-SJORKVTESA-N 1 3 292.442 3.769 20 0 CHADHO CC[NH+](CC)C[C@@H]1CCN(CCCC2CCCC2)C1 ZINC000483210024 1126772861 /nfs/dbraw/zinc/77/28/61/1126772861.db2.gz CNZOLUJHITXPNH-KRWDZBQOSA-N 1 3 266.473 3.621 20 0 CHADHO CCN(C)C[C@@H]1CC[N@H+](Cc2c(C)ccc3ccccc32)C1 ZINC000483216789 1126772882 /nfs/dbraw/zinc/77/28/82/1126772882.db2.gz BLXKLPUPTRKGCV-KRWDZBQOSA-N 1 3 296.458 3.922 20 0 CHADHO CCN(C)C[C@@H]1CC[N@@H+](Cc2c(C)ccc3ccccc32)C1 ZINC000483216789 1126772886 /nfs/dbraw/zinc/77/28/86/1126772886.db2.gz BLXKLPUPTRKGCV-KRWDZBQOSA-N 1 3 296.458 3.922 20 0 CHADHO CC[N@H+](C)C[C@@H]1CCN(Cc2c(C)ccc3ccccc32)C1 ZINC000483216789 1126772889 /nfs/dbraw/zinc/77/28/89/1126772889.db2.gz BLXKLPUPTRKGCV-KRWDZBQOSA-N 1 3 296.458 3.922 20 0 CHADHO CC[N@@H+](C)C[C@@H]1CCN(Cc2c(C)ccc3ccccc32)C1 ZINC000483216789 1126772891 /nfs/dbraw/zinc/77/28/91/1126772891.db2.gz BLXKLPUPTRKGCV-KRWDZBQOSA-N 1 3 296.458 3.922 20 0 CHADHO COc1cccc([C@@H](C)NCc2cccc(C[NH+](C)C)c2)c1 ZINC000177199545 1126798460 /nfs/dbraw/zinc/79/84/60/1126798460.db2.gz PTRMDLIJLAFCGK-OAHLLOKOSA-N 1 3 298.430 3.608 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCc3cc(Cl)ccc32)C1 ZINC000484467586 1126817007 /nfs/dbraw/zinc/81/70/07/1126817007.db2.gz AALNQNYLLPEOGJ-BFYDXBDKSA-N 1 3 292.854 3.790 20 0 CHADHO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)c(C)c1 ZINC000484466049 1126817168 /nfs/dbraw/zinc/81/71/68/1126817168.db2.gz JEECOSZLJKNUSG-GVDBMIGSSA-N 1 3 274.452 3.827 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCc3cc(Cl)ccc32)C1 ZINC000484467589 1126817224 /nfs/dbraw/zinc/81/72/24/1126817224.db2.gz AALNQNYLLPEOGJ-UXLLHSPISA-N 1 3 292.854 3.790 20 0 CHADHO Cc1ccc(C)c([C@H](C)[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)c1 ZINC000484482998 1126821071 /nfs/dbraw/zinc/82/10/71/1126821071.db2.gz GAKUNFOUFMYQEL-GVDBMIGSSA-N 1 3 274.452 3.827 20 0 CHADHO C[C@@H](c1ccc(Cl)cc1Cl)N(C)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904308600 1126843961 /nfs/dbraw/zinc/84/39/61/1126843961.db2.gz SLIZTRCJVFHMPA-JBLDHEPKSA-N 1 3 287.234 3.724 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2NC1CC[NH+](C2CCC2)CC1 ZINC000269012564 1127032447 /nfs/dbraw/zinc/03/24/47/1127032447.db2.gz NXBVBEUIJMHEAS-IBGZPJMESA-N 1 3 284.447 3.671 20 0 CHADHO CC[NH+]1CCC(NCc2ccc(C3CCC3)cc2)CC1 ZINC000339166352 1127117937 /nfs/dbraw/zinc/11/79/37/1127117937.db2.gz NPYANLADFXMZAF-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[NH2+][C@H]1CCNC2(CCC2)C1 ZINC000666995557 1127139196 /nfs/dbraw/zinc/13/91/96/1127139196.db2.gz RGQUOKCMPIMMDA-JYJNAYRXSA-N 1 3 266.473 3.712 20 0 CHADHO CCCC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCNC2(CCC2)C1 ZINC000666995601 1127139617 /nfs/dbraw/zinc/13/96/17/1127139617.db2.gz SVJCMIXPIDDSAD-PMPSAXMXSA-N 1 3 264.457 3.610 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@@H]2N[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000349806006 1127161674 /nfs/dbraw/zinc/16/16/74/1127161674.db2.gz XINAOCNJDDSVBN-SCTDSRPQSA-N 1 3 298.474 3.897 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@@H]2N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000349806006 1127161675 /nfs/dbraw/zinc/16/16/75/1127161675.db2.gz XINAOCNJDDSVBN-SCTDSRPQSA-N 1 3 298.474 3.897 20 0 CHADHO Cc1sccc1CN1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000351813361 1127209927 /nfs/dbraw/zinc/20/99/27/1127209927.db2.gz QZZFOUCGPNQHND-WBVHZDCISA-N 1 3 290.476 3.505 20 0 CHADHO Cc1sccc1CN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000351813361 1127209932 /nfs/dbraw/zinc/20/99/32/1127209932.db2.gz QZZFOUCGPNQHND-WBVHZDCISA-N 1 3 290.476 3.505 20 0 CHADHO CC[N@H+](Cc1cccc(F)c1)C1CCN(CC2CC2)CC1 ZINC001168387597 1127214500 /nfs/dbraw/zinc/21/45/00/1127214500.db2.gz LXBKYXWFSHGKSJ-UHFFFAOYSA-N 1 3 290.426 3.522 20 0 CHADHO CC[N@@H+](Cc1cccc(F)c1)C1CCN(CC2CC2)CC1 ZINC001168387597 1127214503 /nfs/dbraw/zinc/21/45/03/1127214503.db2.gz LXBKYXWFSHGKSJ-UHFFFAOYSA-N 1 3 290.426 3.522 20 0 CHADHO CC(C)CCCC[NH2+]C1CCN(CC(C)C)CC1 ZINC000157048350 1127223722 /nfs/dbraw/zinc/22/37/22/1127223722.db2.gz LBASUNWIJPMQMT-UHFFFAOYSA-N 1 3 254.462 3.523 20 0 CHADHO Cc1ccnc([C@@H](C)NCCCC[N@@H+]2CCCC[C@H]2C)c1 ZINC000285472527 1127230142 /nfs/dbraw/zinc/23/01/42/1127230142.db2.gz AXWCMCKSJQGELK-IAGOWNOFSA-N 1 3 289.467 3.695 20 0 CHADHO Cc1ccnc([C@@H](C)NCCCC[N@H+]2CCCC[C@H]2C)c1 ZINC000285472527 1127230146 /nfs/dbraw/zinc/23/01/46/1127230146.db2.gz AXWCMCKSJQGELK-IAGOWNOFSA-N 1 3 289.467 3.695 20 0 CHADHO CC[C@@H]1CCC[C@@H]([NH2+]CC[C@@H](C)N2CCCCC2)C1 ZINC001308365063 1127372875 /nfs/dbraw/zinc/37/28/75/1127372875.db2.gz CLTUZFHDNDFRQO-BRWVUGGUSA-N 1 3 266.473 3.809 20 0 CHADHO Cc1cc(N2CC[C@H]([NH+]3CCCCC3)C2)c2ccccc2n1 ZINC000594006233 1127407485 /nfs/dbraw/zinc/40/74/85/1127407485.db2.gz YINWWKUMPYELSU-INIZCTEOSA-N 1 3 295.430 3.608 20 0 CHADHO Cc1cccnc1[C@H](N[C@H]1C[C@H]([NH3+])CC(C)(C)C1)C(C)C ZINC000925497809 1127487810 /nfs/dbraw/zinc/48/78/10/1127487810.db2.gz KESCINGYQRGVJT-HRCADAONSA-N 1 3 289.467 3.583 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@H]2CCCCc3ccccc32)C1 ZINC000360233680 1127493557 /nfs/dbraw/zinc/49/35/57/1127493557.db2.gz JHDJXUCXYBQPQT-LPHOPBHVSA-N 1 3 286.463 3.776 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@H]2CCCCc3ccccc32)C1 ZINC000360233680 1127493559 /nfs/dbraw/zinc/49/35/59/1127493559.db2.gz JHDJXUCXYBQPQT-LPHOPBHVSA-N 1 3 286.463 3.776 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H]2CCCCc3ccccc32)C1 ZINC000360233680 1127493561 /nfs/dbraw/zinc/49/35/61/1127493561.db2.gz JHDJXUCXYBQPQT-LPHOPBHVSA-N 1 3 286.463 3.776 20 0 CHADHO CC[C@@H]([NH2+][C@@H](C)CCN(C)C)c1cc(Cl)ccc1OC ZINC000360858991 1127515880 /nfs/dbraw/zinc/51/58/80/1127515880.db2.gz MNQJOUWNOCSTFO-SWLSCSKDSA-N 1 3 298.858 3.730 20 0 CHADHO c1cc(C2CCC2)ccc1CNC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000294117962 1127549941 /nfs/dbraw/zinc/54/99/41/1127549941.db2.gz NFHOSZIJRQNOIU-INIZCTEOSA-N 1 3 284.447 3.528 20 0 CHADHO c1cc(C2CCC2)ccc1CNC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000294117962 1127549943 /nfs/dbraw/zinc/54/99/43/1127549943.db2.gz NFHOSZIJRQNOIU-INIZCTEOSA-N 1 3 284.447 3.528 20 0 CHADHO c1cc(C2CCC2)ccc1C[NH2+]C[C@@H]1CCN(C2CC2)C1 ZINC000294117962 1127549944 /nfs/dbraw/zinc/54/99/44/1127549944.db2.gz NFHOSZIJRQNOIU-INIZCTEOSA-N 1 3 284.447 3.528 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1ccc(F)cc1 ZINC000361967799 1127603033 /nfs/dbraw/zinc/60/30/33/1127603033.db2.gz MQSPIDFUJBYNIJ-BBWFWOEESA-N 1 3 278.415 3.739 20 0 CHADHO CC1(C)[C@H](N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C[C@@H]1c1ccccc1 ZINC000364071034 1127690067 /nfs/dbraw/zinc/69/00/67/1127690067.db2.gz DMTJBAVXCCKSOG-NCXUSEDFSA-N 1 3 298.474 3.785 20 0 CHADHO CC1(C)[C@H](N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)C[C@@H]1c1ccccc1 ZINC000364071034 1127690070 /nfs/dbraw/zinc/69/00/70/1127690070.db2.gz DMTJBAVXCCKSOG-NCXUSEDFSA-N 1 3 298.474 3.785 20 0 CHADHO CC[C@@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)c1ccsc1 ZINC000297645644 1127703535 /nfs/dbraw/zinc/70/35/35/1127703535.db2.gz JXTVZHRFDSSKNA-GDBMZVCRSA-N 1 3 280.481 3.909 20 0 CHADHO C[C@@H](CCc1ccccc1)N1CCC2(CCC[N@@H+]2C)CC1 ZINC000368612397 1127758722 /nfs/dbraw/zinc/75/87/22/1127758722.db2.gz KLEGCTCTNMVBQP-KRWDZBQOSA-N 1 3 286.463 3.568 20 0 CHADHO C[C@@H](CCc1ccccc1)N1CCC2(CCC[N@H+]2C)CC1 ZINC000368612397 1127758726 /nfs/dbraw/zinc/75/87/26/1127758726.db2.gz KLEGCTCTNMVBQP-KRWDZBQOSA-N 1 3 286.463 3.568 20 0 CHADHO C[C@@H](CCc1ccccc1)[NH+]1CCC2(CCCN2C)CC1 ZINC000368612397 1127758730 /nfs/dbraw/zinc/75/87/30/1127758730.db2.gz KLEGCTCTNMVBQP-KRWDZBQOSA-N 1 3 286.463 3.568 20 0 CHADHO CC(C)[NH+]1CCC(N[C@H](CC2CC2)c2ccccc2)CC1 ZINC000540172871 1127966014 /nfs/dbraw/zinc/96/60/14/1127966014.db2.gz BJLHYWMHIBEHPS-LJQANCHMSA-N 1 3 286.463 3.990 20 0 CHADHO C[C@@H](Cc1cccc(F)c1)N1C(C)(C)CC([NH3+])CC1(C)C ZINC001168454803 1128133054 /nfs/dbraw/zinc/13/30/54/1128133054.db2.gz AWVMDDJIFWIMKF-ZDUSSCGKSA-N 1 3 292.442 3.737 20 0 CHADHO c1ccc([C@H]2C[C@H]([NH2+][C@H]3CCNC[C@H]3C3CCCC3)C2)cc1 ZINC000925604108 1128134317 /nfs/dbraw/zinc/13/43/17/1128134317.db2.gz HOCFQPMSIDEAIE-MUGJNUQGSA-N 1 3 298.474 3.691 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3NCCC(C)(C)[NH3+] ZINC000925737757 1128139423 /nfs/dbraw/zinc/13/94/23/1128139423.db2.gz KTWOLXPGJXWKER-MRXNPFEDSA-N 1 3 285.435 3.571 20 0 CHADHO CSCCCCC[NH2+]C1CCN(CCC(C)C)CC1 ZINC000926209506 1128160658 /nfs/dbraw/zinc/16/06/58/1128160658.db2.gz HYPQHTIAKHPMAE-UHFFFAOYSA-N 1 3 286.529 3.620 20 0 CHADHO CCCC[N@H+](CCCCCO)C1CC(C)(C)NC(C)(C)C1 ZINC000931034269 1128344745 /nfs/dbraw/zinc/34/47/45/1128344745.db2.gz YDEBYMDQVFXLJO-UHFFFAOYSA-N 1 3 298.515 3.560 20 0 CHADHO CCCC[N@@H+](CCCCCO)C1CC(C)(C)NC(C)(C)C1 ZINC000931034269 1128344749 /nfs/dbraw/zinc/34/47/49/1128344749.db2.gz YDEBYMDQVFXLJO-UHFFFAOYSA-N 1 3 298.515 3.560 20 0 CHADHO CC(C)SCCNC1CC[NH+]([C@@H]2CCC[C@H](C)C2)CC1 ZINC000562063181 1128375859 /nfs/dbraw/zinc/37/58/59/1128375859.db2.gz AUTOCPCLFJMVJM-DOTOQJQBSA-N 1 3 298.540 3.761 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H](C)c2ccc3c(c2)CCCC3)C1 ZINC000037644195 1128433869 /nfs/dbraw/zinc/43/38/69/1128433869.db2.gz ZZFBGADWBLBXJW-JKSUJKDBSA-N 1 3 286.463 3.558 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H](C)c2ccc3c(c2)CCCC3)C1 ZINC000037644195 1128433870 /nfs/dbraw/zinc/43/38/70/1128433870.db2.gz ZZFBGADWBLBXJW-JKSUJKDBSA-N 1 3 286.463 3.558 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)c2ccc3c(c2)CCCC3)C1 ZINC000037644195 1128433871 /nfs/dbraw/zinc/43/38/71/1128433871.db2.gz ZZFBGADWBLBXJW-JKSUJKDBSA-N 1 3 286.463 3.558 20 0 CHADHO C[C@@H](NC[C@H](C)C[NH+]1CCCC1)c1ccc2c(c1)CCC2 ZINC000062078269 1128436967 /nfs/dbraw/zinc/43/69/67/1128436967.db2.gz QWDHFTIDIJGWAA-JKSUJKDBSA-N 1 3 286.463 3.558 20 0 CHADHO CCCc1ccc([C@H](C)NC2CC[NH+](CC)CC2)cc1 ZINC000038097952 1128437937 /nfs/dbraw/zinc/43/79/37/1128437937.db2.gz AEOCSISXJDDASH-HNNXBMFYSA-N 1 3 274.452 3.774 20 0 CHADHO Cc1ccc([C@H](C)[NH2+][C@H](CCN(C)C)C(C)(C)C)o1 ZINC000126002272 1128460136 /nfs/dbraw/zinc/46/01/36/1128460136.db2.gz PLHZDDFPSDELBV-DZGCQCFKSA-N 1 3 266.429 3.605 20 0 CHADHO CCN1CC[C@H](C[NH2+]Cc2ccccc2-c2ccccc2)C1 ZINC000917395366 1128497307 /nfs/dbraw/zinc/49/73/07/1128497307.db2.gz JGZTYVHKGQOJOZ-QGZVFWFLSA-N 1 3 294.442 3.785 20 0 CHADHO CC[N@@H+]1CC[C@H](CNCc2ccccc2-c2ccccc2)C1 ZINC000917395366 1128497309 /nfs/dbraw/zinc/49/73/09/1128497309.db2.gz JGZTYVHKGQOJOZ-QGZVFWFLSA-N 1 3 294.442 3.785 20 0 CHADHO CC[N@H+]1CC[C@H](CNCc2ccccc2-c2ccccc2)C1 ZINC000917395366 1128497310 /nfs/dbraw/zinc/49/73/10/1128497310.db2.gz JGZTYVHKGQOJOZ-QGZVFWFLSA-N 1 3 294.442 3.785 20 0 CHADHO CC[NH+]1CCC(NCc2ccccc2-c2ccccc2)CC1 ZINC000917392654 1128497321 /nfs/dbraw/zinc/49/73/21/1128497321.db2.gz JPWCCGHHPDTIGO-UHFFFAOYSA-N 1 3 294.442 3.928 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CCC(C)(C)C2CC2)CC1 ZINC000556255373 1128569373 /nfs/dbraw/zinc/56/93/73/1128569373.db2.gz SXKJGNCGRPKKCF-UHFFFAOYSA-N 1 3 266.473 3.665 20 0 CHADHO CC1=CC[C@H]([NH2+][C@@H](C)[C@H]2CCCN(C3CCC3)C2)CC1 ZINC000556833707 1128628000 /nfs/dbraw/zinc/62/80/00/1128628000.db2.gz JRNOJEPRZFYQFA-ULQDDVLXSA-N 1 3 276.468 3.728 20 0 CHADHO Cc1ccc(CC[C@H](C)[NH2+]C[C@H]2CCN(C(C)C)C2)cc1 ZINC000578370008 1128716002 /nfs/dbraw/zinc/71/60/02/1128716002.db2.gz MCWZKBPRVXWOSU-PKOBYXMFSA-N 1 3 288.479 3.636 20 0 CHADHO Cc1ccc(CC[C@H](C)[NH2+]C[C@@H]2CCN(C(C)C)C2)cc1 ZINC000578370005 1128716214 /nfs/dbraw/zinc/71/62/14/1128716214.db2.gz MCWZKBPRVXWOSU-HKUYNNGSSA-N 1 3 288.479 3.636 20 0 CHADHO CC1=CC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000578385631 1128716479 /nfs/dbraw/zinc/71/64/79/1128716479.db2.gz UNABESFUDCFPJJ-INIZCTEOSA-N 1 3 276.468 3.872 20 0 CHADHO C[C@@H]1CC[C@H](C[NH3+])CN1Cc1cccc(C(C)(C)C)c1 ZINC001206767585 1117818233 /nfs/dbraw/zinc/81/82/33/1117818233.db2.gz CCTPNOYAXJPDSU-GDBMZVCRSA-N 1 3 274.452 3.543 20 0 CHADHO C[C@H](CN1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)C(C)(C)C ZINC000670265663 1117828024 /nfs/dbraw/zinc/82/80/24/1117828024.db2.gz PAEJAAUEDXDFKP-VYDXJSESSA-N 1 3 278.484 3.617 20 0 CHADHO C[C@H](CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)C(C)(C)C ZINC000670265663 1117828031 /nfs/dbraw/zinc/82/80/31/1117828031.db2.gz PAEJAAUEDXDFKP-VYDXJSESSA-N 1 3 278.484 3.617 20 0 CHADHO Cc1ccccc1[C@@H](C)N[C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623337663 1117834042 /nfs/dbraw/zinc/83/40/42/1117834042.db2.gz SELRQADBMCYZIJ-HUUCEWRRSA-N 1 3 260.425 3.518 20 0 CHADHO Cc1ccccc1[C@@H](C)N[C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623337663 1117834046 /nfs/dbraw/zinc/83/40/46/1117834046.db2.gz SELRQADBMCYZIJ-HUUCEWRRSA-N 1 3 260.425 3.518 20 0 CHADHO Cc1cc(C)cc([C@@H](C)N[C@H]2CC[N@H+](C)C(C)(C)C2)c1 ZINC000623409222 1117851054 /nfs/dbraw/zinc/85/10/54/1117851054.db2.gz URLZWCJNMVKTOJ-WBVHZDCISA-N 1 3 274.452 3.827 20 0 CHADHO Cc1cc(C)cc([C@@H](C)N[C@H]2CC[N@@H+](C)C(C)(C)C2)c1 ZINC000623409222 1117851058 /nfs/dbraw/zinc/85/10/58/1117851058.db2.gz URLZWCJNMVKTOJ-WBVHZDCISA-N 1 3 274.452 3.827 20 0 CHADHO Cc1cc(C)cc([C@H](C)N[C@H]2CC[N@H+](C)C(C)(C)C2)c1 ZINC000623409221 1117851665 /nfs/dbraw/zinc/85/16/65/1117851665.db2.gz URLZWCJNMVKTOJ-RDJZCZTQSA-N 1 3 274.452 3.827 20 0 CHADHO Cc1cc(C)cc([C@H](C)N[C@H]2CC[N@@H+](C)C(C)(C)C2)c1 ZINC000623409221 1117851672 /nfs/dbraw/zinc/85/16/72/1117851672.db2.gz URLZWCJNMVKTOJ-RDJZCZTQSA-N 1 3 274.452 3.827 20 0 CHADHO CC[C@H](C)[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000579288066 1128743551 /nfs/dbraw/zinc/74/35/51/1128743551.db2.gz IDMDKTJQHXIGKQ-WZGPROSRSA-N 1 3 286.463 3.675 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N[C@H]1CCCc2scnc21 ZINC000623848855 1117942886 /nfs/dbraw/zinc/94/28/86/1117942886.db2.gz NFJRSPRTAOYESN-KGLIPLIRSA-N 1 3 295.496 3.621 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H]2CCc3cc(F)ccc32)C1 ZINC000125727406 1117962781 /nfs/dbraw/zinc/96/27/81/1117962781.db2.gz GYWNOWXZVBSEIZ-RDTXWAMCSA-N 1 3 290.426 3.523 20 0 CHADHO Cc1ccc(CC[C@@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)cc1 ZINC000624120855 1117984906 /nfs/dbraw/zinc/98/49/06/1117984906.db2.gz IMCATEHOGOLJDT-MJGOQNOKSA-N 1 3 288.479 3.638 20 0 CHADHO CCc1ccc([C@H](C)[NH2+]C[C@H]2CCCCN(C)C2)cc1 ZINC000624120218 1117986414 /nfs/dbraw/zinc/98/64/14/1117986414.db2.gz UOKPMHVXUIUPNQ-DOTOQJQBSA-N 1 3 274.452 3.632 20 0 CHADHO CC[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccsc1 ZINC000624123557 1117986657 /nfs/dbraw/zinc/98/66/57/1117986657.db2.gz NZNWQVHZNACVSP-ZFWWWQNUSA-N 1 3 266.454 3.521 20 0 CHADHO CC[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1cccc(C)c1 ZINC000624124006 1117987206 /nfs/dbraw/zinc/98/72/06/1117987206.db2.gz VLVUKYKWQUGAFS-WMZOPIPTSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@H](NC[C@@H]1CCCC[N@H+](C)C1)c1cccc(C)c1 ZINC000624124006 1117987208 /nfs/dbraw/zinc/98/72/08/1117987208.db2.gz VLVUKYKWQUGAFS-WMZOPIPTSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@H](NC[C@@H]1CCCC[N@@H+](C)C1)c1cccc(C)c1 ZINC000624124006 1117987212 /nfs/dbraw/zinc/98/72/12/1117987212.db2.gz VLVUKYKWQUGAFS-WMZOPIPTSA-N 1 3 274.452 3.768 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)C1CCC(F)(F)CC1 ZINC000624123191 1117987615 /nfs/dbraw/zinc/98/76/15/1117987615.db2.gz HRHIOWWRYNSXON-KBPBESRZSA-N 1 3 288.426 3.522 20 0 CHADHO CCc1ccc([C@H](CC)[NH2+]C[C@H]2CCN(CC)C2)cc1 ZINC000037644304 1118032757 /nfs/dbraw/zinc/03/27/57/1118032757.db2.gz OPCSDHWVIFNUBL-AEFFLSMTSA-N 1 3 274.452 3.632 20 0 CHADHO CCc1ccc([C@H](CC)NC[C@H]2CC[N@H+](CC)C2)cc1 ZINC000037644304 1118032762 /nfs/dbraw/zinc/03/27/62/1118032762.db2.gz OPCSDHWVIFNUBL-AEFFLSMTSA-N 1 3 274.452 3.632 20 0 CHADHO CCc1ccc([C@H](CC)NC[C@H]2CC[N@@H+](CC)C2)cc1 ZINC000037644304 1118032768 /nfs/dbraw/zinc/03/27/68/1118032768.db2.gz OPCSDHWVIFNUBL-AEFFLSMTSA-N 1 3 274.452 3.632 20 0 CHADHO C[C@H](CC[NH2+][C@H](C)c1cccs1)N1CCCCC1 ZINC000184501371 1118054244 /nfs/dbraw/zinc/05/42/44/1118054244.db2.gz GDCNQMSIZUSDBP-ZIAGYGMSSA-N 1 3 266.454 3.663 20 0 CHADHO Cc1cccc2c1ncc(C)c2N1CC[C@H]([NH+]2CCCC2)C1 ZINC000185293447 1118061764 /nfs/dbraw/zinc/06/17/64/1118061764.db2.gz LFOPAOGIIOSQFN-INIZCTEOSA-N 1 3 295.430 3.526 20 0 CHADHO C[C@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1cccc(C2CC2)c1 ZINC000340175835 1118099544 /nfs/dbraw/zinc/09/95/44/1118099544.db2.gz RCQZHMSSVNEHPQ-LSDHHAIUSA-N 1 3 284.447 3.699 20 0 CHADHO C[C@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1cccc(C2CC2)c1 ZINC000340175835 1118099551 /nfs/dbraw/zinc/09/95/51/1118099551.db2.gz RCQZHMSSVNEHPQ-LSDHHAIUSA-N 1 3 284.447 3.699 20 0 CHADHO CCCCCC[C@H](C)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000705966996 1118117126 /nfs/dbraw/zinc/11/71/26/1118117126.db2.gz KITSXIYUBBCBMN-JKSUJKDBSA-N 1 3 254.462 3.667 20 0 CHADHO CC/C=C/CCN1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC001167256531 1118123510 /nfs/dbraw/zinc/12/35/10/1118123510.db2.gz ZCPIQLZDNSXEIE-SHCNBLLESA-N 1 3 278.484 3.787 20 0 CHADHO C[C@H]1CN(CCCC[NH2+]C2CCCCCCC2)C[C@H](C)O1 ZINC000765404333 1118149295 /nfs/dbraw/zinc/14/92/95/1118149295.db2.gz CTUKYWSCQJZOHN-IRXDYDNUSA-N 1 3 296.499 3.578 20 0 CHADHO C[C@@H]1C[C@H]([NH3+])CCN1Cc1ccc(-c2ccccc2)cc1 ZINC000129021008 1118156547 /nfs/dbraw/zinc/15/65/47/1118156547.db2.gz ZEXOKJBPLQKHCH-DNVCBOLYSA-N 1 3 280.415 3.665 20 0 CHADHO CN(C)[C@H]1CCC[C@H]([NH2+]C2CCCCCCC2)C1 ZINC000715510622 1118308558 /nfs/dbraw/zinc/30/85/58/1118308558.db2.gz QSKXSZGJZLJWIV-HOTGVXAUSA-N 1 3 252.446 3.562 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+]C2CCCCCCC2)C1 ZINC000715510625 1118308808 /nfs/dbraw/zinc/30/88/08/1118308808.db2.gz QSKXSZGJZLJWIV-HZPDHXFCSA-N 1 3 252.446 3.562 20 0 CHADHO CCc1ccc(C[N@H+](CC(C)(C)C)C2CCNCC2)s1 ZINC001236456623 1128770944 /nfs/dbraw/zinc/77/09/44/1128770944.db2.gz AKYQMKTYDFTSOW-UHFFFAOYSA-N 1 3 294.508 3.911 20 0 CHADHO CCc1ccc(C[N@@H+](CC(C)(C)C)C2CCNCC2)s1 ZINC001236456623 1128770946 /nfs/dbraw/zinc/77/09/46/1128770946.db2.gz AKYQMKTYDFTSOW-UHFFFAOYSA-N 1 3 294.508 3.911 20 0 CHADHO CCc1ccc(CN(CC(C)(C)C)C2CC[NH2+]CC2)s1 ZINC001236456623 1128770949 /nfs/dbraw/zinc/77/09/49/1128770949.db2.gz AKYQMKTYDFTSOW-UHFFFAOYSA-N 1 3 294.508 3.911 20 0 CHADHO C[C@@H]([NH2+]Cc1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000306747608 1118340738 /nfs/dbraw/zinc/34/07/38/1118340738.db2.gz FPYBZZMJEUEXHH-YLJYHZDGSA-N 1 3 294.442 3.687 20 0 CHADHO C[C@@H](NCc1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000306747608 1118340742 /nfs/dbraw/zinc/34/07/42/1118340742.db2.gz FPYBZZMJEUEXHH-YLJYHZDGSA-N 1 3 294.442 3.687 20 0 CHADHO C[C@@H](NCc1ccccc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000306747608 1118340747 /nfs/dbraw/zinc/34/07/47/1118340747.db2.gz FPYBZZMJEUEXHH-YLJYHZDGSA-N 1 3 294.442 3.687 20 0 CHADHO CCOc1cccc([C@H](C)[NH2+]CC[C@H]2CCCCN2C)c1 ZINC000539279158 1118351039 /nfs/dbraw/zinc/35/10/39/1118351039.db2.gz ABQLUKARYNSKLD-DOTOQJQBSA-N 1 3 290.451 3.610 20 0 CHADHO CCSc1cccc(CNCc2ccc(C[NH3+])cc2)c1 ZINC000580192266 1118399106 /nfs/dbraw/zinc/39/91/06/1118399106.db2.gz GSJQQXJAHVIWMC-UHFFFAOYSA-N 1 3 286.444 3.547 20 0 CHADHO CC[C@H](C)[C@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000580226043 1118405635 /nfs/dbraw/zinc/40/56/35/1118405635.db2.gz MCHFVVOWTRKWCL-GJZGRUSLSA-N 1 3 266.473 3.808 20 0 CHADHO C[C@@H]([NH3+])[C@@H]1CCN(Cc2cccc(C3CCCC3)c2)C1 ZINC000656785712 1118657534 /nfs/dbraw/zinc/65/75/34/1118657534.db2.gz IOCHQTHHOSLIRT-RDTXWAMCSA-N 1 3 272.436 3.513 20 0 CHADHO [NH3+][C@@H]1C[C@H](NCCC2=CCCCC2)c2ccccc21 ZINC000131923019 1118776015 /nfs/dbraw/zinc/77/60/15/1118776015.db2.gz NLRBHMPCXBCFHA-SJORKVTESA-N 1 3 256.393 3.611 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCC[C@@H]1CCCF)CN1CCCCC1 ZINC000510724398 1118797195 /nfs/dbraw/zinc/79/71/95/1118797195.db2.gz XNLLVCPHGPFBNF-ZACQAIPSSA-N 1 3 284.463 3.616 20 0 CHADHO c1csc([C@H](NC[C@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC000132152030 1118827036 /nfs/dbraw/zinc/82/70/36/1118827036.db2.gz UTRKZQYJDQJNBS-XJKSGUPXSA-N 1 3 278.465 3.569 20 0 CHADHO CC(C)(C)C[C@@H](N[C@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000133714992 1118867149 /nfs/dbraw/zinc/86/71/49/1118867149.db2.gz JLLMRKUTMFKQBI-DLBZAZTESA-N 1 3 274.452 3.896 20 0 CHADHO CC(C)(C)C1CCN(CCC[NH+]2CCCCC2)CC1 ZINC000472183529 1119023221 /nfs/dbraw/zinc/02/32/21/1119023221.db2.gz SQWZRJYGIPBXSS-UHFFFAOYSA-N 1 3 266.473 3.621 20 0 CHADHO CCC[NH2+][C@H](C)c1ccc(OC)c(CN(CC)CC)c1 ZINC000043809728 1119049153 /nfs/dbraw/zinc/04/91/53/1119049153.db2.gz YTJPUNCNRTXPSF-CQSZACIVSA-N 1 3 278.440 3.598 20 0 CHADHO CCCC[C@H](CC)[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663467504 1119148518 /nfs/dbraw/zinc/14/85/18/1119148518.db2.gz GJJUJNFHQLQIPO-SJORKVTESA-N 1 3 266.473 3.667 20 0 CHADHO Cc1ccc([C@@H](C)C[NH2+]C[C@H]2CCCN(C(C)C)C2)cc1 ZINC000628213898 1128828893 /nfs/dbraw/zinc/82/88/93/1128828893.db2.gz CKKCBVHHZZEKGB-ZWKOTPCHSA-N 1 3 288.479 3.809 20 0 CHADHO CC(C)CC1([NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000657774847 1119385488 /nfs/dbraw/zinc/38/54/88/1119385488.db2.gz MGNRJWVMIIYPRH-UHFFFAOYSA-N 1 3 278.484 3.952 20 0 CHADHO CCC[C@H](C)[C@H](CC)[NH2+]C[C@@H]1CCN(CCC)C1 ZINC000151124069 1119404738 /nfs/dbraw/zinc/40/47/38/1119404738.db2.gz PVDFKXUILUNPKZ-JYJNAYRXSA-N 1 3 254.462 3.523 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@H](C)c1cccc(Cl)c1 ZINC000650759321 1119417891 /nfs/dbraw/zinc/41/78/91/1119417891.db2.gz IKQWWLBRFCTKRQ-CYBMUJFWSA-N 1 3 288.822 3.910 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@@H](C)c1ccc(Cl)s1 ZINC000650759160 1119417948 /nfs/dbraw/zinc/41/79/48/1119417948.db2.gz FIGFGKDJDJETIO-NSHDSACASA-N 1 3 294.851 3.972 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@H](C)c1ccc(Cl)s1 ZINC000650759159 1119417955 /nfs/dbraw/zinc/41/79/55/1119417955.db2.gz FIGFGKDJDJETIO-LLVKDONJSA-N 1 3 294.851 3.972 20 0 CHADHO CCCN1CC[C@@H](C[NH2+]C[C@@H](C)CCc2ccccc2)C1 ZINC001648920568 1119595473 /nfs/dbraw/zinc/59/54/73/1119595473.db2.gz CEUHVKKAUUULNS-HKUYNNGSSA-N 1 3 288.479 3.577 20 0 CHADHO C[C@H]([NH2+]C1CCN(C2CCCC2)CC1)C(C)(C)C(F)F ZINC000657899566 1119619418 /nfs/dbraw/zinc/61/94/18/1119619418.db2.gz CPABFDRQSBDUPV-LBPRGKRZSA-N 1 3 288.426 3.663 20 0 CHADHO C[C@@H]1CCCC[C@@H]1[NH+]1CCC(NCCC(C)(C)F)CC1 ZINC000658192280 1119699550 /nfs/dbraw/zinc/69/95/50/1119699550.db2.gz FDOWPJODDSEUQH-ZBFHGGJFSA-N 1 3 284.463 3.757 20 0 CHADHO C[C@H](CCc1ccco1)N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000658226168 1119706807 /nfs/dbraw/zinc/70/68/07/1119706807.db2.gz GUGDBZRHHZNLMJ-HZPDHXFCSA-N 1 3 290.451 3.597 20 0 CHADHO C[C@H](CCc1ccco1)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000658226168 1119706810 /nfs/dbraw/zinc/70/68/10/1119706810.db2.gz GUGDBZRHHZNLMJ-HZPDHXFCSA-N 1 3 290.451 3.597 20 0 CHADHO C[C@H](Cc1cccs1)N[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000658229260 1119706821 /nfs/dbraw/zinc/70/68/21/1119706821.db2.gz PYPGSUHNPDOHOH-CABCVRRESA-N 1 3 292.492 3.676 20 0 CHADHO C[C@H](Cc1cccs1)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000658229260 1119706826 /nfs/dbraw/zinc/70/68/26/1119706826.db2.gz PYPGSUHNPDOHOH-CABCVRRESA-N 1 3 292.492 3.676 20 0 CHADHO CCCc1ccc(C[NH2+]C[C@@H]2CCCCN(C)C2)s1 ZINC000623657002 1120065157 /nfs/dbraw/zinc/06/51/57/1120065157.db2.gz HKLVRVDUDGHPNI-AWEZNQCLSA-N 1 3 280.481 3.522 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@H]2CC[C@H](c3ccccc3)C2)C1 ZINC000623657251 1120066216 /nfs/dbraw/zinc/06/62/16/1120066216.db2.gz MDZVGOSYJRDORU-NEWSRXKRSA-N 1 3 286.463 3.644 20 0 CHADHO CCC[C@H](C)[C@@H](CC)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000624120914 1120068529 /nfs/dbraw/zinc/06/85/29/1120068529.db2.gz KAAZRAFTEMAVBA-HRCADAONSA-N 1 3 254.462 3.523 20 0 CHADHO CCC[C@H](C)[C@@H](CC)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000624120913 1120068722 /nfs/dbraw/zinc/06/87/22/1120068722.db2.gz KAAZRAFTEMAVBA-ARFHVFGLSA-N 1 3 254.462 3.523 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+]CC2CCC(C)(C)CC2)C1 ZINC000715540341 1120081955 /nfs/dbraw/zinc/08/19/55/1120081955.db2.gz BXSGNFPZERMAIQ-HZPDHXFCSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)COc1ccc([C@@H](C)[NH2+]C[C@H](C)CN(C)C)cc1 ZINC000314277399 1120181844 /nfs/dbraw/zinc/18/18/44/1120181844.db2.gz JKSIECTWKGDTRJ-JKSUJKDBSA-N 1 3 292.467 3.570 20 0 CHADHO C[C@H]([NH2+][C@H]1CC[C@@H](C)NC1)c1cc2ccccc2s1 ZINC000629542687 1128914555 /nfs/dbraw/zinc/91/45/55/1128914555.db2.gz JIERFVVBLBKVHZ-DYEKYZERSA-N 1 3 274.433 3.692 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2c2cccs2)C1 ZINC000417336390 1120429787 /nfs/dbraw/zinc/42/97/87/1120429787.db2.gz HWQFPYVZLFMLLV-FXUDXRNXSA-N 1 3 292.492 3.562 20 0 CHADHO c1ccc([C@H]2C[C@H]([NH2+][C@@H]3CCNC[C@@H]3C3CCCC3)C2)cc1 ZINC000925604111 1120445110 /nfs/dbraw/zinc/44/51/10/1120445110.db2.gz HOCFQPMSIDEAIE-UAFMIMERSA-N 1 3 298.474 3.691 20 0 CHADHO C[C@@H]([NH2+][C@@H]1C[C@@H]1c1ccccc1)[C@@H]1CCCN(C2CCC2)C1 ZINC000660258101 1120469745 /nfs/dbraw/zinc/46/97/45/1120469745.db2.gz ZZTPDSFCTIYLAE-RARDXLECSA-N 1 3 298.474 3.785 20 0 CHADHO C[C@@H](N[C@@H]1C[C@@H]1c1ccccc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000660258101 1120469747 /nfs/dbraw/zinc/46/97/47/1120469747.db2.gz ZZTPDSFCTIYLAE-RARDXLECSA-N 1 3 298.474 3.785 20 0 CHADHO C[C@@H](N[C@@H]1C[C@@H]1c1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000660258101 1120469751 /nfs/dbraw/zinc/46/97/51/1120469751.db2.gz ZZTPDSFCTIYLAE-RARDXLECSA-N 1 3 298.474 3.785 20 0 CHADHO Cc1ccccc1C[NH+]1CCC(NCc2ccccc2)CC1 ZINC000069710307 1120517915 /nfs/dbraw/zinc/51/79/15/1120517915.db2.gz UXJQRTUANVUANI-UHFFFAOYSA-N 1 3 294.442 3.749 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]CC[C@@H](C)N2CCCCC2)cc1 ZINC000543418656 1120518766 /nfs/dbraw/zinc/51/87/66/1120518766.db2.gz WRKFXTJPSUWBPI-SJORKVTESA-N 1 3 274.452 3.910 20 0 CHADHO Cc1nc2ccc(NCCC[N@H+]3CCCC[C@@H]3C)cc2[nH]1 ZINC001167751899 1120541954 /nfs/dbraw/zinc/54/19/54/1120541954.db2.gz ORIVDNNQHRCLLS-ZDUSSCGKSA-N 1 3 286.423 3.548 20 0 CHADHO Cc1nc2ccc(NCCC[N@@H+]3CCCC[C@@H]3C)cc2[nH]1 ZINC001167751899 1120541958 /nfs/dbraw/zinc/54/19/58/1120541958.db2.gz ORIVDNNQHRCLLS-ZDUSSCGKSA-N 1 3 286.423 3.548 20 0 CHADHO CN1CC[C@]2(C1)CCC[N@H+](Cc1ccc(C(F)F)cc1)C2 ZINC000660662380 1120674923 /nfs/dbraw/zinc/67/49/23/1120674923.db2.gz JKEQXEHIZKGZHF-KRWDZBQOSA-N 1 3 294.389 3.542 20 0 CHADHO CN1CC[C@]2(C1)CCC[N@@H+](Cc1ccc(C(F)F)cc1)C2 ZINC000660662380 1120674926 /nfs/dbraw/zinc/67/49/26/1120674926.db2.gz JKEQXEHIZKGZHF-KRWDZBQOSA-N 1 3 294.389 3.542 20 0 CHADHO CC(C)C1CCC([N@@H+]2CCC[C@]3(CCCNC3)C2)CC1 ZINC000228086240 1120774494 /nfs/dbraw/zinc/77/44/94/1120774494.db2.gz GVLBIYPMGACVEC-ABHNRTSZSA-N 1 3 278.484 3.667 20 0 CHADHO CC(C)C1CCC([N@H+]2CCC[C@]3(CCCNC3)C2)CC1 ZINC000228086240 1120774497 /nfs/dbraw/zinc/77/44/97/1120774497.db2.gz GVLBIYPMGACVEC-ABHNRTSZSA-N 1 3 278.484 3.667 20 0 CHADHO CC[C@H](C)C[C@H](CC)[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000251929796 1120884169 /nfs/dbraw/zinc/88/41/69/1120884169.db2.gz RCRYLDLUSLMNLT-XHSDSOJGSA-N 1 3 254.462 3.521 20 0 CHADHO CC[C@H]1C[N@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)CC[C@H]1N ZINC000662273713 1120916736 /nfs/dbraw/zinc/91/67/36/1120916736.db2.gz YUSKYOVZMAFJFS-UKBAYJJMSA-N 1 3 286.463 3.630 20 0 CHADHO CC[C@H]1C[N@@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)CC[C@H]1N ZINC000662273713 1120916739 /nfs/dbraw/zinc/91/67/39/1120916739.db2.gz YUSKYOVZMAFJFS-UKBAYJJMSA-N 1 3 286.463 3.630 20 0 CHADHO C([NH2+][C@@H]1CCCC12CCCC2)[C@@H]1CCCN(CC2CC2)C1 ZINC000663465868 1120981079 /nfs/dbraw/zinc/98/10/79/1120981079.db2.gz LZOXZLRPPWCMRC-ZWKOTPCHSA-N 1 3 290.495 3.811 20 0 CHADHO CCCC[C@H](CC)[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663467503 1120981564 /nfs/dbraw/zinc/98/15/64/1120981564.db2.gz GJJUJNFHQLQIPO-IRXDYDNUSA-N 1 3 266.473 3.667 20 0 CHADHO CCN(CC)Cc1cc([C@@H](C)[NH2+]CC2CC2)ccc1OC ZINC000182312451 1128955935 /nfs/dbraw/zinc/95/59/35/1128955935.db2.gz AYMCKQHLTVRMTC-CQSZACIVSA-N 1 3 290.451 3.598 20 0 CHADHO C[C@@H](N[C@H]1CC[N@H+](CC2CC2)C1)c1cccc2ccccc21 ZINC000674048570 1121058645 /nfs/dbraw/zinc/05/86/45/1121058645.db2.gz XMBFBNNWPUIUAK-QAPCUYQASA-N 1 3 294.442 3.975 20 0 CHADHO C[C@@H](N[C@H]1CC[N@@H+](CC2CC2)C1)c1cccc2ccccc21 ZINC000674048570 1121058656 /nfs/dbraw/zinc/05/86/56/1121058656.db2.gz XMBFBNNWPUIUAK-QAPCUYQASA-N 1 3 294.442 3.975 20 0 CHADHO C[C@H](N[C@@H]1CC[N@H+](CC2CC2)C1)c1cccc2ccccc21 ZINC000674048569 1121059387 /nfs/dbraw/zinc/05/93/87/1121059387.db2.gz XMBFBNNWPUIUAK-MAUKXSAKSA-N 1 3 294.442 3.975 20 0 CHADHO C[C@H](N[C@@H]1CC[N@@H+](CC2CC2)C1)c1cccc2ccccc21 ZINC000674048569 1121059395 /nfs/dbraw/zinc/05/93/95/1121059395.db2.gz XMBFBNNWPUIUAK-MAUKXSAKSA-N 1 3 294.442 3.975 20 0 CHADHO CCCC[C@@H](CC)[NH2+]CCCN1CCCC[C@H]1C ZINC000251276610 1121108724 /nfs/dbraw/zinc/10/87/24/1121108724.db2.gz DPBFWCIVVJGBBV-HZPDHXFCSA-N 1 3 254.462 3.809 20 0 CHADHO CCN(CC)Cc1cc(C(F)(F)F)ccc1NC=[NH2+] ZINC001167871164 1121187345 /nfs/dbraw/zinc/18/73/45/1121187345.db2.gz KXUFLVLBVXSPFL-UHFFFAOYSA-N 1 3 273.302 3.566 20 0 CHADHO CCC1([NH+]2CCCC2)CCN(CC2CCCCC2)CC1 ZINC001175157684 1121188427 /nfs/dbraw/zinc/18/84/27/1121188427.db2.gz ZQBHOBAUUYEBBD-UHFFFAOYSA-N 1 3 278.484 3.907 20 0 CHADHO C[C@@H](c1ccccc1Cl)N1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000063197605 1121201309 /nfs/dbraw/zinc/20/13/09/1121201309.db2.gz GLJYLCZJPXCCGI-GUYCJALGSA-N 1 3 292.854 3.865 20 0 CHADHO C[C@@H](c1ccc(Cl)cc1)N1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000063197557 1121202239 /nfs/dbraw/zinc/20/22/39/1121202239.db2.gz GHMVCXRETYAAIH-SUMWQHHRSA-N 1 3 292.854 3.865 20 0 CHADHO CN1CCC2(CCC[N@@H+]2Cc2cccc3ccccc32)CC1 ZINC000512400795 1121312378 /nfs/dbraw/zinc/31/23/78/1121312378.db2.gz SJCXKPMHSRUGCZ-UHFFFAOYSA-N 1 3 294.442 3.900 20 0 CHADHO CN1CCC2(CCC[N@H+]2Cc2cccc3ccccc32)CC1 ZINC000512400795 1121312386 /nfs/dbraw/zinc/31/23/86/1121312386.db2.gz SJCXKPMHSRUGCZ-UHFFFAOYSA-N 1 3 294.442 3.900 20 0 CHADHO CCC[NH+]1CCC(N[C@H]2CC(C)(C)c3ccccc32)CC1 ZINC000675733946 1121345882 /nfs/dbraw/zinc/34/58/82/1121345882.db2.gz RNWKZSGVUBZHMO-SFHVURJKSA-N 1 3 286.463 3.873 20 0 CHADHO CC(C)c1ccc(CCN2CCC[C@@H]([NH+](C)C)CC2)cc1 ZINC000432796082 1121358954 /nfs/dbraw/zinc/35/89/54/1121358954.db2.gz FICBMCMFRRDGHR-LJQANCHMSA-N 1 3 288.479 3.769 20 0 CHADHO CC(C)c1ccc(CC[N@@H+]2CCC[C@@H](N(C)C)CC2)cc1 ZINC000432796082 1121358963 /nfs/dbraw/zinc/35/89/63/1121358963.db2.gz FICBMCMFRRDGHR-LJQANCHMSA-N 1 3 288.479 3.769 20 0 CHADHO CC(C)c1ccc(CC[N@H+]2CCC[C@@H](N(C)C)CC2)cc1 ZINC000432796082 1121358971 /nfs/dbraw/zinc/35/89/71/1121358971.db2.gz FICBMCMFRRDGHR-LJQANCHMSA-N 1 3 288.479 3.769 20 0 CHADHO CCC[NH+]1CCC(CN[C@@H](C)c2nc(C)sc2C)CC1 ZINC000676489835 1121439080 /nfs/dbraw/zinc/43/90/80/1121439080.db2.gz LPDSXBSFVHAPOF-LBPRGKRZSA-N 1 3 295.496 3.533 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)C1CC1 ZINC000512615254 1121494175 /nfs/dbraw/zinc/49/41/75/1121494175.db2.gz YWUKVMIOUHKGTD-JOCLIGHLSA-N 1 3 298.474 3.675 20 0 CHADHO Cc1ccc([C@@H](NCC2=CC[N@H+](C)CC2)C2CCCC2)o1 ZINC000543626730 1121533763 /nfs/dbraw/zinc/53/37/63/1121533763.db2.gz ISUDBDAKNKVJSR-SFHVURJKSA-N 1 3 288.435 3.671 20 0 CHADHO Cc1ccc([C@@H](NCC2=CC[N@@H+](C)CC2)C2CCCC2)o1 ZINC000543626730 1121533766 /nfs/dbraw/zinc/53/37/66/1121533766.db2.gz ISUDBDAKNKVJSR-SFHVURJKSA-N 1 3 288.435 3.671 20 0 CHADHO C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC001179592849 1121892201 /nfs/dbraw/zinc/89/22/01/1121892201.db2.gz IXEVKNMEGPYSTJ-VVWQDTPRSA-N 1 3 290.495 3.665 20 0 CHADHO CC(C)CCCCN1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC001179924873 1121923396 /nfs/dbraw/zinc/92/33/96/1121923396.db2.gz KQBNWIOJSFRRLE-WMZOPIPTSA-N 1 3 278.484 3.761 20 0 CHADHO CC(C)CCCCN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC001179924873 1121923400 /nfs/dbraw/zinc/92/34/00/1121923400.db2.gz KQBNWIOJSFRRLE-WMZOPIPTSA-N 1 3 278.484 3.761 20 0 CHADHO CC1(C)CCC[C@@H](C[N@@H+]2CC[C@H](CN3CCCC3)C2)C1 ZINC001179873172 1121924179 /nfs/dbraw/zinc/92/41/79/1121924179.db2.gz FANLFAHEOHCCFK-IAGOWNOFSA-N 1 3 278.484 3.621 20 0 CHADHO CC1(C)CCC[C@@H](C[N@H+]2CC[C@H](CN3CCCC3)C2)C1 ZINC001179873172 1121924185 /nfs/dbraw/zinc/92/41/85/1121924185.db2.gz FANLFAHEOHCCFK-IAGOWNOFSA-N 1 3 278.484 3.621 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2ccc(C3CC3)cc2)[C@H](C)C1 ZINC001179906651 1121929599 /nfs/dbraw/zinc/92/95/99/1121929599.db2.gz ZLGOKHIDONMNLM-BEFAXECRSA-N 1 3 286.463 3.726 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2ccc(C3CC3)cc2)[C@H](C)C1 ZINC001179906651 1121929606 /nfs/dbraw/zinc/92/96/06/1121929606.db2.gz ZLGOKHIDONMNLM-BEFAXECRSA-N 1 3 286.463 3.726 20 0 CHADHO Cc1cc(CN[C@@H](C[NH3+])C2CCCCC2)c2ccccc2n1 ZINC000420376527 1122004074 /nfs/dbraw/zinc/00/40/74/1122004074.db2.gz VEWXTCPSISICBD-IBGZPJMESA-N 1 3 297.446 3.540 20 0 CHADHO [NH3+]C[C@@H](NCCc1c(F)cccc1Cl)C1CCCCC1 ZINC000420374774 1122004749 /nfs/dbraw/zinc/00/47/49/1122004749.db2.gz SKOSIRQQLCXWBP-MRXNPFEDSA-N 1 3 298.833 3.519 20 0 CHADHO CCSCCCNC1CC[NH+]([C@@H]2CCCC[C@@H]2C)CC1 ZINC000502346943 1122076299 /nfs/dbraw/zinc/07/62/99/1122076299.db2.gz RMZAHFCVERGYFX-DOTOQJQBSA-N 1 3 298.540 3.762 20 0 CHADHO CCN(CC)CCC[NH2+][C@H](C)[C@H](C)c1ccc(OC)cc1 ZINC000514248434 1122391458 /nfs/dbraw/zinc/39/14/58/1122391458.db2.gz QBJCWUDJLFRWHA-JKSUJKDBSA-N 1 3 292.467 3.509 20 0 CHADHO CCN1CCC[C@H](C[NH2+]CCCC2CCCCC2)C1 ZINC000514758043 1122446267 /nfs/dbraw/zinc/44/62/67/1122446267.db2.gz GCNGJHSIHPOBFC-QGZVFWFLSA-N 1 3 266.473 3.668 20 0 CHADHO Cc1ccc(CCNC2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167958701 1122459415 /nfs/dbraw/zinc/45/94/15/1122459415.db2.gz IPKDAQQRUOYZNI-IHWFROFDSA-N 1 3 298.474 3.533 20 0 CHADHO Cc1ccc(CCNC2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167958701 1122459418 /nfs/dbraw/zinc/45/94/18/1122459418.db2.gz IPKDAQQRUOYZNI-IHWFROFDSA-N 1 3 298.474 3.533 20 0 CHADHO C(=C/C1CC1)\CN[C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716693192 1122636328 /nfs/dbraw/zinc/63/63/28/1122636328.db2.gz OPHFIYMBASPBLC-LEARLUKTSA-N 1 3 296.458 3.595 20 0 CHADHO C(=C/C1CC1)\CN[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716693192 1122636332 /nfs/dbraw/zinc/63/63/32/1122636332.db2.gz OPHFIYMBASPBLC-LEARLUKTSA-N 1 3 296.458 3.595 20 0 CHADHO C(=C/C1CC1)\C[NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000716693192 1122636336 /nfs/dbraw/zinc/63/63/36/1122636336.db2.gz OPHFIYMBASPBLC-LEARLUKTSA-N 1 3 296.458 3.595 20 0 CHADHO CCN(CC)CCC[NH2+][C@H](Cc1ccc(F)cc1)C(C)C ZINC001192848805 1122659948 /nfs/dbraw/zinc/65/99/48/1122659948.db2.gz QAXAWVOMXWXWNA-GOSISDBHSA-N 1 3 294.458 3.714 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000438070564 1122672967 /nfs/dbraw/zinc/67/29/67/1122672967.db2.gz FCZOJMGWNZCQFR-RBUKOAKNSA-N 1 3 288.479 3.817 20 0 CHADHO CC(C)N1CCC([N@H+](C)Cc2ccc(F)c(Cl)c2)CC1 ZINC000506328606 1122719516 /nfs/dbraw/zinc/71/95/16/1122719516.db2.gz VTQKUCJIZFOZLC-UHFFFAOYSA-N 1 3 298.833 3.784 20 0 CHADHO CC(C)N1CCC([N@@H+](C)Cc2ccc(F)c(Cl)c2)CC1 ZINC000506328606 1122719521 /nfs/dbraw/zinc/71/95/21/1122719521.db2.gz VTQKUCJIZFOZLC-UHFFFAOYSA-N 1 3 298.833 3.784 20 0 CHADHO C(C1CC1)N1[C@@H]2CC[C@H]1CC([N@H+]1C[C@@H]3CCCC[C@@H]3C1)C2 ZINC001167982826 1122903402 /nfs/dbraw/zinc/90/34/02/1122903402.db2.gz BNZZYJZUVOUFKD-MKAJOQBOSA-N 1 3 288.479 3.514 20 0 CHADHO C(C1CC1)N1[C@@H]2CC[C@H]1CC([N@@H+]1C[C@@H]3CCCC[C@@H]3C1)C2 ZINC001167982826 1122903407 /nfs/dbraw/zinc/90/34/07/1122903407.db2.gz BNZZYJZUVOUFKD-MKAJOQBOSA-N 1 3 288.479 3.514 20 0 CHADHO CC[C@H](F)CN1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000440774565 1123037767 /nfs/dbraw/zinc/03/77/67/1123037767.db2.gz YFQFIKQKPJULGO-RDJZCZTQSA-N 1 3 284.463 3.711 20 0 CHADHO CC[C@H](F)CN1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000440774565 1123037775 /nfs/dbraw/zinc/03/77/75/1123037775.db2.gz YFQFIKQKPJULGO-RDJZCZTQSA-N 1 3 284.463 3.711 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CCC[C@H](CN)[C@@H]1C ZINC001205902015 1123060263 /nfs/dbraw/zinc/06/02/63/1123060263.db2.gz GUTUPTJRPZWDIZ-YESZJQIVSA-N 1 3 266.473 3.818 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CCC[C@H](CN)[C@@H]1C ZINC001205902015 1123060267 /nfs/dbraw/zinc/06/02/67/1123060267.db2.gz GUTUPTJRPZWDIZ-YESZJQIVSA-N 1 3 266.473 3.818 20 0 CHADHO C([NH2+]C1CCN(C2CCCC2)CC1)C1CCCCC1 ZINC001200920903 1123064117 /nfs/dbraw/zinc/06/41/17/1123064117.db2.gz AGBDJHBUYCGURN-UHFFFAOYSA-N 1 3 264.457 3.563 20 0 CHADHO Cc1cccc(C)c1C[N@@H+](C)CC[C@H]1CCCCN1C ZINC000441371334 1123081979 /nfs/dbraw/zinc/08/19/79/1123081979.db2.gz TVLZOJRLJIDNKJ-QGZVFWFLSA-N 1 3 274.452 3.610 20 0 CHADHO Cc1cccc(C)c1C[N@H+](C)CC[C@H]1CCCCN1C ZINC000441371334 1123081982 /nfs/dbraw/zinc/08/19/82/1123081982.db2.gz TVLZOJRLJIDNKJ-QGZVFWFLSA-N 1 3 274.452 3.610 20 0 CHADHO C[C@@H]1[C@@H](C)CCC[N@H+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167995455 1123107183 /nfs/dbraw/zinc/10/71/83/1123107183.db2.gz GGICYWNGBWVFPM-PJFKJEBRSA-N 1 3 276.468 3.512 20 0 CHADHO C[C@@H]1[C@@H](C)CCC[N@@H+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167995455 1123107185 /nfs/dbraw/zinc/10/71/85/1123107185.db2.gz GGICYWNGBWVFPM-PJFKJEBRSA-N 1 3 276.468 3.512 20 0 CHADHO Cc1c(CN(C(C)C)[C@@H]2CCC[NH2+]CC2)ccc(F)c1F ZINC001206598768 1129101420 /nfs/dbraw/zinc/10/14/20/1129101420.db2.gz MLAFVPDQFFMQRJ-OAHLLOKOSA-N 1 3 296.405 3.626 20 0 CHADHO CCCCCC[N@@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001201754876 1123146125 /nfs/dbraw/zinc/14/61/25/1123146125.db2.gz LINVWPHZSADQRA-QGZVFWFLSA-N 1 3 266.473 3.907 20 0 CHADHO CCCCCC[N@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001201754876 1123146128 /nfs/dbraw/zinc/14/61/28/1123146128.db2.gz LINVWPHZSADQRA-QGZVFWFLSA-N 1 3 266.473 3.907 20 0 CHADHO C[C@@H]1CCC[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000152427465 1123217130 /nfs/dbraw/zinc/21/71/30/1123217130.db2.gz PDEAFKUNOWOAKZ-PBHICJAKSA-N 1 3 264.457 3.562 20 0 CHADHO CCN1CC[C@@H]([N@H+](C)Cc2ccc(Cl)c(C)c2)C[C@H]1C ZINC000507812445 1123219106 /nfs/dbraw/zinc/21/91/06/1123219106.db2.gz HNISFKPZLGWSKH-GDBMZVCRSA-N 1 3 294.870 3.953 20 0 CHADHO CCN1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)c(C)c2)C[C@H]1C ZINC000507812445 1123219109 /nfs/dbraw/zinc/21/91/09/1123219109.db2.gz HNISFKPZLGWSKH-GDBMZVCRSA-N 1 3 294.870 3.953 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C[C@H]1C[C@H](C)C[C@H](C)C1 ZINC000665239642 1123243768 /nfs/dbraw/zinc/24/37/68/1123243768.db2.gz WHYTXIOQZOKASO-CTASWTNQSA-N 1 3 289.467 3.572 20 0 CHADHO [NH3+][C@H]1C[C@@H](NCC2CCC(F)(F)CC2)c2ccccc21 ZINC000335022296 1123291412 /nfs/dbraw/zinc/29/14/12/1123291412.db2.gz KTHCGQIQRDJURX-LSDHHAIUSA-N 1 3 280.362 3.546 20 0 CHADHO Cc1cc([C@H](NCC[C@@H]([NH3+])C(C)C)C2CC2)ccc1F ZINC000665280421 1123313694 /nfs/dbraw/zinc/31/36/94/1123313694.db2.gz ANBMTAQAZQPUTO-IAGOWNOFSA-N 1 3 278.415 3.548 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@@H]1CCCc2c3ccccc3[nH]c21 ZINC000665282296 1123314336 /nfs/dbraw/zinc/31/43/36/1123314336.db2.gz VKCFFEBDGMOPCX-NVXWUHKLSA-N 1 3 285.435 3.508 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C[C@H](C)C1CCCCC1 ZINC000665284049 1123315692 /nfs/dbraw/zinc/31/56/92/1123315692.db2.gz ZMNBZCMGQYYFSN-UONOGXRCSA-N 1 3 289.467 3.716 20 0 CHADHO CCC[C@@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccsc1 ZINC000191200532 1123397457 /nfs/dbraw/zinc/39/74/57/1123397457.db2.gz YGFOEIHFJVIEKP-XJKSGUPXSA-N 1 3 278.465 3.663 20 0 CHADHO CCC[C@@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccsc1 ZINC000191200532 1123397462 /nfs/dbraw/zinc/39/74/62/1123397462.db2.gz YGFOEIHFJVIEKP-XJKSGUPXSA-N 1 3 278.465 3.663 20 0 CHADHO CC(C)C[C@@H](C[NH+]1CCC(N(C)C)CC1)c1ccccc1 ZINC000474154040 1123473461 /nfs/dbraw/zinc/47/34/61/1123473461.db2.gz POTPZEWRUBGTRN-SFHVURJKSA-N 1 3 288.479 3.842 20 0 CHADHO CC(C)C[C@@H](CN1CCC([NH+](C)C)CC1)c1ccccc1 ZINC000474154040 1123473463 /nfs/dbraw/zinc/47/34/63/1123473463.db2.gz POTPZEWRUBGTRN-SFHVURJKSA-N 1 3 288.479 3.842 20 0 CHADHO C[C@@H](c1cccc2ccccc21)N1CC[C@@]2(CC[NH2+]C2)C1 ZINC000313870180 1129129243 /nfs/dbraw/zinc/12/92/43/1129129243.db2.gz QSRIHCMKEZARSW-HNAYVOBHSA-N 1 3 280.415 3.586 20 0 CHADHO CCCN1CC[C@H](C[NH2+]C[C@H](c2ccccc2)C(C)C)C1 ZINC000474633563 1123562802 /nfs/dbraw/zinc/56/28/02/1123562802.db2.gz ZEBDNFBZAIHXDV-MJGOQNOKSA-N 1 3 288.479 3.748 20 0 CHADHO C[NH+](C)CC[C@@H](N[C@H]1CCc2c1cccc2F)C(C)(C)C ZINC000474934519 1123615685 /nfs/dbraw/zinc/61/56/85/1123615685.db2.gz QNNJHSLNGMHHRX-DLBZAZTESA-N 1 3 292.442 3.769 20 0 CHADHO C[C@H](CC[NH2+][C@H](c1ccccc1)C1CC1)N1CCCCC1 ZINC000544370468 1123641371 /nfs/dbraw/zinc/64/13/71/1123641371.db2.gz BIMLDWXKJQRRDR-VQIMIIECSA-N 1 3 286.463 3.992 20 0 CHADHO C[C@@H](c1cccs1)[N@H+](C)CCCN1CCCCC1 ZINC000193472936 1123757913 /nfs/dbraw/zinc/75/79/13/1123757913.db2.gz PIHBXOAVNGWDFZ-AWEZNQCLSA-N 1 3 266.454 3.617 20 0 CHADHO C[C@@H](c1cccs1)[N@@H+](C)CCCN1CCCCC1 ZINC000193472936 1123757921 /nfs/dbraw/zinc/75/79/21/1123757921.db2.gz PIHBXOAVNGWDFZ-AWEZNQCLSA-N 1 3 266.454 3.617 20 0 CHADHO CC1(CC[NH2+][C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]23)CC1 ZINC000475216111 1123825304 /nfs/dbraw/zinc/82/53/04/1123825304.db2.gz MZAVGQOSRDDNKX-GUDVDZBRSA-N 1 3 298.474 3.677 20 0 CHADHO CC1(CC[NH2+][C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)CC1 ZINC000475216110 1123826097 /nfs/dbraw/zinc/82/60/97/1123826097.db2.gz MZAVGQOSRDDNKX-GBESFXJTSA-N 1 3 298.474 3.677 20 0 CHADHO CC[C@H](c1ccccc1)[N@@H+]1CC[C@@H]2[C@H](CCCN2C)C1 ZINC000158615113 1129148321 /nfs/dbraw/zinc/14/83/21/1129148321.db2.gz HUYHVOSHDQWKSS-KZNAEPCWSA-N 1 3 272.436 3.554 20 0 CHADHO CC[C@H](c1ccccc1)[N@H+]1CC[C@@H]2[C@H](CCCN2C)C1 ZINC000158615113 1129148325 /nfs/dbraw/zinc/14/83/25/1129148325.db2.gz HUYHVOSHDQWKSS-KZNAEPCWSA-N 1 3 272.436 3.554 20 0 CHADHO C[C@H]1CC[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)CS1 ZINC000655718431 1123998490 /nfs/dbraw/zinc/99/84/90/1123998490.db2.gz JKIUEZPRWGBBKT-GOEBONIOSA-N 1 3 296.524 3.657 20 0 CHADHO CCc1cccc(Cl)c1CN1CCC(C[NH+](C)C)CC1 ZINC000475578871 1124018678 /nfs/dbraw/zinc/01/86/78/1124018678.db2.gz RDRUWKOFWCLVEC-UHFFFAOYSA-N 1 3 294.870 3.676 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]CC[C@H](C)c2ccccc2)C1 ZINC000249043333 1124029638 /nfs/dbraw/zinc/02/96/38/1124029638.db2.gz VJBXALKRSQCTAC-ROUUACIJSA-N 1 3 288.479 3.890 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC(C)(C)C(C)(F)F)CC1 ZINC000866542864 1124080842 /nfs/dbraw/zinc/08/08/42/1124080842.db2.gz ONMGJHSBARQRBV-UHFFFAOYSA-N 1 3 276.415 3.520 20 0 CHADHO Cc1ccc2nccc(N3CCC4(CCC[N@H+]4C)CC3)c2c1 ZINC000445597755 1124093098 /nfs/dbraw/zinc/09/30/98/1124093098.db2.gz STLKPMLMYRKUOE-UHFFFAOYSA-N 1 3 295.430 3.608 20 0 CHADHO Cc1ccc2nccc(N3CCC4(CCC[N@@H+]4C)CC3)c2c1 ZINC000445597755 1124093101 /nfs/dbraw/zinc/09/31/01/1124093101.db2.gz STLKPMLMYRKUOE-UHFFFAOYSA-N 1 3 295.430 3.608 20 0 CHADHO C[C@H](CC[N@@H+]1CCCC12CCN(C)CC2)c1ccccc1 ZINC000446793433 1124122757 /nfs/dbraw/zinc/12/27/57/1124122757.db2.gz DSWSIXIULWELGY-QGZVFWFLSA-N 1 3 286.463 3.740 20 0 CHADHO C[C@H](CC[N@H+]1CCCC12CCN(C)CC2)c1ccccc1 ZINC000446793433 1124122759 /nfs/dbraw/zinc/12/27/59/1124122759.db2.gz DSWSIXIULWELGY-QGZVFWFLSA-N 1 3 286.463 3.740 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1cccc(F)c1 ZINC000446939157 1124128862 /nfs/dbraw/zinc/12/88/62/1124128862.db2.gz ZPWKLGLBUJZAPI-ZACQAIPSSA-N 1 3 278.415 3.739 20 0 CHADHO CC[C@H](N[C@H]1CC[NH2+]CC(C)(C)C1)c1cccs1 ZINC000635008995 1129169918 /nfs/dbraw/zinc/16/99/18/1129169918.db2.gz FTLIYPKDGXRCJR-STQMWFEESA-N 1 3 266.454 3.567 20 0 CHADHO C[C@H](C[NH2+]CC[C@H](C)N1CCCCC1)c1ccc(F)cc1 ZINC000526116305 1124512490 /nfs/dbraw/zinc/51/24/90/1124512490.db2.gz VBOIHYLIIOKTHY-CVEARBPZSA-N 1 3 292.442 3.783 20 0 CHADHO CC[C@@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)C1CCCC1 ZINC000449131480 1124652690 /nfs/dbraw/zinc/65/26/90/1124652690.db2.gz MWQNCTFPHVVARM-NVXWUHKLSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]Cc2cccc3ccoc32)C1 ZINC000449132730 1124654263 /nfs/dbraw/zinc/65/42/63/1124654263.db2.gz VZQIATQUXQZVLX-HNNXBMFYSA-N 1 3 286.419 3.643 20 0 CHADHO CC[C@H]([NH2+]C[C@@H]1CCCN(CC(C)C)C1)C1CCC1 ZINC000449212462 1124670681 /nfs/dbraw/zinc/67/06/81/1124670681.db2.gz SQJPIBFIPBLMTE-RDJZCZTQSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC(C)(C)C2CCC2)CC1 ZINC000449484995 1124765185 /nfs/dbraw/zinc/76/51/85/1124765185.db2.gz JYTFNFUNRZLMJH-UHFFFAOYSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@H](NCc1cccs1)c1cccc(C[NH+](C)C)c1 ZINC000820806015 1131302724 /nfs/dbraw/zinc/30/27/24/1131302724.db2.gz XKBAQHZBGDLDJK-ZDUSSCGKSA-N 1 3 274.433 3.661 20 0 CHADHO Cc1c(Cl)cccc1C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)N2C ZINC000877517311 1125038953 /nfs/dbraw/zinc/03/89/53/1125038953.db2.gz LRDASQJBWOZYOZ-XYPWUTKMSA-N 1 3 292.854 3.705 20 0 CHADHO Cc1c(Cl)cccc1C[N@H+](C)C1C[C@H]2CC[C@@H](C1)N2C ZINC000877517311 1125038961 /nfs/dbraw/zinc/03/89/61/1125038961.db2.gz LRDASQJBWOZYOZ-XYPWUTKMSA-N 1 3 292.854 3.705 20 0 CHADHO CCCCCC1CCC([NH2+]C2(C)CCNCC2)CC1 ZINC001246129229 1131343929 /nfs/dbraw/zinc/34/39/29/1131343929.db2.gz QUYLQXBCHPOAAU-UHFFFAOYSA-N 1 3 266.473 3.857 20 0 CHADHO C[C@H]([NH2+][C@H]1CCCC2(CC2)C1)[C@H]1CCCN(C2CCC2)C1 ZINC000883216727 1125379425 /nfs/dbraw/zinc/37/94/25/1125379425.db2.gz VNYFDJXGAMBIHW-ULQDDVLXSA-N 1 3 290.495 3.952 20 0 CHADHO CCSc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)cc1 ZINC000883245070 1125383130 /nfs/dbraw/zinc/38/31/30/1125383130.db2.gz CZHQWBXMQRELRJ-MQVJKMGUSA-N 1 3 290.476 3.513 20 0 CHADHO CC[C@H](C[C@@H](C)CC)[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000040622056 1125388888 /nfs/dbraw/zinc/38/88/88/1125388888.db2.gz RCRYLDLUSLMNLT-HRCADAONSA-N 1 3 254.462 3.521 20 0 CHADHO C[N@@H+]1CCC[C@@H]2CN(Cc3ccc4ccccc4c3)CC[C@@H]21 ZINC000532536501 1125408838 /nfs/dbraw/zinc/40/88/38/1125408838.db2.gz OAGMSUNIGKRZAT-UXHICEINSA-N 1 3 294.442 3.756 20 0 CHADHO C[N@H+]1CCC[C@@H]2CN(Cc3ccc4ccccc4c3)CC[C@@H]21 ZINC000532536501 1125408839 /nfs/dbraw/zinc/40/88/39/1125408839.db2.gz OAGMSUNIGKRZAT-UXHICEINSA-N 1 3 294.442 3.756 20 0 CHADHO CN1CCC[C@@H]2C[N@H+](Cc3ccc4ccccc4c3)CC[C@@H]21 ZINC000532536501 1125408842 /nfs/dbraw/zinc/40/88/42/1125408842.db2.gz OAGMSUNIGKRZAT-UXHICEINSA-N 1 3 294.442 3.756 20 0 CHADHO CN1CCC[C@@H]2C[N@@H+](Cc3ccc4ccccc4c3)CC[C@@H]21 ZINC000532536501 1125408844 /nfs/dbraw/zinc/40/88/44/1125408844.db2.gz OAGMSUNIGKRZAT-UXHICEINSA-N 1 3 294.442 3.756 20 0 CHADHO Cc1cc(C)c(C[N@@H+]2CC[C@H]3[C@@H](CCCN3C)C2)c(C)c1 ZINC000532538399 1125410207 /nfs/dbraw/zinc/41/02/07/1125410207.db2.gz YRGWQLKGTCHGAJ-HKUYNNGSSA-N 1 3 286.463 3.528 20 0 CHADHO Cc1cc(C)c(C[N@H+]2CC[C@H]3[C@@H](CCCN3C)C2)c(C)c1 ZINC000532538399 1125410209 /nfs/dbraw/zinc/41/02/09/1125410209.db2.gz YRGWQLKGTCHGAJ-HKUYNNGSSA-N 1 3 286.463 3.528 20 0 CHADHO CSC(C)(C)C[C@@H](C)[NH2+]CCCN1CCCC[C@H]1C ZINC001258320841 1129194026 /nfs/dbraw/zinc/19/40/26/1129194026.db2.gz FSKPCWIGSPUKBW-HUUCEWRRSA-N 1 3 286.529 3.761 20 0 CHADHO C[C@@H](NCc1cccc(-c2ccccc2)c1)[C@@H]1CCC[NH2+]C1 ZINC000414855689 1129196239 /nfs/dbraw/zinc/19/62/39/1129196239.db2.gz NGVIPEZCUNMNCO-OXQOHEQNSA-N 1 3 294.442 3.831 20 0 CHADHO CCCCc1ccc(C[N@@H+]2CC[C@@]3(CCN(C)C3)C2)s1 ZINC001138755454 1129214256 /nfs/dbraw/zinc/21/42/56/1129214256.db2.gz PJONEUJPKURVFM-QGZVFWFLSA-N 1 3 292.492 3.618 20 0 CHADHO CCCCc1ccc(C[N@H+]2CC[C@@]3(CCN(C)C3)C2)s1 ZINC001138755454 1129214260 /nfs/dbraw/zinc/21/42/60/1129214260.db2.gz PJONEUJPKURVFM-QGZVFWFLSA-N 1 3 292.492 3.618 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2cccc3ncccc23)C[C@H]1C ZINC000638111126 1129243534 /nfs/dbraw/zinc/24/35/34/1129243534.db2.gz RIYXVLOEGZHUDD-WBVHZDCISA-N 1 3 297.446 3.539 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2cccc3ncccc23)C[C@H]1C ZINC000638111126 1129243536 /nfs/dbraw/zinc/24/35/36/1129243536.db2.gz RIYXVLOEGZHUDD-WBVHZDCISA-N 1 3 297.446 3.539 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2c2cccs2)C1 ZINC000639169615 1129288765 /nfs/dbraw/zinc/28/87/65/1129288765.db2.gz HNBAIEGKSPSBSN-FXUDXRNXSA-N 1 3 292.492 3.560 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@@H+]1CCCC[C@H](CN)C1 ZINC001206606312 1129381330 /nfs/dbraw/zinc/38/13/30/1129381330.db2.gz KDKVKLFNGQJVAA-IAGOWNOFSA-N 1 3 266.473 3.820 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@H+]1CCCC[C@H](CN)C1 ZINC001206606312 1129381332 /nfs/dbraw/zinc/38/13/32/1129381332.db2.gz KDKVKLFNGQJVAA-IAGOWNOFSA-N 1 3 266.473 3.820 20 0 CHADHO Clc1cccc2c1CC[C@H]2NCc1ccc2c(c1)C[NH2+]C2 ZINC000643523460 1129443776 /nfs/dbraw/zinc/44/37/76/1129443776.db2.gz NLOGCGLGRHFTMC-GOSISDBHSA-N 1 3 298.817 3.720 20 0 CHADHO Cc1ncc([C@H](C)N[C@@H](CCC[NH3+])c2ccccc2)s1 ZINC000643543763 1129445232 /nfs/dbraw/zinc/44/52/32/1129445232.db2.gz OHIZYYBMYCOOSH-WFASDCNBSA-N 1 3 289.448 3.582 20 0 CHADHO Cc1ncc([C@H](C)N[C@H](CCC[NH3+])c2ccccc2)s1 ZINC000643543762 1129445330 /nfs/dbraw/zinc/44/53/30/1129445330.db2.gz OHIZYYBMYCOOSH-SWLSCSKDSA-N 1 3 289.448 3.582 20 0 CHADHO C[N@H+](CCCN1CCCC1)[C@@H]1CCc2cc(Cl)ccc21 ZINC000796055726 1129463713 /nfs/dbraw/zinc/46/37/13/1129463713.db2.gz DRJDISQQXPHDTN-QGZVFWFLSA-N 1 3 292.854 3.745 20 0 CHADHO C[N@@H+](CCCN1CCCC1)[C@@H]1CCc2cc(Cl)ccc21 ZINC000796055726 1129463716 /nfs/dbraw/zinc/46/37/16/1129463716.db2.gz DRJDISQQXPHDTN-QGZVFWFLSA-N 1 3 292.854 3.745 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN(CC(C)(C)c2ccccc2)C1 ZINC000180524092 1129487255 /nfs/dbraw/zinc/48/72/55/1129487255.db2.gz SQQYUUSPFWKDPT-KRWDZBQOSA-N 1 3 288.479 3.628 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN(CC(C)(C)c2ccccc2)C1 ZINC000180524092 1129487257 /nfs/dbraw/zinc/48/72/57/1129487257.db2.gz SQQYUUSPFWKDPT-KRWDZBQOSA-N 1 3 288.479 3.628 20 0 CHADHO CN1CCC[C@@H]1CC[N@@H+]1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000646117953 1129524066 /nfs/dbraw/zinc/52/40/66/1129524066.db2.gz BUEOROLNWVHFFY-MOPGFXCFSA-N 1 3 296.458 3.864 20 0 CHADHO CN1CCC[C@@H]1CC[N@H+]1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000646117953 1129524069 /nfs/dbraw/zinc/52/40/69/1129524069.db2.gz BUEOROLNWVHFFY-MOPGFXCFSA-N 1 3 296.458 3.864 20 0 CHADHO CC[C@@H]1C[N@@H+]([C@@H]2CC[C@](C)(c3ccccc3)C2)CC[C@H]1N ZINC000647497297 1129579489 /nfs/dbraw/zinc/57/94/89/1129579489.db2.gz BXVRCVRNGWELTL-OWYHZJEWSA-N 1 3 286.463 3.556 20 0 CHADHO CC[C@@H]1C[N@H+]([C@@H]2CC[C@](C)(c3ccccc3)C2)CC[C@H]1N ZINC000647497297 1129579491 /nfs/dbraw/zinc/57/94/91/1129579491.db2.gz BXVRCVRNGWELTL-OWYHZJEWSA-N 1 3 286.463 3.556 20 0 CHADHO NCCC[N@@H+](Cc1cccc2cnccc21)CC1CCCC1 ZINC000647541380 1129580722 /nfs/dbraw/zinc/58/07/22/1129580722.db2.gz DTDMZLBTEQXJKB-UHFFFAOYSA-N 1 3 297.446 3.576 20 0 CHADHO NCCC[N@H+](Cc1cccc2cnccc21)CC1CCCC1 ZINC000647541380 1129580726 /nfs/dbraw/zinc/58/07/26/1129580726.db2.gz DTDMZLBTEQXJKB-UHFFFAOYSA-N 1 3 297.446 3.576 20 0 CHADHO Clc1sccc1CN1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647543904 1129581173 /nfs/dbraw/zinc/58/11/73/1129581173.db2.gz UGKAQBPUNSYOGZ-STQMWFEESA-N 1 3 298.883 3.613 20 0 CHADHO CCCN(C[C@H]1CC[NH2+]C1)[C@H](C)c1cc2ccccc2o1 ZINC000647882241 1129586961 /nfs/dbraw/zinc/58/69/61/1129586961.db2.gz ZVFNFTKSJZXHIE-CABCVRRESA-N 1 3 286.419 3.815 20 0 CHADHO CC(C)c1ccc([C@@H](C)N2CCC(C)([NH3+])CC2)cc1 ZINC000647924310 1129588431 /nfs/dbraw/zinc/58/84/31/1129588431.db2.gz XDCBKVAKRGSDFS-CQSZACIVSA-N 1 3 260.425 3.684 20 0 CHADHO CC[C@@H]1CN(CCCc2cccc3ccccc32)CC[C@@H]1[NH3+] ZINC000647936282 1129588631 /nfs/dbraw/zinc/58/86/31/1129588631.db2.gz ATUGROIZTGPUIP-UZLBHIALSA-N 1 3 296.458 3.832 20 0 CHADHO CC[C@@H]1C[N@H+](CCCc2cccc3ccccc32)CC[C@@H]1N ZINC000647936282 1129588636 /nfs/dbraw/zinc/58/86/36/1129588636.db2.gz ATUGROIZTGPUIP-UZLBHIALSA-N 1 3 296.458 3.832 20 0 CHADHO CC[C@@H]1C[N@@H+](CCCc2cccc3ccccc32)CC[C@@H]1N ZINC000647936282 1129588639 /nfs/dbraw/zinc/58/86/39/1129588639.db2.gz ATUGROIZTGPUIP-UZLBHIALSA-N 1 3 296.458 3.832 20 0 CHADHO Cc1ccc(CN[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc12 ZINC001169099557 1129696496 /nfs/dbraw/zinc/69/64/96/1129696496.db2.gz BHLILDXPXRBRCS-BCDXTJNWSA-N 1 3 294.442 3.863 20 0 CHADHO Cc1ccc(CN[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc12 ZINC001169099557 1129696497 /nfs/dbraw/zinc/69/64/97/1129696497.db2.gz BHLILDXPXRBRCS-BCDXTJNWSA-N 1 3 294.442 3.863 20 0 CHADHO CN1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1(c3cccc(Cl)c3)CC1)C2 ZINC001169098418 1129696649 /nfs/dbraw/zinc/69/66/49/1129696649.db2.gz HVDMBKLLBFSTBZ-PHZGNYQRSA-N 1 3 290.838 3.544 20 0 CHADHO CC(C)[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001169101272 1129697583 /nfs/dbraw/zinc/69/75/83/1129697583.db2.gz QEOAHCNKLZYPHX-ZJPYXAASSA-N 1 3 290.426 3.738 20 0 CHADHO CC(C)[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001169101272 1129697584 /nfs/dbraw/zinc/69/75/84/1129697584.db2.gz QEOAHCNKLZYPHX-ZJPYXAASSA-N 1 3 290.426 3.738 20 0 CHADHO CC(C)=CCC/C(C)=C/C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)N2C ZINC001169100659 1129697721 /nfs/dbraw/zinc/69/77/21/1129697721.db2.gz KYEUYQCXJSFYLA-BCHMHWIISA-N 1 3 276.468 3.894 20 0 CHADHO CC(C)=CCC/C(C)=C/CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169100659 1129697722 /nfs/dbraw/zinc/69/77/22/1129697722.db2.gz KYEUYQCXJSFYLA-BCHMHWIISA-N 1 3 276.468 3.894 20 0 CHADHO CC(C)=CCC/C(C)=C/CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169100659 1129697724 /nfs/dbraw/zinc/69/77/24/1129697724.db2.gz KYEUYQCXJSFYLA-BCHMHWIISA-N 1 3 276.468 3.894 20 0 CHADHO CN1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccc(C(C)(C)C)cc1)C2 ZINC001169090892 1129700265 /nfs/dbraw/zinc/70/02/65/1129700265.db2.gz NKJZKWCTRYBNOK-BCDXTJNWSA-N 1 3 286.463 3.699 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@H](N[C@H](CC1CC1)c1ccccc1)C2 ZINC001169116319 1129700620 /nfs/dbraw/zinc/70/06/20/1129700620.db2.gz PXQNNQZVWLOROW-AKHDSKFASA-N 1 3 284.447 3.743 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](N[C@H](CC1CC1)c1ccccc1)C2 ZINC001169116319 1129700621 /nfs/dbraw/zinc/70/06/21/1129700621.db2.gz PXQNNQZVWLOROW-AKHDSKFASA-N 1 3 284.447 3.743 20 0 CHADHO CCC[C@H](NC1CC[NH+](CC)CC1)c1ccc(F)cc1 ZINC001169230315 1129710463 /nfs/dbraw/zinc/71/04/63/1129710463.db2.gz XWXDQPNWCLAXIP-KRWDZBQOSA-N 1 3 278.415 3.741 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@@H]1CCCc2sccc21 ZINC000650757791 1129722068 /nfs/dbraw/zinc/72/20/68/1129722068.db2.gz AVGDFBGDFLXMMX-MRXNPFEDSA-N 1 3 286.444 3.635 20 0 CHADHO Cc1ccc2c(c1)[C@H]([NH3+])CCCN2c1cncc2cc[nH]c21 ZINC001169694534 1129747229 /nfs/dbraw/zinc/74/72/29/1129747229.db2.gz CFSVOHOYENLFQI-OAHLLOKOSA-N 1 3 292.386 3.803 20 0 CHADHO Cc1ccccc1[C@@H]1C[C@H]1NC1CC[NH+](C(C)(C)C)CC1 ZINC000651910949 1129751388 /nfs/dbraw/zinc/75/13/88/1129751388.db2.gz SWLRELATILJIIK-ZWKOTPCHSA-N 1 3 286.463 3.703 20 0 CHADHO CN(CC/C=C/c1ccccc1)CCC[NH+]1CCCC1 ZINC001169761258 1129755165 /nfs/dbraw/zinc/75/51/65/1129755165.db2.gz GLWZGICDZNJIHT-LFYBBSHMSA-N 1 3 272.436 3.508 20 0 CHADHO C[C@H]([NH2+]C1C[C@@H]2CCC[C@H]2C1)[C@H]1CCCN(C2CCC2)C1 ZINC000902948929 1130089606 /nfs/dbraw/zinc/08/96/06/1130089606.db2.gz YNPBXHZCXUDIMF-QAETUUGQSA-N 1 3 290.495 3.808 20 0 CHADHO CC[C@]1(C)CCC[C@@H]1N[C@H](CC[NH+](C)C)c1cccnc1 ZINC000903378129 1130168415 /nfs/dbraw/zinc/16/84/15/1130168415.db2.gz OSJGJHXTKLSABQ-FGTMMUONSA-N 1 3 289.467 3.633 20 0 CHADHO Cl/C=C/C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000903443174 1130177164 /nfs/dbraw/zinc/17/71/64/1130177164.db2.gz CNUNAFUJOJYTGA-QASIXUJNSA-N 1 3 290.838 3.524 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]C2CCN(CC3CCCCC3)CC2)C1 ZINC001170112325 1130264091 /nfs/dbraw/zinc/26/40/91/1130264091.db2.gz JBOXTHIIWFMBJV-QAPCUYQASA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H](CC[NH2+]C[C@@H]1CCc2ccccc21)N1CCCCC1 ZINC000790056717 1130288709 /nfs/dbraw/zinc/28/87/09/1130288709.db2.gz XKXVRPAHRBZVGC-WMZOPIPTSA-N 1 3 286.463 3.571 20 0 CHADHO C[C@@H](CC[NH2+]C[C@H]1CCc2ccccc21)N1CCCCC1 ZINC000790056713 1130289058 /nfs/dbraw/zinc/28/90/58/1130289058.db2.gz XKXVRPAHRBZVGC-FUHWJXTLSA-N 1 3 286.463 3.571 20 0 CHADHO Cc1ccccc1[C@H](N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)C1CC1 ZINC000677240279 1130297654 /nfs/dbraw/zinc/29/76/54/1130297654.db2.gz FCTATHUQNBONSY-ZHALLVOQSA-N 1 3 284.447 3.663 20 0 CHADHO Cc1ccccc1[C@H](N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)C1CC1 ZINC000677240279 1130297658 /nfs/dbraw/zinc/29/76/58/1130297658.db2.gz FCTATHUQNBONSY-ZHALLVOQSA-N 1 3 284.447 3.663 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2cccc3cnccc32)C[C@@H]1C ZINC000679990546 1130568618 /nfs/dbraw/zinc/56/86/18/1130568618.db2.gz VEPYPQYFZSTHCC-MAUKXSAKSA-N 1 3 297.446 3.539 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2cccc3cnccc32)C[C@@H]1C ZINC000679990546 1130568623 /nfs/dbraw/zinc/56/86/23/1130568623.db2.gz VEPYPQYFZSTHCC-MAUKXSAKSA-N 1 3 297.446 3.539 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@@H+]1CCCC12CCNCC2 ZINC001235141339 1130714092 /nfs/dbraw/zinc/71/40/92/1130714092.db2.gz RGBKUCVLYONLMX-QGZVFWFLSA-N 1 3 278.484 3.977 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@H+]1CCCC12CCNCC2 ZINC001235141339 1130714098 /nfs/dbraw/zinc/71/40/98/1130714098.db2.gz RGBKUCVLYONLMX-QGZVFWFLSA-N 1 3 278.484 3.977 20 0 CHADHO Fc1ccc(CN2CCCC23CC[NH2+]CC3)c2ccccc12 ZINC001235145945 1130714552 /nfs/dbraw/zinc/71/45/52/1130714552.db2.gz YVBJRXBWIDBYFI-UHFFFAOYSA-N 1 3 298.405 3.697 20 0 CHADHO Fc1ccc(C[N@@H+]2CCCC23CCNCC3)c2ccccc12 ZINC001235145945 1130714556 /nfs/dbraw/zinc/71/45/56/1130714556.db2.gz YVBJRXBWIDBYFI-UHFFFAOYSA-N 1 3 298.405 3.697 20 0 CHADHO Fc1ccc(C[N@H+]2CCCC23CCNCC3)c2ccccc12 ZINC001235145945 1130714562 /nfs/dbraw/zinc/71/45/62/1130714562.db2.gz YVBJRXBWIDBYFI-UHFFFAOYSA-N 1 3 298.405 3.697 20 0 CHADHO Cc1ccc([C@H](C)CC[N@@H+]2CCCCC23CCNCC3)o1 ZINC001235191192 1130720761 /nfs/dbraw/zinc/72/07/61/1130720761.db2.gz QJMMFGFBTXKAPB-OAHLLOKOSA-N 1 3 290.451 3.690 20 0 CHADHO Cc1ccc([C@H](C)CC[N@H+]2CCCCC23CCNCC3)o1 ZINC001235191192 1130720766 /nfs/dbraw/zinc/72/07/66/1130720766.db2.gz QJMMFGFBTXKAPB-OAHLLOKOSA-N 1 3 290.451 3.690 20 0 CHADHO Cc1ccccc1[C@@H]1CCCN1CC[C@@H]1CCCC[NH2+]1 ZINC001235446282 1130746062 /nfs/dbraw/zinc/74/60/62/1130746062.db2.gz XNNXGZJPYGALAC-WMZOPIPTSA-N 1 3 272.436 3.664 20 0 CHADHO Cc1cc(C)cc(CC[NH2+]C2CCN(CC(C)C)CC2)c1 ZINC000782155067 1130756721 /nfs/dbraw/zinc/75/67/21/1130756721.db2.gz OVIKEKZENHNNFQ-UHFFFAOYSA-N 1 3 288.479 3.556 20 0 CHADHO [NH3+]C[C@H]1CCCN(Cc2cccc(-c3ccc(F)cc3)c2)C1 ZINC001235673144 1130764046 /nfs/dbraw/zinc/76/40/46/1130764046.db2.gz LUBZAOPLCOAGJK-MRXNPFEDSA-N 1 3 298.405 3.663 20 0 CHADHO c1csc(C2CCN(Cc3ccc4c(c3)C[NH2+]C4)CC2)c1 ZINC001235690753 1130770453 /nfs/dbraw/zinc/77/04/53/1130770453.db2.gz CPPIMZUCLXIKDS-UHFFFAOYSA-N 1 3 298.455 3.731 20 0 CHADHO CC[N@H+](Cc1sc2ccccc2c1C)C1CCNCC1 ZINC001235759892 1130776248 /nfs/dbraw/zinc/77/62/48/1130776248.db2.gz DSCWUMZPVGQOTI-UHFFFAOYSA-N 1 3 288.460 3.784 20 0 CHADHO CC[N@@H+](Cc1sc2ccccc2c1C)C1CCNCC1 ZINC001235759892 1130776252 /nfs/dbraw/zinc/77/62/52/1130776252.db2.gz DSCWUMZPVGQOTI-UHFFFAOYSA-N 1 3 288.460 3.784 20 0 CHADHO CCN(Cc1sc2ccccc2c1C)C1CC[NH2+]CC1 ZINC001235759892 1130776257 /nfs/dbraw/zinc/77/62/57/1130776257.db2.gz DSCWUMZPVGQOTI-UHFFFAOYSA-N 1 3 288.460 3.784 20 0 CHADHO COc1c(C)cc([C@@H](C)[NH2+]C[C@@H](C)CN(C)C)cc1Cl ZINC000813876940 1130793836 /nfs/dbraw/zinc/79/38/36/1130793836.db2.gz DXOLMEJUTIIABP-DGCLKSJQSA-N 1 3 298.858 3.505 20 0 CHADHO CN(CCCC[NH3+])Cc1sc2ccccc2c1Cl ZINC001235948902 1130812266 /nfs/dbraw/zinc/81/22/66/1130812266.db2.gz SFRKLRGGTNPOHS-UHFFFAOYSA-N 1 3 282.840 3.725 20 0 CHADHO Cc1c2ccccc2sc1CN(C)C[C@@H]1CCC[NH2+]C1 ZINC001235950630 1130815026 /nfs/dbraw/zinc/81/50/26/1130815026.db2.gz JFRNHDDLAFNRNI-CQSZACIVSA-N 1 3 288.460 3.641 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1(C)C ZINC001170728785 1130831486 /nfs/dbraw/zinc/83/14/86/1130831486.db2.gz YCDONKOUVACKKK-YOWGUQMCSA-N 1 3 278.484 3.662 20 0 CHADHO [NH3+]Cc1ccc(-c2cccc(CN3CCCCC3)c2F)cc1 ZINC001236011538 1130832023 /nfs/dbraw/zinc/83/20/23/1130832023.db2.gz IXPSOZMMJHFXBR-UHFFFAOYSA-N 1 3 298.405 3.937 20 0 CHADHO C[C@H]1C[C@@H](N)C[N@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001236047186 1130837133 /nfs/dbraw/zinc/83/71/33/1130837133.db2.gz LDPSJURSMXUQDK-UONOGXRCSA-N 1 3 299.462 3.635 20 0 CHADHO C[C@H]1C[C@@H](N)C[N@@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001236047186 1130837137 /nfs/dbraw/zinc/83/71/37/1130837137.db2.gz LDPSJURSMXUQDK-UONOGXRCSA-N 1 3 299.462 3.635 20 0 CHADHO C[C@@H]1C[C@@H](N)C[N@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001236047187 1130837894 /nfs/dbraw/zinc/83/78/94/1130837894.db2.gz LDPSJURSMXUQDK-ZIAGYGMSSA-N 1 3 299.462 3.635 20 0 CHADHO C[C@@H]1C[C@@H](N)C[N@@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001236047187 1130837899 /nfs/dbraw/zinc/83/78/99/1130837899.db2.gz LDPSJURSMXUQDK-ZIAGYGMSSA-N 1 3 299.462 3.635 20 0 CHADHO Cc1c(C[N@@H+]2C[C@H](C)C[C@@H](N)C2)cccc1-c1ccccc1 ZINC001236052434 1130840933 /nfs/dbraw/zinc/84/09/33/1130840933.db2.gz QVVREKPCLJIMHY-DNVCBOLYSA-N 1 3 294.442 3.831 20 0 CHADHO Cc1c(C[N@H+]2C[C@H](C)C[C@@H](N)C2)cccc1-c1ccccc1 ZINC001236052434 1130840943 /nfs/dbraw/zinc/84/09/43/1130840943.db2.gz QVVREKPCLJIMHY-DNVCBOLYSA-N 1 3 294.442 3.831 20 0 CHADHO C[NH2+]C[C@H]1CCN(Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001236068920 1130846874 /nfs/dbraw/zinc/84/68/74/1130846874.db2.gz YXRWWWMVFPHECV-CQSZACIVSA-N 1 3 299.462 3.507 20 0 CHADHO C[N@H+](Cc1ccc(C(C)(C)C)cc1)[C@H]1CCCC[C@@H]1N ZINC001236211416 1130887122 /nfs/dbraw/zinc/88/71/22/1130887122.db2.gz HWMNYBZHMSXAHL-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO C[N@@H+](Cc1ccc(C(C)(C)C)cc1)[C@H]1CCCC[C@@H]1N ZINC001236211416 1130887126 /nfs/dbraw/zinc/88/71/26/1130887126.db2.gz HWMNYBZHMSXAHL-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO COc1ccc2cc(C[N@H+](C)[C@@H]3CCCC[C@@H]3N)ccc2c1 ZINC001236210670 1130887736 /nfs/dbraw/zinc/88/77/36/1130887736.db2.gz DWRPIMUWTUXGBT-RBUKOAKNSA-N 1 3 298.430 3.550 20 0 CHADHO COc1ccc2cc(C[N@@H+](C)[C@@H]3CCCC[C@@H]3N)ccc2c1 ZINC001236210670 1130887742 /nfs/dbraw/zinc/88/77/42/1130887742.db2.gz DWRPIMUWTUXGBT-RBUKOAKNSA-N 1 3 298.430 3.550 20 0 CHADHO C[N@H+](Cc1c[nH]c2c1cccc2Cl)[C@H]1CCCC[C@@H]1N ZINC001236214726 1130889249 /nfs/dbraw/zinc/88/92/49/1130889249.db2.gz DWSNVQLURBLEJU-GJZGRUSLSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@@H+](Cc1c[nH]c2c1cccc2Cl)[C@H]1CCCC[C@@H]1N ZINC001236214726 1130889254 /nfs/dbraw/zinc/88/92/54/1130889254.db2.gz DWSNVQLURBLEJU-GJZGRUSLSA-N 1 3 291.826 3.523 20 0 CHADHO Cc1sc2ccccc2c1C[N@@H+](C)[C@@H]1CCCC[C@H]1N ZINC001236216188 1130893611 /nfs/dbraw/zinc/89/36/11/1130893611.db2.gz IWLHHYIYEQSDHY-HZPDHXFCSA-N 1 3 288.460 3.911 20 0 CHADHO Cc1sc2ccccc2c1C[N@H+](C)[C@@H]1CCCC[C@H]1N ZINC001236216188 1130893615 /nfs/dbraw/zinc/89/36/15/1130893615.db2.gz IWLHHYIYEQSDHY-HZPDHXFCSA-N 1 3 288.460 3.911 20 0 CHADHO CC/C=C\CCC[N@H+](Cc1ccccc1)C1CCNCC1 ZINC001236286676 1130910659 /nfs/dbraw/zinc/91/06/59/1130910659.db2.gz NSWLXODIMPTNTF-ARJAWSKDSA-N 1 3 286.463 3.987 20 0 CHADHO CC/C=C\CCC[N@@H+](Cc1ccccc1)C1CCNCC1 ZINC001236286676 1130910663 /nfs/dbraw/zinc/91/06/63/1130910663.db2.gz NSWLXODIMPTNTF-ARJAWSKDSA-N 1 3 286.463 3.987 20 0 CHADHO CC(C)(C)CC[N@H+](Cc1ccccc1)C1CCNCC1 ZINC001236286624 1130911697 /nfs/dbraw/zinc/91/16/97/1130911697.db2.gz NGTHZBKTKXSCNT-UHFFFAOYSA-N 1 3 274.452 3.677 20 0 CHADHO CC(C)(C)CC[N@@H+](Cc1ccccc1)C1CCNCC1 ZINC001236286624 1130911702 /nfs/dbraw/zinc/91/17/02/1130911702.db2.gz NGTHZBKTKXSCNT-UHFFFAOYSA-N 1 3 274.452 3.677 20 0 CHADHO C[C@H]1[C@H](N)CCC[N@@H+]1Cc1ccccc1-c1ccccc1 ZINC001236422470 1130937445 /nfs/dbraw/zinc/93/74/45/1130937445.db2.gz WOIPWIVIHYAPOF-HNAYVOBHSA-N 1 3 280.415 3.665 20 0 CHADHO C[C@H]1[C@H](N)CCC[N@H+]1Cc1ccccc1-c1ccccc1 ZINC001236422470 1130937446 /nfs/dbraw/zinc/93/74/46/1130937446.db2.gz WOIPWIVIHYAPOF-HNAYVOBHSA-N 1 3 280.415 3.665 20 0 CHADHO C[C@@H](CC[N@H+](C[C@@H]1CCCNC1)C1CC1)CC(C)(C)C ZINC001236584551 1130980748 /nfs/dbraw/zinc/98/07/48/1130980748.db2.gz LURVNLRTXIGCKM-JKSUJKDBSA-N 1 3 280.500 3.913 20 0 CHADHO C[C@@H](CC[N@@H+](C[C@@H]1CCCNC1)C1CC1)CC(C)(C)C ZINC001236584551 1130980749 /nfs/dbraw/zinc/98/07/49/1130980749.db2.gz LURVNLRTXIGCKM-JKSUJKDBSA-N 1 3 280.500 3.913 20 0 CHADHO CCC[C@H](Cc1ccccc1)[N@H+](CCC)CCCNC ZINC001236662960 1130991842 /nfs/dbraw/zinc/99/18/42/1130991842.db2.gz MFZJFUXHKDWJKE-GOSISDBHSA-N 1 3 276.468 3.719 20 0 CHADHO CCC[C@H](Cc1ccccc1)[N@@H+](CCC)CCCNC ZINC001236662960 1130991847 /nfs/dbraw/zinc/99/18/47/1130991847.db2.gz MFZJFUXHKDWJKE-GOSISDBHSA-N 1 3 276.468 3.719 20 0 CHADHO CCCN(Cc1ccc(CC(C)C)cc1)C[C@H]1CC[NH2+]C1 ZINC001236843475 1131021299 /nfs/dbraw/zinc/02/12/99/1131021299.db2.gz OZIGJFGCFLLQMA-IBGZPJMESA-N 1 3 288.479 3.707 20 0 CHADHO CCCN(Cc1c(C)cc(Cl)cc1C)C[C@@H]1CC[NH2+]C1 ZINC001236842950 1131021941 /nfs/dbraw/zinc/02/19/41/1131021941.db2.gz IGNAZSXHRNHDDX-OAHLLOKOSA-N 1 3 294.870 3.778 20 0 CHADHO C[C@H](N)C[N@H+](C)Cc1ccccc1-c1ccccc1Cl ZINC001236895248 1131030017 /nfs/dbraw/zinc/03/00/17/1131030017.db2.gz NXPPSJFEWCDZPC-ZDUSSCGKSA-N 1 3 288.822 3.786 20 0 CHADHO C[C@H](N)C[N@@H+](C)Cc1ccccc1-c1ccccc1Cl ZINC001236895248 1131030024 /nfs/dbraw/zinc/03/00/24/1131030024.db2.gz NXPPSJFEWCDZPC-ZDUSSCGKSA-N 1 3 288.822 3.786 20 0 CHADHO Cc1c(C)c(C)c(CN2CCC[C@](C)(C[NH3+])C2)c(C)c1C ZINC001237055233 1131042457 /nfs/dbraw/zinc/04/24/57/1131042457.db2.gz BPQBUKUBWLRTCQ-LJQANCHMSA-N 1 3 288.479 3.790 20 0 CHADHO CC(C)(C)c1ccc(CN2CCC[C@@](C)(C[NH3+])C2)cc1 ZINC001237058535 1131043769 /nfs/dbraw/zinc/04/37/69/1131043769.db2.gz QHFJZBYZTCQDQT-SFHVURJKSA-N 1 3 274.452 3.545 20 0 CHADHO Cc1ccc(CN2CC[C@H]3[NH2+]CCC[C@H]3C2)c2ccccc12 ZINC001237389107 1131094892 /nfs/dbraw/zinc/09/48/92/1131094892.db2.gz FSMDPPCAMJERQM-FXAWDEMLSA-N 1 3 294.442 3.722 20 0 CHADHO CN1CCCC[C@H]1CC[N@H+](C)[C@H]1CCc2c1cccc2F ZINC001116195865 1131133415 /nfs/dbraw/zinc/13/34/15/1131133415.db2.gz QMWXUAPYRHUJPX-KSSFIOAISA-N 1 3 290.426 3.619 20 0 CHADHO CN1CCCC[C@H]1CC[N@@H+](C)[C@H]1CCc2c1cccc2F ZINC001116195865 1131133419 /nfs/dbraw/zinc/13/34/19/1131133419.db2.gz QMWXUAPYRHUJPX-KSSFIOAISA-N 1 3 290.426 3.619 20 0 CHADHO CC[N@H+](Cc1ccc2c(c1)C(C(C)C)=NCC2)C(C)C ZINC001237876057 1131147471 /nfs/dbraw/zinc/14/74/71/1131147471.db2.gz CCVDQBZCYKCNLN-UHFFFAOYSA-N 1 3 272.436 3.918 20 0 CHADHO CC[N@@H+](Cc1ccc2c(c1)C(C(C)C)=NCC2)C(C)C ZINC001237876057 1131147474 /nfs/dbraw/zinc/14/74/74/1131147474.db2.gz CCVDQBZCYKCNLN-UHFFFAOYSA-N 1 3 272.436 3.918 20 0 CHADHO CC(C)C1=NCCc2ccc(C[NH+]3CCC(C)CC3)cc21 ZINC001237881210 1131148669 /nfs/dbraw/zinc/14/86/69/1131148669.db2.gz NWKUVUPYHWTBAG-UHFFFAOYSA-N 1 3 284.447 3.920 20 0 CHADHO CC(C)(C)c1cc(Nc2ccc(CC[NH3+])cc2)ccn1 ZINC001159639836 1131157993 /nfs/dbraw/zinc/15/79/93/1131157993.db2.gz HSIJLVBFPHGTNE-UHFFFAOYSA-N 1 3 269.392 3.624 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H](C)Cc2ccccc2Cl)C1 ZINC001117639461 1131189975 /nfs/dbraw/zinc/18/99/75/1131189975.db2.gz HTGVJGDJBWJOCD-LSDHHAIUSA-N 1 3 294.870 3.591 20 0 CHADHO C[C@@H]([NH2+]CC1(N)CCC1)c1ccc(SC(F)F)cc1 ZINC000817965052 1131194239 /nfs/dbraw/zinc/19/42/39/1131194239.db2.gz ODVBRYRMCUJUJP-SNVBAGLBSA-N 1 3 286.391 3.533 20 0 CHADHO CC[C@H](NCC[C@@H](C)[NH2+]C)c1cccc2ccccc21 ZINC001118122010 1131210842 /nfs/dbraw/zinc/21/08/42/1131210842.db2.gz MSIXNNQEYLZDOZ-KDOFPFPSSA-N 1 3 270.420 3.879 20 0 CHADHO CCN(CC)CCC[NH2+][C@H]1CCc2c(Cl)cccc2C1 ZINC001171006930 1131416181 /nfs/dbraw/zinc/41/61/81/1131416181.db2.gz ASCVAVNTVZUGLO-HNNXBMFYSA-N 1 3 294.870 3.519 20 0 CHADHO CCN(CC)CCC[N@H+](C)[C@H]1CCC[C@@H]1c1ccccc1 ZINC001171018910 1131429229 /nfs/dbraw/zinc/42/92/29/1131429229.db2.gz UAGUMUGEEBVRBW-MOPGFXCFSA-N 1 3 288.479 3.986 20 0 CHADHO CCN(CC)CCC[N@@H+](C)[C@H]1CCC[C@@H]1c1ccccc1 ZINC001171018910 1131429231 /nfs/dbraw/zinc/42/92/31/1131429231.db2.gz UAGUMUGEEBVRBW-MOPGFXCFSA-N 1 3 288.479 3.986 20 0 CHADHO CC[NH+](CC)CCCN(C)[C@H]1CCC[C@@H]1c1ccccc1 ZINC001171018910 1131429234 /nfs/dbraw/zinc/42/92/34/1131429234.db2.gz UAGUMUGEEBVRBW-MOPGFXCFSA-N 1 3 288.479 3.986 20 0 CHADHO C[C@@H]([NH2+][C@H]1CCN[C@@H](C(C)(C)C)C1)C1CCCCC1 ZINC001246243691 1131430265 /nfs/dbraw/zinc/43/02/65/1131430265.db2.gz HIQDODYKGCOLKY-VNQPRFMTSA-N 1 3 266.473 3.712 20 0 CHADHO CC(C)C1CCC([NH2+][C@H]2CCN[C@@H](C(C)(C)C)C2)CC1 ZINC001246335632 1131474133 /nfs/dbraw/zinc/47/41/33/1131474133.db2.gz LEMHADSARFSRRZ-SJJHQCBESA-N 1 3 280.500 3.958 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H]1CCc2cc(Cl)ccc2C1 ZINC001171089534 1131512210 /nfs/dbraw/zinc/51/22/10/1131512210.db2.gz AOWCLRLINNENIT-QGZVFWFLSA-N 1 3 294.870 3.519 20 0 CHADHO [NH3+]CCCCCCCN[C@H](c1ccccc1)c1ccccn1 ZINC000844221713 1131537553 /nfs/dbraw/zinc/53/75/53/1131537553.db2.gz UJQVAQMVIYHDFX-LJQANCHMSA-N 1 3 297.446 3.670 20 0 CHADHO CCCCc1ccc(CN2CC3(C2)CC[NH+](C)CC3)s1 ZINC001138756052 1131547481 /nfs/dbraw/zinc/54/74/81/1131547481.db2.gz WCHNNHAKXVQQQA-UHFFFAOYSA-N 1 3 292.492 3.618 20 0 CHADHO CCCCC[C@H](CCC)[N@@H+]1CC[C@H](C)[C@H](CN)C1 ZINC001246550744 1131606333 /nfs/dbraw/zinc/60/63/33/1131606333.db2.gz KRJSLTHIMITOKD-XHSDSOJGSA-N 1 3 254.462 3.652 20 0 CHADHO CCCCC[C@H](CCC)[N@H+]1CC[C@H](C)[C@H](CN)C1 ZINC001246550744 1131606335 /nfs/dbraw/zinc/60/63/35/1131606335.db2.gz KRJSLTHIMITOKD-XHSDSOJGSA-N 1 3 254.462 3.652 20 0 CHADHO C[C@@H]1CC[N@@H+]([C@H]2CCCC3(CCCCC3)C2)C[C@H]1CN ZINC001246554293 1131612966 /nfs/dbraw/zinc/61/29/66/1131612966.db2.gz UYYHFKDVZLCTJU-ZACQAIPSSA-N 1 3 278.484 3.796 20 0 CHADHO C[C@@H]1CC[N@H+]([C@H]2CCCC3(CCCCC3)C2)C[C@H]1CN ZINC001246554293 1131612971 /nfs/dbraw/zinc/61/29/71/1131612971.db2.gz UYYHFKDVZLCTJU-ZACQAIPSSA-N 1 3 278.484 3.796 20 0 CHADHO C[C@@H]1CCCC[N@@H+]([C@@H]2CCNC3(CCCCC3)C2)C1 ZINC001246557875 1131620292 /nfs/dbraw/zinc/62/02/92/1131620292.db2.gz LQLASSOJHNABMA-HZPDHXFCSA-N 1 3 264.457 3.563 20 0 CHADHO C[C@@H]1CCCC[N@H+]([C@@H]2CCNC3(CCCCC3)C2)C1 ZINC001246557875 1131620297 /nfs/dbraw/zinc/62/02/97/1131620297.db2.gz LQLASSOJHNABMA-HZPDHXFCSA-N 1 3 264.457 3.563 20 0 CHADHO C[C@H]1[C@H](CN)CCC[N@@H+]1C1CCC2(CCCCC2)CC1 ZINC001246559393 1131621425 /nfs/dbraw/zinc/62/14/25/1131621425.db2.gz AOKDKVYMZOYFOJ-HOTGVXAUSA-N 1 3 278.484 3.939 20 0 CHADHO C[C@H]1[C@H](CN)CCC[N@H+]1C1CCC2(CCCCC2)CC1 ZINC001246559393 1131621427 /nfs/dbraw/zinc/62/14/27/1131621427.db2.gz AOKDKVYMZOYFOJ-HOTGVXAUSA-N 1 3 278.484 3.939 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@@H+]2CCC[C@@H](C)[C@H](C)C2)CCN1 ZINC001246577088 1131667203 /nfs/dbraw/zinc/66/72/03/1131667203.db2.gz VEKADWLTWPZCNZ-QBPKDAKJSA-N 1 3 266.473 3.665 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@@H](C)[C@H](C)C2)CCN1 ZINC001246577088 1131667204 /nfs/dbraw/zinc/66/72/04/1131667204.db2.gz VEKADWLTWPZCNZ-QBPKDAKJSA-N 1 3 266.473 3.665 20 0 CHADHO CCCCC[C@H](C)[N@H+](C(C)C)[C@H]1CCCNCC1 ZINC001246592726 1131707579 /nfs/dbraw/zinc/70/75/79/1131707579.db2.gz LHNYFHCDSBNLRR-HOTGVXAUSA-N 1 3 254.462 3.808 20 0 CHADHO CCCCC[C@H](C)[N@@H+](C(C)C)[C@H]1CCCNCC1 ZINC001246592726 1131707581 /nfs/dbraw/zinc/70/75/81/1131707581.db2.gz LHNYFHCDSBNLRR-HOTGVXAUSA-N 1 3 254.462 3.808 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[N@@H+]1CCCC[C@@H](CN)C1 ZINC001246595236 1131709834 /nfs/dbraw/zinc/70/98/34/1131709834.db2.gz SIAIJQKFKMWGIN-JYJNAYRXSA-N 1 3 254.462 3.652 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[N@H+]1CCCC[C@@H](CN)C1 ZINC001246595236 1131709838 /nfs/dbraw/zinc/70/98/38/1131709838.db2.gz SIAIJQKFKMWGIN-JYJNAYRXSA-N 1 3 254.462 3.652 20 0 CHADHO CC(C)[N@H+]([C@H]1CC[C@@H](C)[C@H](C)C1)[C@H]1CCCNCC1 ZINC001246595919 1131710334 /nfs/dbraw/zinc/71/03/34/1131710334.db2.gz UFKAVLUQOMPHCP-NCOADZHNSA-N 1 3 266.473 3.664 20 0 CHADHO CC(C)[N@@H+]([C@H]1CC[C@@H](C)[C@H](C)C1)[C@H]1CCCNCC1 ZINC001246595919 1131710338 /nfs/dbraw/zinc/71/03/38/1131710338.db2.gz UFKAVLUQOMPHCP-NCOADZHNSA-N 1 3 266.473 3.664 20 0 CHADHO CCCCCC[C@@H](C)[N@@H+]1CCCC12CCNCC2 ZINC001246653322 1131777858 /nfs/dbraw/zinc/77/78/58/1131777858.db2.gz MCZCUNIKHBIZAI-OAHLLOKOSA-N 1 3 252.446 3.563 20 0 CHADHO CCCCCC[C@@H](C)[N@H+]1CCCC12CCNCC2 ZINC001246653322 1131777865 /nfs/dbraw/zinc/77/78/65/1131777865.db2.gz MCZCUNIKHBIZAI-OAHLLOKOSA-N 1 3 252.446 3.563 20 0 CHADHO CCC[N@H+](CC(C)C)[C@@H]1C[C@@H](CC)N[C@@H](CC)C1 ZINC001246912770 1131814035 /nfs/dbraw/zinc/81/40/35/1131814035.db2.gz SRDDMFJPVFFWRJ-MUJYYYPQSA-N 1 3 254.462 3.664 20 0 CHADHO CCC[N@@H+](CC(C)C)[C@@H]1C[C@@H](CC)N[C@@H](CC)C1 ZINC001246912770 1131814041 /nfs/dbraw/zinc/81/40/41/1131814041.db2.gz SRDDMFJPVFFWRJ-MUJYYYPQSA-N 1 3 254.462 3.664 20 0 CHADHO CCCC[C@@H]1C[C@@H]([N@H+](C)[C@H]2CC[C@H](C)CC2)CCN1 ZINC001246995027 1131837895 /nfs/dbraw/zinc/83/78/95/1131837895.db2.gz FELLKIDXSUHQBZ-VQHPVUNQSA-N 1 3 266.473 3.808 20 0 CHADHO CCCC[C@@H]1C[C@@H]([N@@H+](C)[C@H]2CC[C@H](C)CC2)CCN1 ZINC001246995027 1131837902 /nfs/dbraw/zinc/83/79/02/1131837902.db2.gz FELLKIDXSUHQBZ-VQHPVUNQSA-N 1 3 266.473 3.808 20 0 CHADHO c1ccc(CN2C[C@@H]3C[C@H]2C[C@@H]([NH2+][C@H]2CC=CCC2)C3)cc1 ZINC000716627724 1132028168 /nfs/dbraw/zinc/02/81/68/1132028168.db2.gz UAEDTMCYAWTRGH-MUGJNUQGSA-N 1 3 296.458 3.738 20 0 CHADHO C1=C[C@@H](C[NH2+][C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)CC1 ZINC000716694227 1132028523 /nfs/dbraw/zinc/02/85/23/1132028523.db2.gz RXQMHMAWRPAOLN-MDNKFWRPSA-N 1 3 296.458 3.595 20 0 CHADHO CN1C(C)(C)CC([NH2+]CCCCCCCCO)CC1(C)C ZINC001171625296 1132067306 /nfs/dbraw/zinc/06/73/06/1132067306.db2.gz GIIXVIIQTRAPGR-UHFFFAOYSA-N 1 3 298.515 3.560 20 0 CHADHO Cc1ccc([C@H](C)N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172100552 1132124933 /nfs/dbraw/zinc/12/49/33/1132124933.db2.gz DYOIEYYOWBZRQX-LEUOFYLZSA-N 1 3 272.436 3.661 20 0 CHADHO Cc1ccc([C@H](C)N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172100552 1132124937 /nfs/dbraw/zinc/12/49/37/1132124937.db2.gz DYOIEYYOWBZRQX-LEUOFYLZSA-N 1 3 272.436 3.661 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCCC3(CC(F)C3)CC1)C2 ZINC001172127327 1132125761 /nfs/dbraw/zinc/12/57/61/1132125761.db2.gz HZRXJOARFZXHDX-UHQQODTQSA-N 1 3 294.458 3.606 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCCC3(CC(F)C3)CC1)C2 ZINC001172127327 1132125763 /nfs/dbraw/zinc/12/57/63/1132125763.db2.gz HZRXJOARFZXHDX-UHQQODTQSA-N 1 3 294.458 3.606 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CC[C@H]3CCCC[C@@H]3C1)C2 ZINC001172131037 1132127826 /nfs/dbraw/zinc/12/78/26/1132127826.db2.gz UCVHNSNFTYFCNE-DZVNLGKHSA-N 1 3 276.468 3.514 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CC[C@H]3CCCC[C@@H]3C1)C2 ZINC001172131037 1132127829 /nfs/dbraw/zinc/12/78/29/1132127829.db2.gz UCVHNSNFTYFCNE-DZVNLGKHSA-N 1 3 276.468 3.514 20 0 CHADHO Cc1cc(C)cc([C@@H](C)N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC001172111525 1132131899 /nfs/dbraw/zinc/13/18/99/1132131899.db2.gz RYLZSDDOPAZQCX-OWYHZJEWSA-N 1 3 286.463 3.969 20 0 CHADHO Cc1cc(C)cc([C@@H](C)N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC001172111525 1132131903 /nfs/dbraw/zinc/13/19/03/1132131903.db2.gz RYLZSDDOPAZQCX-OWYHZJEWSA-N 1 3 286.463 3.969 20 0 CHADHO CCCCN(C)CCC[NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1 ZINC001172358136 1132187143 /nfs/dbraw/zinc/18/71/43/1132187143.db2.gz DONTXSRYFVDXGB-BZUAXINKSA-N 1 3 254.462 3.523 20 0 CHADHO CC[C@H](CC(C)C)[NH+]1CCC(N2CCCCC2)CC1 ZINC001172402340 1132223377 /nfs/dbraw/zinc/22/33/77/1132223377.db2.gz RPDBHJPCKRCRPP-MRXNPFEDSA-N 1 3 266.473 3.761 20 0 CHADHO CCCCN(C)CCC[NH2+][C@@H]1CCc2ccc(C)cc2C1 ZINC001172825910 1132322294 /nfs/dbraw/zinc/32/22/94/1132322294.db2.gz LMUILGUEGPICRC-LJQANCHMSA-N 1 3 288.479 3.564 20 0 CHADHO C[N@H+](Cc1cc2cnccc2[nH]1)[C@H]1CCc2ccccc21 ZINC001232018918 1132413297 /nfs/dbraw/zinc/41/32/97/1132413297.db2.gz QWTVYTSRYWDUGC-SFHVURJKSA-N 1 3 277.371 3.682 20 0 CHADHO C[N@@H+](Cc1cc2cnccc2[nH]1)[C@H]1CCc2ccccc21 ZINC001232018918 1132413301 /nfs/dbraw/zinc/41/33/01/1132413301.db2.gz QWTVYTSRYWDUGC-SFHVURJKSA-N 1 3 277.371 3.682 20 0 CHADHO C[C@H](CC(c1ccccc1)c1ccccc1)[NH2+]C1CC(N)C1 ZINC001173209983 1132416209 /nfs/dbraw/zinc/41/62/09/1132416209.db2.gz IFECRCCYPFYSNL-VNCLNFNDSA-N 1 3 294.442 3.676 20 0 CHADHO C[C@H](CC(c1ccccc1)c1ccccc1)NC1CC([NH3+])C1 ZINC001173209983 1132416213 /nfs/dbraw/zinc/41/62/13/1132416213.db2.gz IFECRCCYPFYSNL-VNCLNFNDSA-N 1 3 294.442 3.676 20 0 CHADHO CN(C)Cc1cc(F)cc(C[NH+]2CC3CCC(CC3)C2)c1 ZINC001232149320 1132427730 /nfs/dbraw/zinc/42/77/30/1132427730.db2.gz MOCGSGRXYYAPAQ-UHFFFAOYSA-N 1 3 290.426 3.509 20 0 CHADHO CC[C@H]1CC[C@H]([N@H+](CCCN)C2CCCCC2)C1 ZINC001173265668 1132431365 /nfs/dbraw/zinc/43/13/65/1132431365.db2.gz UUMARGQPWSJHOW-HOCLYGCPSA-N 1 3 252.446 3.549 20 0 CHADHO CC[C@H]1CC[C@H]([N@@H+](CCCN)C2CCCCC2)C1 ZINC001173265668 1132431370 /nfs/dbraw/zinc/43/13/70/1132431370.db2.gz UUMARGQPWSJHOW-HOCLYGCPSA-N 1 3 252.446 3.549 20 0 CHADHO CC[C@H]1CC[C@@H]([NH+]2CCC(N3CCCCC3)CC2)C1 ZINC001173272907 1132437895 /nfs/dbraw/zinc/43/78/95/1132437895.db2.gz LDZOIASLTWYLQO-DOTOQJQBSA-N 1 3 264.457 3.515 20 0 CHADHO CC[C@H]1CC[C@@H](N2CCC([NH+]3CCCCC3)CC2)C1 ZINC001173272907 1132437900 /nfs/dbraw/zinc/43/79/00/1132437900.db2.gz LDZOIASLTWYLQO-DOTOQJQBSA-N 1 3 264.457 3.515 20 0 CHADHO CCc1ccc(C[C@H](C)[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)cc1 ZINC001173240902 1132441274 /nfs/dbraw/zinc/44/12/74/1132441274.db2.gz KOACAUYCXXZJMB-KFKAGJAMSA-N 1 3 288.479 3.642 20 0 CHADHO CC(C)CN1CCC[C@@H](C[NH2+]C2CCC(F)(F)CC2)C1 ZINC000842694865 1132451540 /nfs/dbraw/zinc/45/15/40/1132451540.db2.gz SVCWSODLZNQLLA-AWEZNQCLSA-N 1 3 288.426 3.522 20 0 CHADHO Cc1cccc(F)c1CN(C)CC1CC[NH+](C(C)C)CC1 ZINC001232484675 1132478314 /nfs/dbraw/zinc/47/83/14/1132478314.db2.gz JUBNCZZYEGCWCI-UHFFFAOYSA-N 1 3 292.442 3.686 20 0 CHADHO CN(C)Cc1ccccc1Nc1ccc(CC[NH+](C)C)cc1 ZINC001173931533 1132644587 /nfs/dbraw/zinc/64/45/87/1132644587.db2.gz HBRMFACFWPUJJP-UHFFFAOYSA-N 1 3 297.446 3.596 20 0 CHADHO Cc1nc(-n2ccc3cc([C@@H](C)[NH3+])ccc32)cc2[nH]ccc21 ZINC001155349655 1132655282 /nfs/dbraw/zinc/65/52/82/1132655282.db2.gz UMBCDJDDJUUIHL-LLVKDONJSA-N 1 3 290.370 3.835 20 0 CHADHO CC[C@@H]1CCCC[C@@H]1C[N@@H+]1CC[C@@H](CN(CC)CC)C1 ZINC001204549961 1133460566 /nfs/dbraw/zinc/46/05/66/1133460566.db2.gz DHVHGCWIWLGDPA-RCCFBDPRSA-N 1 3 280.500 3.867 20 0 CHADHO CC[C@@H]1CCCC[C@@H]1C[N@H+]1CC[C@@H](CN(CC)CC)C1 ZINC001204549961 1133460570 /nfs/dbraw/zinc/46/05/70/1133460570.db2.gz DHVHGCWIWLGDPA-RCCFBDPRSA-N 1 3 280.500 3.867 20 0 CHADHO CC(C)(C)N(CC[C@H]1CCCC[NH2+]1)Cc1ccccc1 ZINC001204604464 1133466956 /nfs/dbraw/zinc/46/69/56/1133466956.db2.gz PWJMDQNGOSKLSU-QGZVFWFLSA-N 1 3 274.452 3.819 20 0 CHADHO NC[C@@H]1CCCC[N@@H+]1Cc1cccc(-c2ccc(F)cc2)c1 ZINC001204925220 1133501053 /nfs/dbraw/zinc/50/10/53/1133501053.db2.gz NNUBKGAROYVASU-IBGZPJMESA-N 1 3 298.405 3.806 20 0 CHADHO NC[C@@H]1CCCC[N@H+]1Cc1cccc(-c2ccc(F)cc2)c1 ZINC001204925220 1133501057 /nfs/dbraw/zinc/50/10/57/1133501057.db2.gz NNUBKGAROYVASU-IBGZPJMESA-N 1 3 298.405 3.806 20 0 CHADHO Cc1c(C)c(C)c(CN2[C@@H](C)CC[C@H]2C[NH3+])c(C)c1C ZINC001205074860 1133524120 /nfs/dbraw/zinc/52/41/20/1133524120.db2.gz BILNXQZWWYTKOM-GTNSWQLSSA-N 1 3 274.452 3.540 20 0 CHADHO Cc1ccc(-c2ccc(CN3CCC[C@@H]([NH3+])CC3)cc2)cc1 ZINC001205109135 1133531315 /nfs/dbraw/zinc/53/13/15/1133531315.db2.gz BIDVTCPKUSYAIA-HXUWFJFHSA-N 1 3 294.442 3.975 20 0 CHADHO C[C@H]1CN(Cc2cc(-c3ccsc3)cs2)C[C@H]1C[NH3+] ZINC001205151646 1133537526 /nfs/dbraw/zinc/53/75/26/1133537526.db2.gz XUBDAXSDNJKQCW-SMDDNHRTSA-N 1 3 292.473 3.503 20 0 CHADHO C[C@H](C[N@@H+]1CC[C@@H](C)[C@H](CN)C1)c1cccc2ccccc21 ZINC001205296076 1133556048 /nfs/dbraw/zinc/55/60/48/1133556048.db2.gz GEVJZTLDRKQFBH-JFIYKMOQSA-N 1 3 296.458 3.860 20 0 CHADHO C[C@H](C[N@H+]1CC[C@@H](C)[C@H](CN)C1)c1cccc2ccccc21 ZINC001205296076 1133556052 /nfs/dbraw/zinc/55/60/52/1133556052.db2.gz GEVJZTLDRKQFBH-JFIYKMOQSA-N 1 3 296.458 3.860 20 0 CHADHO C[C@@H]1CCN(Cc2cccc(-c3ccccc3)c2)C[C@@H]1C[NH3+] ZINC001205305037 1133558144 /nfs/dbraw/zinc/55/81/44/1133558144.db2.gz QOTXRWUJYAUALK-UZLBHIALSA-N 1 3 294.442 3.770 20 0 CHADHO C[C@@H]1CCNCC[N@@H+]1Cc1ccccc1-c1ccc(F)cc1 ZINC001205332849 1133563995 /nfs/dbraw/zinc/56/39/95/1133563995.db2.gz UUAUKJVIRRTLBD-OAHLLOKOSA-N 1 3 298.405 3.677 20 0 CHADHO C[C@@H]1CCNCC[N@H+]1Cc1ccccc1-c1ccc(F)cc1 ZINC001205332849 1133563997 /nfs/dbraw/zinc/56/39/97/1133563997.db2.gz UUAUKJVIRRTLBD-OAHLLOKOSA-N 1 3 298.405 3.677 20 0 CHADHO Cc1ccc([C@@H](C)C[NH2+]CC[C@H](C)N2CCCCC2)cc1 ZINC001205391381 1133573727 /nfs/dbraw/zinc/57/37/27/1133573727.db2.gz MVLZRHLPZGNRJO-ROUUACIJSA-N 1 3 288.479 3.953 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@H+]1CCCNC[C@@H]1C ZINC001206263283 1133678761 /nfs/dbraw/zinc/67/87/61/1133678761.db2.gz UCQPQWGOWGBBBD-KRWDZBQOSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@@H+]1CCCNC[C@@H]1C ZINC001206263283 1133678763 /nfs/dbraw/zinc/67/87/63/1133678763.db2.gz UCQPQWGOWGBBBD-KRWDZBQOSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1cc(F)cc(CN2CCC[C@@](C)(C[NH3+])CC2)c1Cl ZINC001206326848 1133689865 /nfs/dbraw/zinc/68/98/65/1133689865.db2.gz PSVYWUNHWUKXMX-MRXNPFEDSA-N 1 3 298.833 3.738 20 0 CHADHO C[C@]1(C[NH3+])CCCCN(CCCc2ccccc2Cl)C1 ZINC001206542311 1133715961 /nfs/dbraw/zinc/71/59/61/1133715961.db2.gz XWSWIINMEJIRRH-QGZVFWFLSA-N 1 3 294.870 3.724 20 0 CHADHO CC(C)N(Cc1ccc(F)c(Cl)c1)[C@@H]1CCC[NH2+]CC1 ZINC001206582761 1133722038 /nfs/dbraw/zinc/72/20/38/1133722038.db2.gz PLZFHHHTBMOZPC-CQSZACIVSA-N 1 3 298.833 3.832 20 0 CHADHO NC[C@@H]1CCCC[N@H+](C[C@H]2C[C@H]2c2ccc(Cl)cc2)C1 ZINC001206606560 1133727332 /nfs/dbraw/zinc/72/73/32/1133727332.db2.gz PHFGOPMOCPKKKX-LXZKKBNFSA-N 1 3 292.854 3.504 20 0 CHADHO NC[C@@H]1CCCC[N@@H+](C[C@H]2C[C@H]2c2ccc(Cl)cc2)C1 ZINC001206606560 1133727338 /nfs/dbraw/zinc/72/73/38/1133727338.db2.gz PHFGOPMOCPKKKX-LXZKKBNFSA-N 1 3 292.854 3.504 20 0 CHADHO C[C@H]1CC[C@@H](CN)C[N@@H+]1CC1(c2ccccc2)CCCC1 ZINC001206760535 1133744005 /nfs/dbraw/zinc/74/40/05/1133744005.db2.gz JCRAOKMRKWHCLY-IRXDYDNUSA-N 1 3 286.463 3.558 20 0 CHADHO C[C@H]1CC[C@@H](CN)C[N@H+]1CC1(c2ccccc2)CCCC1 ZINC001206760535 1133744009 /nfs/dbraw/zinc/74/40/09/1133744009.db2.gz JCRAOKMRKWHCLY-IRXDYDNUSA-N 1 3 286.463 3.558 20 0 CHADHO C[C@@H]1CCC(C)(C)C[C@H]1[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC001206827456 1133752049 /nfs/dbraw/zinc/75/20/49/1133752049.db2.gz NVHJANHNKPNGDX-BPQIPLTHSA-N 1 3 292.511 3.913 20 0 CHADHO C[C@@H]1CCC(C)(C)C[C@@H]1[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC001206827458 1133752090 /nfs/dbraw/zinc/75/20/90/1133752090.db2.gz NVHJANHNKPNGDX-NJAFHUGGSA-N 1 3 292.511 3.913 20 0 CHADHO CC1(CN2CCC(C)([NH+]3CCCCC3)CC2)CCCC1 ZINC001207459737 1133804388 /nfs/dbraw/zinc/80/43/88/1133804388.db2.gz NJXIPQDBHBQFAV-UHFFFAOYSA-N 1 3 278.484 3.907 20 0 CHADHO CN(CCCc1ccc(Cl)cc1)CCC[NH+]1CCCC1 ZINC001207595754 1133826576 /nfs/dbraw/zinc/82/65/76/1133826576.db2.gz GJABTYRQAHRCON-UHFFFAOYSA-N 1 3 294.870 3.690 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1C[C@H]1C[C@H]2C=C[C@@H]1C2 ZINC001207631416 1133834586 /nfs/dbraw/zinc/83/45/86/1133834586.db2.gz HBEZMLVGCJQOTL-JKEDJMADSA-N 1 3 288.479 3.537 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@H+]1C[C@H]1C[C@H]2C=C[C@@H]1C2 ZINC001207631416 1133834588 /nfs/dbraw/zinc/83/45/88/1133834588.db2.gz HBEZMLVGCJQOTL-JKEDJMADSA-N 1 3 288.479 3.537 20 0 CHADHO CC[C@H](Cc1ccccc1)[NH2+][C@H](C)CCN(CC)CC ZINC001207858175 1133854712 /nfs/dbraw/zinc/85/47/12/1133854712.db2.gz GETGORICOQCKEW-SJLPKXTDSA-N 1 3 276.468 3.718 20 0 CHADHO CC1=C[C@@H](C)[C@@H](C[NH+]2CCC(N3CCCCC3)CC2)CC1 ZINC001208160160 1133890507 /nfs/dbraw/zinc/89/05/07/1133890507.db2.gz GBFJEJZIEXSJSU-QZTJIDSGSA-N 1 3 290.495 3.929 20 0 CHADHO CC1=C[C@@H](C)[C@@H](CN2CCC([NH+]3CCCCC3)CC2)CC1 ZINC001208160160 1133890511 /nfs/dbraw/zinc/89/05/11/1133890511.db2.gz GBFJEJZIEXSJSU-QZTJIDSGSA-N 1 3 290.495 3.929 20 0 CHADHO CC1=C[C@@H](C)[C@H](CN2CCC([NH+]3CCCC3)CC2)CC1 ZINC001208166060 1133893177 /nfs/dbraw/zinc/89/31/77/1133893177.db2.gz VDIJEBPCFJUJKE-SJORKVTESA-N 1 3 276.468 3.539 20 0 CHADHO CC1=C[C@@H](C)[C@H](C[NH+]2CCC(N3CCCC3)CC2)CC1 ZINC001208166060 1133893183 /nfs/dbraw/zinc/89/31/83/1133893183.db2.gz VDIJEBPCFJUJKE-SJORKVTESA-N 1 3 276.468 3.539 20 0 CHADHO C[C@H]1CN(CC2(C[NH+](C)C)CCCC2)Cc2ccccc21 ZINC001208184146 1133902328 /nfs/dbraw/zinc/90/23/28/1133902328.db2.gz KLCVKXXISXTNIQ-INIZCTEOSA-N 1 3 286.463 3.728 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@@H+]1CCN[C@H](C)CC1 ZINC001210500034 1134230682 /nfs/dbraw/zinc/23/06/82/1134230682.db2.gz ZFVJVBZFZWPCOP-QGZVFWFLSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@H+]1CCN[C@H](C)CC1 ZINC001210500034 1134230688 /nfs/dbraw/zinc/23/06/88/1134230688.db2.gz ZFVJVBZFZWPCOP-QGZVFWFLSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1c[nH+]ccc1Nc1ccc(CN2CCCCC2)c(F)c1 ZINC001215710127 1134665002 /nfs/dbraw/zinc/66/50/02/1134665002.db2.gz NRZRWGKRCXGRQS-UHFFFAOYSA-N 1 3 299.393 3.681 20 0 CHADHO Cc1ccsc1CN1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222161862 1135203480 /nfs/dbraw/zinc/20/34/80/1135203480.db2.gz RTYDLRUXYQYOLL-KRWDZBQOSA-N 1 3 292.492 3.802 20 0 CHADHO c1ccc(C2(CN3CCC4(CCC[NH2+]4)CC3)CCCC2)cc1 ZINC001226786287 1135741049 /nfs/dbraw/zinc/74/10/49/1135741049.db2.gz ZCSOKQJMUIGWFV-UHFFFAOYSA-N 1 3 298.474 3.716 20 0 CHADHO C[N@@H+]1CC[C@H](N[C@@H]2CCCc3sccc32)[C@H]2CCC[C@H]21 ZINC000353668103 529807174 /nfs/dbraw/zinc/80/71/74/529807174.db2.gz FTDGOSHKNZVOQN-DMRZNYOFSA-N 1 3 290.476 3.588 20 0 CHADHO C[N@H+]1CC[C@H](N[C@@H]2CCCc3sccc32)[C@H]2CCC[C@H]21 ZINC000353668103 529807175 /nfs/dbraw/zinc/80/71/75/529807175.db2.gz FTDGOSHKNZVOQN-DMRZNYOFSA-N 1 3 290.476 3.588 20 0 CHADHO C[C@@H](N)C[C@@H](C)[NH2+]CCCc1c(Cl)cccc1Cl ZINC000574205143 335000663 /nfs/dbraw/zinc/00/06/63/335000663.db2.gz UAMDMXBDSDDKSK-GHMZBOCLSA-N 1 3 289.250 3.641 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCCCc1c(Cl)cccc1Cl ZINC000574205143 335000665 /nfs/dbraw/zinc/00/06/65/335000665.db2.gz UAMDMXBDSDDKSK-GHMZBOCLSA-N 1 3 289.250 3.641 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]CCCc1c(Cl)cccc1Cl ZINC000574205147 335000696 /nfs/dbraw/zinc/00/06/96/335000696.db2.gz UAMDMXBDSDDKSK-QWRGUYRKSA-N 1 3 289.250 3.641 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCCCc1c(Cl)cccc1Cl ZINC000574205147 335000697 /nfs/dbraw/zinc/00/06/97/335000697.db2.gz UAMDMXBDSDDKSK-QWRGUYRKSA-N 1 3 289.250 3.641 20 0 CHADHO C[NH+](C)Cc1ccc(CN[C@@H](c2ccccc2)C2CC2)cc1 ZINC000171128097 335055941 /nfs/dbraw/zinc/05/59/41/335055941.db2.gz CYVINEUZOVKOKE-FQEVSTJZSA-N 1 3 294.442 3.989 20 0 CHADHO CN(C)Cc1ccc(C[NH2+][C@@H](c2ccccc2)C2CC2)cc1 ZINC000171128097 335055942 /nfs/dbraw/zinc/05/59/42/335055942.db2.gz CYVINEUZOVKOKE-FQEVSTJZSA-N 1 3 294.442 3.989 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]CCCN(C)C(C)C)cc1C ZINC000221915390 262323417 /nfs/dbraw/zinc/32/34/17/262323417.db2.gz UNRVXXKOJCKJTK-INIZCTEOSA-N 1 3 262.441 3.684 20 0 CHADHO C[C@@H](C[NH2+][C@H]1CCCc2cc(F)ccc21)CN1CCCC1 ZINC000341762983 130028270 /nfs/dbraw/zinc/02/82/70/130028270.db2.gz WWFJIMMHXJTKKP-KSSFIOAISA-N 1 3 290.426 3.525 20 0 CHADHO CC[C@@H](NC1CC[NH+](C(C)C)CC1)c1ccc(C)cc1 ZINC000020189268 171053972 /nfs/dbraw/zinc/05/39/72/171053972.db2.gz YBYOEARQLVILKN-GOSISDBHSA-N 1 3 274.452 3.909 20 0 CHADHO CCC[C@H](NC1CC[NH+](C(C)C)CC1)c1ccccc1 ZINC000020189385 171055528 /nfs/dbraw/zinc/05/55/28/171055528.db2.gz JATHQFJZUHTDEI-SFHVURJKSA-N 1 3 274.452 3.990 20 0 CHADHO CC(C)[NH+]1CCC(N[C@H]2CCCc3ccccc32)CC1 ZINC000020189389 171055856 /nfs/dbraw/zinc/05/58/56/171055856.db2.gz MPXIQHDPSDOTFR-SFHVURJKSA-N 1 3 272.436 3.526 20 0 CHADHO CCC[C@@H](NC1CC[NH+](C(C)C)CC1)c1ccccc1 ZINC000020189383 171056085 /nfs/dbraw/zinc/05/60/85/171056085.db2.gz JATHQFJZUHTDEI-GOSISDBHSA-N 1 3 274.452 3.990 20 0 CHADHO CCC[NH+]1CCC(N[C@@H](CC)c2ccc(C)cc2)CC1 ZINC000020189868 171056576 /nfs/dbraw/zinc/05/65/76/171056576.db2.gz SQZNWVSTVWSYIA-SFHVURJKSA-N 1 3 274.452 3.910 20 0 CHADHO CCCCC[C@H](C)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000020547006 171244566 /nfs/dbraw/zinc/24/45/66/171244566.db2.gz BEQPKLYHTYCRMF-ZDUSSCGKSA-N 1 3 254.462 3.854 20 0 CHADHO C[C@H]1CN(Cc2cccc(-c3ccccc3)c2)CC[C@H]1[NH3+] ZINC000347058566 226008263 /nfs/dbraw/zinc/00/82/63/226008263.db2.gz WRDJPWPKNGNSAB-HNAYVOBHSA-N 1 3 280.415 3.523 20 0 CHADHO Cc1ccc2c(c1)[C@@H](NC1CC[NH+](C(C)C)CC1)CCC2 ZINC000352612033 227105995 /nfs/dbraw/zinc/10/59/95/227105995.db2.gz MAKKCBJTXWVLEG-IBGZPJMESA-N 1 3 286.463 3.835 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N[C@@H](C)c1csc(C)n1 ZINC000036914509 260050842 /nfs/dbraw/zinc/05/08/42/260050842.db2.gz XEDWABKHQGERJB-OLZOCXBDSA-N 1 3 283.485 3.613 20 0 CHADHO C1C[C@@H]2C[C@@H]([NH2+][C@H]3CCCC34CCCCC4)CCN2C1 ZINC000313037044 260240392 /nfs/dbraw/zinc/24/03/92/260240392.db2.gz NEKVRRIQQNLPFY-BBWFWOEESA-N 1 3 276.468 3.706 20 0 CHADHO C[C@@H](C[NH2+][C@@H]1CCc2c1cccc2F)CN1CCCCC1 ZINC000211628019 260307757 /nfs/dbraw/zinc/30/77/57/260307757.db2.gz DKVXLPJLJZCKDC-KBXCAEBGSA-N 1 3 290.426 3.525 20 0 CHADHO C[C@H]1CC[C@@H](NCCC[NH+]2CCCC2)c2ccccc21 ZINC000126474985 260353159 /nfs/dbraw/zinc/35/31/59/260353159.db2.gz HSVYGUZZRBZOFC-MAUKXSAKSA-N 1 3 272.436 3.701 20 0 CHADHO C[C@H]1CC[C@@H]([NH2+]CCCN2CCCC2)c2ccccc21 ZINC000126474985 260353160 /nfs/dbraw/zinc/35/31/60/260353160.db2.gz HSVYGUZZRBZOFC-MAUKXSAKSA-N 1 3 272.436 3.701 20 0 CHADHO CC(C)[C@H](N[C@@H]1CCC[NH2+]CC1)c1ccc(Cl)cc1 ZINC000128997835 260379994 /nfs/dbraw/zinc/37/99/94/260379994.db2.gz AOBDKMZULPIMOG-CVEARBPZSA-N 1 3 280.843 3.769 20 0 CHADHO CCC1CCC(N[C@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC000132051951 260463317 /nfs/dbraw/zinc/46/33/17/260463317.db2.gz AXQCVHODRQQNKQ-YCUKKYJWSA-N 1 3 258.409 3.690 20 0 CHADHO C[C@H]([NH2+]CC(C)(C)CN(C)C)c1ccc(F)c(Cl)c1 ZINC000020078416 262227452 /nfs/dbraw/zinc/22/74/52/262227452.db2.gz VCRJGXBISLDSKF-NSHDSACASA-N 1 3 286.822 3.718 20 0 CHADHO CC(C)[C@H](N[C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(F)cc1 ZINC000221836560 262304332 /nfs/dbraw/zinc/30/43/32/262304332.db2.gz GFLGAJHXMDNPEN-JQFCIGGWSA-N 1 3 278.415 3.595 20 0 CHADHO CC(C)[C@H](N[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(F)cc1 ZINC000221836560 262304334 /nfs/dbraw/zinc/30/43/34/262304334.db2.gz GFLGAJHXMDNPEN-JQFCIGGWSA-N 1 3 278.415 3.595 20 0 CHADHO C[C@H](CC[NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1)N1CCCCC1 ZINC000488562386 262363615 /nfs/dbraw/zinc/36/36/15/262363615.db2.gz SIPFOBHUOZCSPS-OWCLPIDISA-N 1 3 298.540 3.761 20 0 CHADHO C[C@H](CCN[C@@H]1CS[C@@H](C(C)(C)C)C1)[NH+]1CCCCC1 ZINC000488562386 262363616 /nfs/dbraw/zinc/36/36/16/262363616.db2.gz SIPFOBHUOZCSPS-OWCLPIDISA-N 1 3 298.540 3.761 20 0 CHADHO C[C@H]([NH2+]CCCN1CCCCC1)c1cccc(Cl)c1 ZINC000021032142 262374455 /nfs/dbraw/zinc/37/44/55/262374455.db2.gz HCXALKJEQANKEX-AWEZNQCLSA-N 1 3 280.843 3.867 20 0 CHADHO C[C@H]([NH2+]CC1CCN(Cc2cccs2)CC1)[C@H]1C[C@H]1C ZINC000414085155 262802917 /nfs/dbraw/zinc/80/29/17/262802917.db2.gz XZSKNTOWAWUNNB-KEYYUXOJSA-N 1 3 292.492 3.594 20 0 CHADHO CCC[N@H+](Cc1ccc(-c2ccccc2)o1)C1CCNCC1 ZINC000414657644 263022537 /nfs/dbraw/zinc/02/25/37/263022537.db2.gz OSOKUUMDNAKXCF-UHFFFAOYSA-N 1 3 298.430 3.911 20 0 CHADHO CCC[N@@H+](Cc1ccc(-c2ccccc2)o1)C1CCNCC1 ZINC000414657644 263022538 /nfs/dbraw/zinc/02/25/38/263022538.db2.gz OSOKUUMDNAKXCF-UHFFFAOYSA-N 1 3 298.430 3.911 20 0 CHADHO [NH3+]CCCN1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000414700010 263033134 /nfs/dbraw/zinc/03/31/34/263033134.db2.gz ULMNYNKIVKUPRL-AWEZNQCLSA-N 1 3 286.341 3.581 20 0 CHADHO CCN(Cc1ccc(C2CC2)cc1)[C@H]1CCC[NH2+]CC1 ZINC000414711275 263033687 /nfs/dbraw/zinc/03/36/87/263033687.db2.gz HMZQDTITBUBAOU-SFHVURJKSA-N 1 3 272.436 3.528 20 0 CHADHO CCSc1cccc(CN(CC)[C@H]2CCC[NH2+]CC2)c1 ZINC000414713174 263034086 /nfs/dbraw/zinc/03/40/86/263034086.db2.gz KGACNIIGWLWBRV-INIZCTEOSA-N 1 3 292.492 3.763 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H]([NH2+][C@@H]2CCCC[C@@H]2CN)C1 ZINC000414803401 263051465 /nfs/dbraw/zinc/05/14/65/263051465.db2.gz NUSNOUACSVVXGH-LULLPPNCSA-N 1 3 286.463 3.604 20 0 CHADHO CCC([NH3+])(CC)CNC[C@@H](C)c1cccc(Cl)c1 ZINC000414803947 263051726 /nfs/dbraw/zinc/05/17/26/263051726.db2.gz DJWMHTNWDIVQKP-GFCCVEGCSA-N 1 3 268.832 3.551 20 0 CHADHO CC(C)[C@H]([NH3+])CN[C@@H]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000414805979 263051736 /nfs/dbraw/zinc/05/17/36/263051736.db2.gz ZAJBFMFBWCTOKX-BZUAXINKSA-N 1 3 280.843 3.549 20 0 CHADHO CCC([NH3+])(CC)CN[C@H]1CCC[C@H]1c1ccc(F)cc1 ZINC000414813858 263053217 /nfs/dbraw/zinc/05/32/17/263053217.db2.gz URHDBDUTEDCLAO-HOTGVXAUSA-N 1 3 278.415 3.569 20 0 CHADHO CCC([NH3+])(CC)CN[C@H](C)CC(C)(C)c1ccccc1 ZINC000414815871 263053886 /nfs/dbraw/zinc/05/38/86/263053886.db2.gz YPEQXEYTNRIGLQ-OAHLLOKOSA-N 1 3 276.468 3.850 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CNCc2ccc(C3CC3)cc2)cc1 ZINC000414817122 263053991 /nfs/dbraw/zinc/05/39/91/263053991.db2.gz RLTJBEMRCZLPSU-CQSZACIVSA-N 1 3 280.415 3.874 20 0 CHADHO Cc1ccc(CNCc2ccc([C@@H](C)[NH3+])cc2)cc1Cl ZINC000414817019 263054405 /nfs/dbraw/zinc/05/44/05/263054405.db2.gz RLGVEDVDULZFDR-CYBMUJFWSA-N 1 3 288.822 3.958 20 0 CHADHO C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+]C[C@@H]2CCCNC2)C1 ZINC000414827887 263055717 /nfs/dbraw/zinc/05/57/17/263055717.db2.gz KWIBBKUEVHMRDG-ISARSNTHSA-N 1 3 286.463 3.548 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+][C@@H](C)[C@@H]1CCCNC1 ZINC000414857859 263074257 /nfs/dbraw/zinc/07/42/57/263074257.db2.gz QIUCOYPFLIRCFF-QXAKKESOSA-N 1 3 288.479 3.766 20 0 CHADHO Cc1ccc2cc(C[NH2+]CC3(N)CCCCCC3)ccc2n1 ZINC000414864478 263076863 /nfs/dbraw/zinc/07/68/63/263076863.db2.gz ZEMAKOYCJAQYDI-UHFFFAOYSA-N 1 3 297.446 3.685 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000282997871 263080151 /nfs/dbraw/zinc/08/01/51/263080151.db2.gz GAAOFOSRQFDAPP-NBMJBFSESA-N 1 3 286.463 3.500 20 0 CHADHO C[C@H]([NH3+])[C@@H]1CCN([C@@H](C)c2ccc(C(C)(C)C)cc2)C1 ZINC000226541069 263103581 /nfs/dbraw/zinc/10/35/81/263103581.db2.gz JSSYKNNQGDSSRL-OFQRWUPVSA-N 1 3 274.452 3.714 20 0 CHADHO C[C@@H](CC1CC1)N[C@H](C[NH3+])c1ccc2ccccc2c1 ZINC000414946355 263155361 /nfs/dbraw/zinc/15/53/61/263155361.db2.gz TVKXEBSMYAENOF-SCLBCKFNSA-N 1 3 268.404 3.618 20 0 CHADHO Clc1cccc(CNCCC[C@@H]2CCC[NH2+]2)c1Cl ZINC000414973950 263175041 /nfs/dbraw/zinc/17/50/41/263175041.db2.gz NEGZUPPWULYROK-GFCCVEGCSA-N 1 3 287.234 3.615 20 0 CHADHO Cc1ccc(C)c(CN[C@H](CCC[NH3+])c2ccccc2)c1 ZINC000415068459 263259833 /nfs/dbraw/zinc/25/98/33/263259833.db2.gz RBPNUQNETXAJIT-LJQANCHMSA-N 1 3 282.431 3.873 20 0 CHADHO CS[C@@H]1CC[C@H]1NCc1cccc(C[N@H+](C)C(C)C)c1 ZINC000425361220 264147352 /nfs/dbraw/zinc/14/73/52/264147352.db2.gz UAJZOOUSUSRAGK-IAGOWNOFSA-N 1 3 292.492 3.510 20 0 CHADHO CS[C@@H]1CC[C@H]1NCc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000425361220 264147353 /nfs/dbraw/zinc/14/73/53/264147353.db2.gz UAJZOOUSUSRAGK-IAGOWNOFSA-N 1 3 292.492 3.510 20 0 CHADHO C[NH+](C)CC1CCC(NCc2ccc(Cl)cc2F)CC1 ZINC000189403966 264299525 /nfs/dbraw/zinc/29/95/25/264299525.db2.gz UYRFLYSWABKVFU-UHFFFAOYSA-N 1 3 298.833 3.689 20 0 CHADHO CC[C@H](N[C@H]1CCC[NH2+]CC1)c1cccc(Cl)c1 ZINC000128965810 264312848 /nfs/dbraw/zinc/31/28/48/264312848.db2.gz ZLIRQICGGLWRHV-GJZGRUSLSA-N 1 3 266.816 3.523 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]CCCN2CCCCC2)cc1F ZINC000094836708 265261899 /nfs/dbraw/zinc/26/18/99/265261899.db2.gz MDHFOICKKQQXTN-HNNXBMFYSA-N 1 3 278.415 3.661 20 0 CHADHO CC(C)[C@H]1C[C@@H]([NH2+]C2CCN(C3CCCC3)CC2)CS1 ZINC000368460541 267174348 /nfs/dbraw/zinc/17/43/48/267174348.db2.gz DOQJJYWEZVGYMW-NVXWUHKLSA-N 1 3 296.524 3.513 20 0 CHADHO CC(C)[C@H]1C[C@@H](NC2CC[NH+](C3CCCC3)CC2)CS1 ZINC000368460541 267174351 /nfs/dbraw/zinc/17/43/51/267174351.db2.gz DOQJJYWEZVGYMW-NVXWUHKLSA-N 1 3 296.524 3.513 20 0 CHADHO Cc1cc(NC2CC[NH+](C(C)C)CC2)c2ccccc2n1 ZINC000301076202 327715412 /nfs/dbraw/zinc/71/54/12/327715412.db2.gz KTCNKUBNHIIYTP-UHFFFAOYSA-N 1 3 283.419 3.828 20 0 CHADHO COc1ccccc1-c1ccc(CN[C@H](C)C[C@H](C)[NH3+])cc1 ZINC000575181197 327866531 /nfs/dbraw/zinc/86/65/31/327866531.db2.gz UDJSCKVMPYNGCZ-LSDHHAIUSA-N 1 3 298.430 3.578 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2CCc3c2cccc3Cl)C1 ZINC000531700571 328025768 /nfs/dbraw/zinc/02/57/68/328025768.db2.gz REXPJBNLASSRIO-CXAGYDPISA-N 1 3 292.854 3.649 20 0 CHADHO CN1CCC[C@H]1CC[N@@H+]1CCC[C@H]1c1ccccc1Cl ZINC000534019868 328033044 /nfs/dbraw/zinc/03/30/44/328033044.db2.gz LTGOTTGCWSGMFB-YOEHRIQHSA-N 1 3 292.854 3.961 20 0 CHADHO CN1CCC[C@H]1CC[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC000534019868 328033045 /nfs/dbraw/zinc/03/30/45/328033045.db2.gz LTGOTTGCWSGMFB-YOEHRIQHSA-N 1 3 292.854 3.961 20 0 CHADHO C[C@@H](NC[C@H]1CCC[N@H+](C)C1)c1ccccc1C(C)(C)C ZINC000534353149 328048340 /nfs/dbraw/zinc/04/83/40/328048340.db2.gz PNKIVLVYJXORCQ-HZPDHXFCSA-N 1 3 288.479 3.977 20 0 CHADHO C[C@@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccccc1C(C)(C)C ZINC000534353149 328048341 /nfs/dbraw/zinc/04/83/41/328048341.db2.gz PNKIVLVYJXORCQ-HZPDHXFCSA-N 1 3 288.479 3.977 20 0 CHADHO Cc1ccc(C)c(C[NH2+]C2CCN(C(C)(C)C)CC2)c1 ZINC000048327213 328051716 /nfs/dbraw/zinc/05/17/16/328051716.db2.gz LETHCDDSZMWNMP-UHFFFAOYSA-N 1 3 274.452 3.656 20 0 CHADHO Cc1cc(C[N@H+]2CC[C@H](C3CCN(C)CC3)C2)c(C)s1 ZINC000563481156 328069749 /nfs/dbraw/zinc/06/97/49/328069749.db2.gz AKUDROQAHWIJFU-INIZCTEOSA-N 1 3 292.492 3.529 20 0 CHADHO Cc1cc(C[N@@H+]2CC[C@H](C3CCN(C)CC3)C2)c(C)s1 ZINC000563481156 328069751 /nfs/dbraw/zinc/06/97/51/328069751.db2.gz AKUDROQAHWIJFU-INIZCTEOSA-N 1 3 292.492 3.529 20 0 CHADHO Cc1cccc([C@@H](C)NCc2ccc3c(c2)C[NH2+]CC3)c1C ZINC000563542842 328072500 /nfs/dbraw/zinc/07/25/00/328072500.db2.gz MDBASEDVHOXDDD-MRXNPFEDSA-N 1 3 294.442 3.800 20 0 CHADHO c1ccc(C2CCC(CN3CC[C@@]4(CC[NH2+]C4)C3)CC2)cc1 ZINC000414769699 328221641 /nfs/dbraw/zinc/22/16/41/328221641.db2.gz XBODRHNEZBWPQL-LYBXBRPPSA-N 1 3 298.474 3.646 20 0 CHADHO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2Cl)s1)[C@H](C)N ZINC000415011899 328298571 /nfs/dbraw/zinc/29/85/71/328298571.db2.gz RJNICVIIJMXFKK-WDEREUQCSA-N 1 3 294.851 3.894 20 0 CHADHO C[N@@H+]1CCC[C@H]1CCN1CCC[C@](C)(c2ccccc2)C1 ZINC000534758346 328360543 /nfs/dbraw/zinc/36/05/43/328360543.db2.gz YURUMEHRKCVCIL-OALUTQOASA-N 1 3 286.463 3.524 20 0 CHADHO C[N@H+]1CCC[C@H]1CCN1CCC[C@](C)(c2ccccc2)C1 ZINC000534758346 328360544 /nfs/dbraw/zinc/36/05/44/328360544.db2.gz YURUMEHRKCVCIL-OALUTQOASA-N 1 3 286.463 3.524 20 0 CHADHO Cc1cc(C)c([C@H](C)N[C@@H](C)CC[NH+](C)C)cc1C ZINC000049553640 328371588 /nfs/dbraw/zinc/37/15/88/328371588.db2.gz LBHAEQABRORASY-HOTGVXAUSA-N 1 3 262.441 3.603 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@@H](C)c1ccc2ccccc2c1 ZINC000049553118 328371817 /nfs/dbraw/zinc/37/18/17/328371817.db2.gz JDANMSWZDBQRLH-CABCVRRESA-N 1 3 270.420 3.831 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@H](C)c1ccc2ccccc2c1 ZINC000049553120 328371851 /nfs/dbraw/zinc/37/18/51/328371851.db2.gz JDANMSWZDBQRLH-HUUCEWRRSA-N 1 3 270.420 3.831 20 0 CHADHO Cc1ccc(CN2CCC(C[N@@H+](C)C(C)C)CC2)cc1F ZINC000535083256 328385508 /nfs/dbraw/zinc/38/55/08/328385508.db2.gz QPXFPHHGPKYCGK-UHFFFAOYSA-N 1 3 292.442 3.686 20 0 CHADHO Cc1ccc(CN2CCC(C[N@H+](C)C(C)C)CC2)cc1F ZINC000535083256 328385510 /nfs/dbraw/zinc/38/55/10/328385510.db2.gz QPXFPHHGPKYCGK-UHFFFAOYSA-N 1 3 292.442 3.686 20 0 CHADHO C[C@H](CCC(C)(C)C)[NH2+]CCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000556583400 326951651 /nfs/dbraw/zinc/95/16/51/326951651.db2.gz IKKFKXACVQGVGK-BRWVUGGUSA-N 1 3 298.515 3.680 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)C/C(C)=C\c2ccccc2)[C@H](C)C1 ZINC000255868956 327022049 /nfs/dbraw/zinc/02/20/49/327022049.db2.gz TZACIYWDEMMGGA-FPWIVQKUSA-N 1 3 286.463 3.752 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)C/C(C)=C\c2ccccc2)[C@H](C)C1 ZINC000255868956 327022051 /nfs/dbraw/zinc/02/20/51/327022051.db2.gz TZACIYWDEMMGGA-FPWIVQKUSA-N 1 3 286.463 3.752 20 0 CHADHO C[C@@H](c1ccc2ccccc2c1)[N@@H+]1CC[C@](C)(CN)C1 ZINC000261719419 327028199 /nfs/dbraw/zinc/02/81/99/327028199.db2.gz KBBHSVLPYREGSH-KBXCAEBGSA-N 1 3 268.404 3.572 20 0 CHADHO C[C@@H](c1ccc2ccccc2c1)[N@H+]1CC[C@](C)(CN)C1 ZINC000261719419 327028200 /nfs/dbraw/zinc/02/82/00/327028200.db2.gz KBBHSVLPYREGSH-KBXCAEBGSA-N 1 3 268.404 3.572 20 0 CHADHO C[C@@H](c1ccc2ccccc2c1)N1CC[C@](C)(C[NH3+])C1 ZINC000261719419 327028202 /nfs/dbraw/zinc/02/82/02/327028202.db2.gz KBBHSVLPYREGSH-KBXCAEBGSA-N 1 3 268.404 3.572 20 0 CHADHO CC(C)[C@@H]1CC[C@H]([NH2+]C[C@H]2CCN(C(C)C)C2)C[C@H]1C ZINC000584186657 327062623 /nfs/dbraw/zinc/06/26/23/327062623.db2.gz OZXWPWLTQFWENM-BDXSIMOUSA-N 1 3 280.500 3.767 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+]Cc2cc3ccccc3s2)C1 ZINC000558418677 327092668 /nfs/dbraw/zinc/09/26/68/327092668.db2.gz DMWQNQXPJQTTLT-AWEZNQCLSA-N 1 3 288.460 3.721 20 0 CHADHO CCCN(CCC)CCC[NH2+]C1CCC(C)CC1 ZINC000558652335 327112122 /nfs/dbraw/zinc/11/21/22/327112122.db2.gz JGDRGNVCVGJXGK-UHFFFAOYSA-N 1 3 254.462 3.667 20 0 CHADHO CC[NH+](CC)CCCN1C[C@@H](c2ccccc2)C[C@H]1C ZINC000558724364 327117585 /nfs/dbraw/zinc/11/75/85/327117585.db2.gz CRDLEJZEGOULEJ-AEFFLSMTSA-N 1 3 274.452 3.596 20 0 CHADHO CCN(CC)CCC[N@@H+]1C[C@@H](c2ccccc2)C[C@H]1C ZINC000558724364 327117586 /nfs/dbraw/zinc/11/75/86/327117586.db2.gz CRDLEJZEGOULEJ-AEFFLSMTSA-N 1 3 274.452 3.596 20 0 CHADHO CCN(CC)CCC[N@H+]1C[C@@H](c2ccccc2)C[C@H]1C ZINC000558724364 327117588 /nfs/dbraw/zinc/11/75/88/327117588.db2.gz CRDLEJZEGOULEJ-AEFFLSMTSA-N 1 3 274.452 3.596 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@H]2CCCC[C@@H]2Cc2ccccc2)C1 ZINC000564470825 327197055 /nfs/dbraw/zinc/19/70/55/327197055.db2.gz PWDGWJCFCVVAQU-YRXWBPOGSA-N 1 3 286.463 3.647 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN([C@@H]2C=CCCCCC2)C1 ZINC000559796362 327262086 /nfs/dbraw/zinc/26/20/86/327262086.db2.gz SGAFGVHDJFABLI-DLBZAZTESA-N 1 3 264.457 3.539 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN([C@@H]2C=CCCCCC2)C1 ZINC000559796362 327262087 /nfs/dbraw/zinc/26/20/87/327262087.db2.gz SGAFGVHDJFABLI-DLBZAZTESA-N 1 3 264.457 3.539 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+]([C@@H]2C=CCCCCC2)C1 ZINC000559796362 327262088 /nfs/dbraw/zinc/26/20/88/327262088.db2.gz SGAFGVHDJFABLI-DLBZAZTESA-N 1 3 264.457 3.539 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+]([C@@H]2C=CCCCCC2)C1 ZINC000559796362 327262089 /nfs/dbraw/zinc/26/20/89/327262089.db2.gz SGAFGVHDJFABLI-DLBZAZTESA-N 1 3 264.457 3.539 20 0 CHADHO C[NH+](C)CCCN[C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000561138635 327369112 /nfs/dbraw/zinc/36/91/12/327369112.db2.gz SPMKXGISPGMEPI-INIZCTEOSA-N 1 3 280.843 3.723 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCCC[C@@H]2c2ccccc2)C1 ZINC000566482128 327392958 /nfs/dbraw/zinc/39/29/58/327392958.db2.gz MMDGCUFEHJFTMF-ZSYWTGECSA-N 1 3 286.463 3.820 20 0 CHADHO CC(C)[C@@H]1C[C@@H](C[NH2+][C@H]2CCC[C@@H](N)C2)c2ccccc21 ZINC000566484071 327393985 /nfs/dbraw/zinc/39/39/85/327393985.db2.gz ZOQFEMXJGAFIBW-RCJHGTSTSA-N 1 3 286.463 3.773 20 0 CHADHO C[C@H]1CCC[C@@H](N2CCC([NH2+]C[C@@H]3C[C@H]3C3CC3)CC2)C1 ZINC000449741333 327427436 /nfs/dbraw/zinc/42/74/36/327427436.db2.gz JUNQYHFSODSQTB-WQCNXYOZSA-N 1 3 290.495 3.665 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)[NH2+][C@H](C)[C@H]2CCCNC2)cc1 ZINC000570673960 327610058 /nfs/dbraw/zinc/61/00/58/327610058.db2.gz GLYGYZJEPBBRKT-MDZRGWNJSA-N 1 3 288.479 3.719 20 0 CHADHO C[C@H]([NH2+]C1CCN(c2ccncc2)CC1)C1CCCCC1 ZINC000052333063 328641485 /nfs/dbraw/zinc/64/14/85/328641485.db2.gz OCVSKHUCEKAVLQ-HNNXBMFYSA-N 1 3 287.451 3.609 20 0 CHADHO CC[NH+](CC)C[C@@H](C)Nc1cc(C)nc2ccccc21 ZINC000041677275 328714781 /nfs/dbraw/zinc/71/47/81/328714781.db2.gz XRWWLMSJNJQAMU-CQSZACIVSA-N 1 3 271.408 3.685 20 0 CHADHO C[C@H](C[NH2+]Cc1ccc(CN(C)C)cc1)Cc1ccccc1 ZINC000542517023 328799125 /nfs/dbraw/zinc/79/91/25/328799125.db2.gz ZYXANWHDQZIKOV-KRWDZBQOSA-N 1 3 296.458 3.717 20 0 CHADHO c1cc(N2CCC([NH2+]CC3CCCCCC3)CC2)ccn1 ZINC000389662071 328948704 /nfs/dbraw/zinc/94/87/04/328948704.db2.gz UKLDFJMTRUUETH-UHFFFAOYSA-N 1 3 287.451 3.610 20 0 CHADHO C[C@H](CC[N@@H+]1CC[C@@H]2[C@H](CCCN2C)C1)c1ccccc1 ZINC000194073839 329065396 /nfs/dbraw/zinc/06/53/96/329065396.db2.gz AQUZMLVODMBMNT-BHIYHBOVSA-N 1 3 286.463 3.596 20 0 CHADHO C[C@H](CC[N@H+]1CC[C@@H]2[C@H](CCCN2C)C1)c1ccccc1 ZINC000194073839 329065397 /nfs/dbraw/zinc/06/53/97/329065397.db2.gz AQUZMLVODMBMNT-BHIYHBOVSA-N 1 3 286.463 3.596 20 0 CHADHO C[C@H](C[C@@H]1CCCCC[NH2+]1)NCCCc1cccs1 ZINC000582719733 329129948 /nfs/dbraw/zinc/12/99/48/329129948.db2.gz VDEBUZVLALMLOX-CABCVRRESA-N 1 3 280.481 3.581 20 0 CHADHO C[C@H]([NH2+]CC1CCN(Cc2cccs2)CC1)C1CCC1 ZINC000178221797 329194758 /nfs/dbraw/zinc/19/47/58/329194758.db2.gz BFMOXAIOXBKMFF-AWEZNQCLSA-N 1 3 292.492 3.738 20 0 CHADHO C[C@H](NC1CCC([NH+]2CCC(C)CC2)CC1)c1ccoc1 ZINC000181664276 329235335 /nfs/dbraw/zinc/23/53/35/329235335.db2.gz XNHQSOAHNDCXCA-ZLPCBKJTSA-N 1 3 290.451 3.973 20 0 CHADHO CN(C)Cc1cccc(C[NH2+][C@@H]2CC[C@@H]2C(C)(C)C)c1 ZINC000514684458 329540947 /nfs/dbraw/zinc/54/09/47/329540947.db2.gz UFDZNYAZSUBQTN-DLBZAZTESA-N 1 3 274.452 3.663 20 0 CHADHO C[C@H](NCCCC[NH3+])c1cc(F)c(Cl)cc1Cl ZINC000037715495 329550722 /nfs/dbraw/zinc/55/07/22/329550722.db2.gz DRPJXGYEOCDVTQ-QMMMGPOBSA-N 1 3 279.186 3.522 20 0 CHADHO CC(C)(CN[C@H]1C[C@H]([NH3+])c2ccccc21)c1ccc(F)cc1 ZINC000422711232 330151539 /nfs/dbraw/zinc/15/15/39/330151539.db2.gz MKUZLRBVZLKLIS-ROUUACIJSA-N 1 3 298.405 3.838 20 0 CHADHO CC[C@H](CN[C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1)c1ccccc1 ZINC000422716506 330151804 /nfs/dbraw/zinc/15/18/04/330151804.db2.gz NHVCXZNQUJBSGI-XGXHKWSGSA-N 1 3 286.463 3.691 20 0 CHADHO CC[C@H](CN[C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1)c1ccccc1 ZINC000422716505 330151884 /nfs/dbraw/zinc/15/18/84/330151884.db2.gz NHVCXZNQUJBSGI-QXCFHYIPSA-N 1 3 286.463 3.691 20 0 CHADHO CC(C)Oc1ccc(CC[C@@H](C)[NH2+][C@@H](C)C[C@H](C)N)cc1 ZINC000422717280 330151920 /nfs/dbraw/zinc/15/19/20/330151920.db2.gz KMHBIGMXIGVRST-XHSDSOJGSA-N 1 3 292.467 3.510 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC[C@H]1CCCC[C@@H]1C ZINC000422730609 330152448 /nfs/dbraw/zinc/15/24/48/330152448.db2.gz MHWMBAZAHDJKNO-OFQRWUPVSA-N 1 3 289.467 3.716 20 0 CHADHO C[C@H](CCC[NH3+])N[C@@H](C)c1cc(F)c(Cl)cc1Cl ZINC000422728023 330152527 /nfs/dbraw/zinc/15/25/27/330152527.db2.gz IPWYEFLIZMLBSL-BDAKNGLRSA-N 1 3 293.213 3.911 20 0 CHADHO C[C@@H](N)C[C@H](C)[NH2+]CCC(c1ccccc1)c1ccccc1 ZINC000422734689 330152776 /nfs/dbraw/zinc/15/27/76/330152776.db2.gz STZILEMZZHEERK-SJORKVTESA-N 1 3 296.458 3.924 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@@H]2CC[NH2+]CC[C@@H]2C)c1C ZINC000422735178 330152856 /nfs/dbraw/zinc/15/28/56/330152856.db2.gz DLYJUUXYDBBREF-SCLBCKFNSA-N 1 3 299.462 3.571 20 0 CHADHO Clc1ccc([C@@H]([NH2+]C2CCNCC2)C2CCCC2)cc1 ZINC000422741139 330152906 /nfs/dbraw/zinc/15/29/06/330152906.db2.gz OFKVVYMIOJZWKS-KRWDZBQOSA-N 1 3 292.854 3.913 20 0 CHADHO [NH3+][C@H]1CCCCC[C@H]1NCC1(c2cccc(Cl)c2)CC1 ZINC000422757999 330153728 /nfs/dbraw/zinc/15/37/28/330153728.db2.gz DMBVTDWNOAZGFY-JKSUJKDBSA-N 1 3 292.854 3.621 20 0 CHADHO [NH3+][C@@H]1CCC[C@H]1NCC1(c2cccc(Cl)c2)CCCC1 ZINC000422764427 330154082 /nfs/dbraw/zinc/15/40/82/330154082.db2.gz PMEHMPFTLIFATF-HZPDHXFCSA-N 1 3 292.854 3.621 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](c1ccccc1)C1CCCC1 ZINC000422777754 330154692 /nfs/dbraw/zinc/15/46/92/330154692.db2.gz GLVISXKGVXGUEP-VBQJREDUSA-N 1 3 260.425 3.633 20 0 CHADHO Cc1cccc([C@H](C)CN[C@H]2C[C@@H]([NH3+])c3ccccc32)c1 ZINC000422778826 330154700 /nfs/dbraw/zinc/15/47/00/330154700.db2.gz HUVHBDIIIAZSPY-ZMYBRWDISA-N 1 3 280.415 3.833 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@@H](c1ccccc1)C(C)C ZINC000422792780 330155535 /nfs/dbraw/zinc/15/55/35/330155535.db2.gz WLAGRTKTTIONFP-DNVCBOLYSA-N 1 3 297.446 3.897 20 0 CHADHO C[C@@H](N[C@@H](C)C[C@H](C)[NH3+])c1ccc(-c2ccncc2)cc1 ZINC000422804258 330155884 /nfs/dbraw/zinc/15/58/84/330155884.db2.gz FAHVYACSAMWVLX-SOUVJXGZSA-N 1 3 283.419 3.525 20 0 CHADHO [NH3+][C@H]1C[C@@H](NCC2(c3ccccc3)CCC2)c2ccccc21 ZINC000422803603 330155899 /nfs/dbraw/zinc/15/58/99/330155899.db2.gz CZHXWVCZLOVPCB-RBUKOAKNSA-N 1 3 292.426 3.843 20 0 CHADHO C[C@H]1CCNCC[C@@H]1[NH2+]CC(C)(C)c1cccc(Cl)c1 ZINC000422819896 330156472 /nfs/dbraw/zinc/15/64/72/330156472.db2.gz JHANSNCQWRHQGE-BBRMVZONSA-N 1 3 294.870 3.595 20 0 CHADHO CC(C)(C)[C@H](N[C@@H]1CCC[NH2+]CC1)c1cccc(F)c1 ZINC000422839814 330157250 /nfs/dbraw/zinc/15/72/50/330157250.db2.gz RKXOJWPLCSAYNA-HZPDHXFCSA-N 1 3 278.415 3.645 20 0 CHADHO CC[C@H](N[C@H](C)[C@@H]1CCC[NH2+]C1)c1cccc(Cl)c1 ZINC000422853424 330157600 /nfs/dbraw/zinc/15/76/00/330157600.db2.gz BTFJHYHHDXLTES-XPKDYRNWSA-N 1 3 280.843 3.769 20 0 CHADHO C[C@H](CN[C@H]1CCC[C@H]1[NH3+])c1c(Cl)cccc1Cl ZINC000422879289 330158951 /nfs/dbraw/zinc/15/89/51/330158951.db2.gz MDMVRRXRKXYKPC-WQAKAFBOSA-N 1 3 287.234 3.566 20 0 CHADHO c1ccc(C[C@@H]2C[C@@H]2N[C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000422919127 330160532 /nfs/dbraw/zinc/16/05/32/330160532.db2.gz JLISXMPSUVNIEP-CXQPBAHBSA-N 1 3 298.474 3.518 20 0 CHADHO NC[C@H]1CCCC[C@H]1[NH2+]CCc1csc2ccccc12 ZINC000422935638 330161457 /nfs/dbraw/zinc/16/14/57/330161457.db2.gz LGXQIEKHSCMHGS-CZUORRHYSA-N 1 3 288.460 3.551 20 0 CHADHO CC[C@H](Cc1ccc(Cl)cc1)NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422983751 330162696 /nfs/dbraw/zinc/16/26/96/330162696.db2.gz UVMHVCKOHBVTNE-VPSFDDGASA-N 1 3 292.854 3.534 20 0 CHADHO c1ccc(CC[C@@H]([NH2+]C2CCNCC2)c2ccccc2)cc1 ZINC000422948194 330163695 /nfs/dbraw/zinc/16/36/95/330163695.db2.gz QWJFVCZBBSSHMP-HXUWFJFHSA-N 1 3 294.442 3.702 20 0 CHADHO C[C@H](CCC[NH3+])NC1(c2c(Cl)cccc2Cl)CC1 ZINC000422958924 330164219 /nfs/dbraw/zinc/16/42/19/330164219.db2.gz ZLPKMHLRHRGYIP-SNVBAGLBSA-N 1 3 287.234 3.700 20 0 CHADHO Cc1ccc(CC[C@H](C)N[C@H]2C[C@H]([NH3+])c3ccccc32)o1 ZINC000423008517 330165111 /nfs/dbraw/zinc/16/51/11/330165111.db2.gz SWSXZBMKFPFWCM-IGNZVWTISA-N 1 3 284.403 3.644 20 0 CHADHO C[C@H](Cc1c(Cl)cccc1Cl)N[C@H](C)C[C@H](C)[NH3+] ZINC000423017138 330165456 /nfs/dbraw/zinc/16/54/56/330165456.db2.gz VMPLDGIQZVOVNV-HBNTYKKESA-N 1 3 289.250 3.640 20 0 CHADHO C[C@H](Cc1c(Cl)cccc1Cl)[NH2+][C@H](C)C[C@H](C)N ZINC000423017138 330165458 /nfs/dbraw/zinc/16/54/58/330165458.db2.gz VMPLDGIQZVOVNV-HBNTYKKESA-N 1 3 289.250 3.640 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@@H]1NCC1(c2ccccc2Cl)CC1 ZINC000423021357 330165592 /nfs/dbraw/zinc/16/55/92/330165592.db2.gz FAZXAYGPXFSQNA-CVEARBPZSA-N 1 3 292.854 3.621 20 0 CHADHO NC[C@@H]1CCC[C@@H]1[NH2+]CC1(Cc2ccccc2)CCCC1 ZINC000423049475 330167047 /nfs/dbraw/zinc/16/70/47/330167047.db2.gz XSBCGSBBYREHDY-ROUUACIJSA-N 1 3 286.463 3.507 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]C[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000423056470 330167319 /nfs/dbraw/zinc/16/73/19/330167319.db2.gz FXRYKYNNUUDWDY-GRYCIOLGSA-N 1 3 288.357 3.524 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NC[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000423056470 330167321 /nfs/dbraw/zinc/16/73/21/330167321.db2.gz FXRYKYNNUUDWDY-GRYCIOLGSA-N 1 3 288.357 3.524 20 0 CHADHO c1ccc(CC2(C[NH2+]C3CCNCC3)CCCCC2)cc1 ZINC000423054076 330167349 /nfs/dbraw/zinc/16/73/49/330167349.db2.gz SYEFZIKGIQANCR-UHFFFAOYSA-N 1 3 286.463 3.521 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC[C@H](C)CC(C)(C)C ZINC000423059671 330167733 /nfs/dbraw/zinc/16/77/33/330167733.db2.gz MMVLGVAGHJNTLH-KBPBESRZSA-N 1 3 291.483 3.962 20 0 CHADHO c1cc(C2CC2)ccc1CN[C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000423072778 330168465 /nfs/dbraw/zinc/16/84/65/330168465.db2.gz JUZJHQCWKIJSAB-GUDVDZBRSA-N 1 3 284.447 3.574 20 0 CHADHO C[C@@H](CCCC[NH3+])NCc1ccc(-c2ccco2)cc1F ZINC000423083609 330168791 /nfs/dbraw/zinc/16/87/91/330168791.db2.gz GCNQDBWRAGEFHI-ZDUSSCGKSA-N 1 3 290.382 3.693 20 0 CHADHO CSc1ccc(CCN[C@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000423094921 330169521 /nfs/dbraw/zinc/16/95/21/330169521.db2.gz KZNIJBJCTRZLSC-MSOLQXFVSA-N 1 3 298.455 3.685 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@@H]1CCC[C@H](C)[C@H]1C ZINC000423105664 330170496 /nfs/dbraw/zinc/17/04/96/330170496.db2.gz ZEDLKBWCIXUPHU-FQLMCAECSA-N 1 3 289.467 3.572 20 0 CHADHO C=Cc1ccc(CCN[C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000423133285 330171800 /nfs/dbraw/zinc/17/18/00/330171800.db2.gz CRWUBTXESCFLQH-SLFFLAALSA-N 1 3 298.474 3.773 20 0 CHADHO C=Cc1ccc(CC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCCN2)cc1 ZINC000423133285 330171801 /nfs/dbraw/zinc/17/18/01/330171801.db2.gz CRWUBTXESCFLQH-SLFFLAALSA-N 1 3 298.474 3.773 20 0 CHADHO C[C@H](N[C@H]1CCC[NH2+]CC1)c1ccc(F)c2ccccc21 ZINC000423137148 330172272 /nfs/dbraw/zinc/17/22/72/330172272.db2.gz ZSVIVMCWPBQUGB-KBPBESRZSA-N 1 3 286.394 3.772 20 0 CHADHO CC(C)(C)C1CC([NH2+][C@@H]2CCC[C@H]2[C@H]2CCCCN2)C1 ZINC000423140401 330172391 /nfs/dbraw/zinc/17/23/91/330172391.db2.gz YCHITEXXISTQEL-IRKLFDGPSA-N 1 3 278.484 3.712 20 0 CHADHO C[C@H](N[C@@H](C)[C@@H]1CCC[NH2+]C1)c1cccc(C2CC2)c1 ZINC000423143150 330172460 /nfs/dbraw/zinc/17/24/60/330172460.db2.gz CLXYQJSJSOYTMV-SUNYJGFJSA-N 1 3 272.436 3.603 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](c1ccc(F)c(Cl)c1)C1CC1 ZINC000423153447 330173128 /nfs/dbraw/zinc/17/31/28/330173128.db2.gz GNSOWCPLJIQVTQ-FEUHOPSXSA-N 1 3 284.806 3.646 20 0 CHADHO CC(C)=CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000423152170 330173134 /nfs/dbraw/zinc/17/31/34/330173134.db2.gz DSWVYVAQRWPAKQ-KGLIPLIRSA-N 1 3 275.440 3.634 20 0 CHADHO C[C@H](N[C@@H]1CC[C@@H](c2cccc(Cl)c2)C1)[C@H]1CC[NH2+]C1 ZINC000423160715 330173640 /nfs/dbraw/zinc/17/36/40/330173640.db2.gz HQUYIPCZCHTOHJ-PWXKEOIMSA-N 1 3 292.854 3.564 20 0 CHADHO Clc1cccc([C@@H]2CC[C@@H]([NH2+][C@@H]3CCCNCC3)C2)c1 ZINC000423165814 330173882 /nfs/dbraw/zinc/17/38/82/330173882.db2.gz QJVMJPYPRYTHHE-DJIMGWMZSA-N 1 3 292.854 3.708 20 0 CHADHO C[C@H](C[C@H]1CCCCC[NH2+]1)N1CCC[C@@]2(CCSC2)C1 ZINC000423167809 330174174 /nfs/dbraw/zinc/17/41/74/330174174.db2.gz XGUJSAUTOQCHAR-BRWVUGGUSA-N 1 3 296.524 3.516 20 0 CHADHO CCC[C@H](NCCC[NH3+])c1ccc(Cl)c(Cl)c1 ZINC000423175100 330174751 /nfs/dbraw/zinc/17/47/51/330174751.db2.gz CXXNDPMEJFBHBX-ZDUSSCGKSA-N 1 3 275.223 3.773 20 0 CHADHO CSc1ccc([C@H](C)[NH2+]CC2(N)CCCCC2)cc1 ZINC000423177250 330174991 /nfs/dbraw/zinc/17/49/91/330174991.db2.gz IRRFHEBVXHRYPZ-ZDUSSCGKSA-N 1 3 278.465 3.721 20 0 CHADHO CSc1ccc([C@@H](C)[NH2+]CC2(N)CCCCC2)cc1 ZINC000423177249 330175110 /nfs/dbraw/zinc/17/51/10/330175110.db2.gz IRRFHEBVXHRYPZ-CYBMUJFWSA-N 1 3 278.465 3.721 20 0 CHADHO Cc1cccc(C[C@H](NCC2([NH3+])CCCCC2)C2CC2)c1 ZINC000423182228 330175357 /nfs/dbraw/zinc/17/53/57/330175357.db2.gz QFWAUTUDOPUGGX-SFHVURJKSA-N 1 3 286.463 3.567 20 0 CHADHO C[C@H]([NH2+]CC1(N)CCCCC1)c1cc2c(s1)CCC2 ZINC000423183905 330175631 /nfs/dbraw/zinc/17/56/31/330175631.db2.gz SHPMAEMZBFIEAD-LBPRGKRZSA-N 1 3 278.465 3.549 20 0 CHADHO CNCCC[NH2+][C@@H]1CCC[C@@H](c2cccc(Cl)c2)C1 ZINC000423199163 330176468 /nfs/dbraw/zinc/17/64/68/330176468.db2.gz JJHWMORVIRBPTL-GDBMZVCRSA-N 1 3 280.843 3.565 20 0 CHADHO C[NH2+]CCCN[C@@H]1CCC[C@@H](c2cccc(Cl)c2)C1 ZINC000423199163 330176469 /nfs/dbraw/zinc/17/64/69/330176469.db2.gz JJHWMORVIRBPTL-GDBMZVCRSA-N 1 3 280.843 3.565 20 0 CHADHO CCC[C@H](N[C@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(OC)cc1 ZINC000423221949 330179808 /nfs/dbraw/zinc/17/98/08/330179808.db2.gz YUVPNGZTJOOLRJ-KYJSFNMBSA-N 1 3 290.451 3.514 20 0 CHADHO CCC[C@H]([NH2+][C@H](C)[C@@H]1CCCNC1)c1ccc(OC)cc1 ZINC000423221949 330179809 /nfs/dbraw/zinc/17/98/09/330179809.db2.gz YUVPNGZTJOOLRJ-KYJSFNMBSA-N 1 3 290.451 3.514 20 0 CHADHO C[C@@H]([NH3+])CCN[C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423224629 330180176 /nfs/dbraw/zinc/18/01/76/330180176.db2.gz JQHLXEASRDPOKZ-IAQYHMDHSA-N 1 3 266.816 3.508 20 0 CHADHO C[C@@H](NCC[C@H](C)[NH3+])c1cccc(-c2ccccc2)c1 ZINC000423225214 330180093 /nfs/dbraw/zinc/18/00/93/330180093.db2.gz LSZZTKBSEGSHGT-LSDHHAIUSA-N 1 3 268.404 3.742 20 0 CHADHO C[C@@H]([NH3+])CCN[C@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000423227986 330180476 /nfs/dbraw/zinc/18/04/76/330180476.db2.gz XUKXRDLJNGQSKP-IUODEOHRSA-N 1 3 266.404 3.630 20 0 CHADHO Clc1cc2c(c(Cl)c1)[C@H](NCC[C@H]1CC[NH2+]C1)CC2 ZINC000423251690 330182875 /nfs/dbraw/zinc/18/28/75/330182875.db2.gz SKSLNICWIABMGA-QMTHXVAHSA-N 1 3 299.245 3.570 20 0 CHADHO CSc1ccccc1[C@H](C)N[C@@H]1CCCC[C@@H]1C[NH3+] ZINC000423275018 330184751 /nfs/dbraw/zinc/18/47/51/330184751.db2.gz LHGFBAOIWPAIFU-GZBFAFLISA-N 1 3 278.465 3.577 20 0 CHADHO CC(C)([NH3+])CN[C@@H]1CCC[C@@H](c2cccc(Cl)c2)C1 ZINC000423286662 330186261 /nfs/dbraw/zinc/18/62/61/330186261.db2.gz IAJORBBHTIXZIZ-UKRRQHHQSA-N 1 3 280.843 3.693 20 0 CHADHO CCOc1ccc([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000423289842 330186334 /nfs/dbraw/zinc/18/63/34/330186334.db2.gz BRBUWGSHTFDUBZ-CABCVRRESA-N 1 3 298.430 3.956 20 0 CHADHO C[C@H](CC(C)(C)c1c[nH]c2ccccc21)NCC(C)(C)[NH3+] ZINC000423288914 330186504 /nfs/dbraw/zinc/18/65/04/330186504.db2.gz VRPSPAWJNULWKY-CYBMUJFWSA-N 1 3 287.451 3.551 20 0 CHADHO CCOc1ccc([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000423289845 330186541 /nfs/dbraw/zinc/18/65/41/330186541.db2.gz BRBUWGSHTFDUBZ-LSDHHAIUSA-N 1 3 298.430 3.956 20 0 CHADHO CC[C@@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1cccc(OC)c1 ZINC000423288971 330186545 /nfs/dbraw/zinc/18/65/45/330186545.db2.gz AEVQWHOZBHXDKT-AUUYWEPGSA-N 1 3 298.430 3.956 20 0 CHADHO Cc1cccc2c1CC[C@H]2NCc1ccc([C@@H](C)[NH3+])cc1 ZINC000423290102 330186780 /nfs/dbraw/zinc/18/67/80/330186780.db2.gz CKGHPSOATYRGDY-AUUYWEPGSA-N 1 3 280.415 3.792 20 0 CHADHO Cc1cc([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)cs1 ZINC000423290965 330187111 /nfs/dbraw/zinc/18/71/11/330187111.db2.gz GBSWXXBQBRDTKB-STQMWFEESA-N 1 3 274.433 3.927 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@H](c2cccnc2)C2CCC2)cc1 ZINC000423292894 330187735 /nfs/dbraw/zinc/18/77/35/330187735.db2.gz OVUROUXQXHHLLH-LIRRHRJNSA-N 1 3 295.430 3.732 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H]2CCCc3ccccc32)cc1 ZINC000423294970 330188395 /nfs/dbraw/zinc/18/83/95/330188395.db2.gz VXDSSQFYGOLOOJ-KUHUBIRLSA-N 1 3 280.415 3.874 20 0 CHADHO C[C@H](C[NH3+])CN[C@H](C)c1ccc(-c2ccc(F)cc2)s1 ZINC000423304372 330189262 /nfs/dbraw/zinc/18/92/62/330189262.db2.gz YLSSJAATZJJAAR-VXGBXAGGSA-N 1 3 292.423 3.800 20 0 CHADHO C[C@H](NC[C@H]([NH3+])C1CC1)C(c1ccccc1)c1ccccc1 ZINC000423314422 330189851 /nfs/dbraw/zinc/18/98/51/330189851.db2.gz HCRIVQVWYZCQSX-KXBFYZLASA-N 1 3 294.442 3.534 20 0 CHADHO N[C@H](C[NH2+][C@@H](CC1CC1)c1ccc(Cl)cc1)C1CC1 ZINC000423313545 330189872 /nfs/dbraw/zinc/18/98/72/330189872.db2.gz FULRGNUZMGMNSP-CVEARBPZSA-N 1 3 278.827 3.508 20 0 CHADHO C[C@H](CN)[NH2+][C@@H](Cc1ccccc1Cl)c1ccsc1 ZINC000423322406 330190258 /nfs/dbraw/zinc/19/02/58/330190258.db2.gz IOAWLYYXRGAHNK-ABAIWWIYSA-N 1 3 294.851 3.622 20 0 CHADHO CC[C@H]([NH2+]C[C@H](N)C1CC1)c1ccc2cc(OC)ccc2c1 ZINC000423322668 330190520 /nfs/dbraw/zinc/19/05/20/330190520.db2.gz OCYWLUSFEYXLJO-OALUTQOASA-N 1 3 298.430 3.626 20 0 CHADHO CCC[C@H](NC[C@]1(C)CCC[NH2+]C1)c1ccc(OC)cc1 ZINC000423331401 330191343 /nfs/dbraw/zinc/19/13/43/330191343.db2.gz OEOJRZVSAPXRJP-ZWKOTPCHSA-N 1 3 290.451 3.516 20 0 CHADHO CCC[C@H]([NH2+]C[C@]1(C)CCCNC1)c1ccc(OC)cc1 ZINC000423331401 330191345 /nfs/dbraw/zinc/19/13/45/330191345.db2.gz OEOJRZVSAPXRJP-ZWKOTPCHSA-N 1 3 290.451 3.516 20 0 CHADHO C[C@H](NCC1=CC[NH2+]CC1)c1cccc(Cl)c1Cl ZINC000423342952 330191905 /nfs/dbraw/zinc/19/19/05/330191905.db2.gz LDJUSULCQXNQON-JTQLQIEISA-N 1 3 285.218 3.564 20 0 CHADHO C[C@@H](NCC1=CC[NH2+]CC1)c1cc2cc(Cl)ccc2o1 ZINC000423342474 330192060 /nfs/dbraw/zinc/19/20/60/330192060.db2.gz KZHVYHUIRNAEJR-LLVKDONJSA-N 1 3 290.794 3.657 20 0 CHADHO Cc1cc(C)c([C@@H](C)NC[C@@]2(C)CCC[NH2+]C2)cc1C ZINC000423344317 330192415 /nfs/dbraw/zinc/19/24/15/330192415.db2.gz XQACXLYFPYOWSW-AEFFLSMTSA-N 1 3 274.452 3.652 20 0 CHADHO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@]2(C)CCCNC2)cc1C ZINC000423344317 330192417 /nfs/dbraw/zinc/19/24/17/330192417.db2.gz XQACXLYFPYOWSW-AEFFLSMTSA-N 1 3 274.452 3.652 20 0 CHADHO Cc1ccc([C@H](C)NCc2ccc3c(c2)C[NH2+]C3)c(C)c1 ZINC000423353897 330193077 /nfs/dbraw/zinc/19/30/77/330193077.db2.gz FFYPBSMFSYTDPN-HNNXBMFYSA-N 1 3 280.415 3.757 20 0 CHADHO Cc1cc([C@@H](C)NCc2ccc3c(c2)C[NH2+]C3)c(C)s1 ZINC000423357093 330193400 /nfs/dbraw/zinc/19/34/00/330193400.db2.gz LMJICWBSYSUYLY-GFCCVEGCSA-N 1 3 286.444 3.819 20 0 CHADHO CCC[C@H]([NH2+][C@H]1CCNC[C@@H]1C)c1ccc(Cl)cc1 ZINC000423363923 330194172 /nfs/dbraw/zinc/19/41/72/330194172.db2.gz CDEDSFXDBGZPNU-RCBQFDQVSA-N 1 3 280.843 3.769 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1cccc(-c2ccncc2)c1 ZINC000423372949 330195325 /nfs/dbraw/zinc/19/53/25/330195325.db2.gz HKRNZOBCYMSKNZ-ZOCIIQOWSA-N 1 3 295.430 3.669 20 0 CHADHO Clc1ccc2c(c1)CC[C@@H]2NCc1ccc2c(c1)C[NH2+]C2 ZINC000423372785 330195416 /nfs/dbraw/zinc/19/54/16/330195416.db2.gz HCWLDTIKXBQYFT-SFHVURJKSA-N 1 3 298.817 3.720 20 0 CHADHO C[C@@H](NC[C@H]1CC[C@H](C[NH3+])CC1)c1ccc(F)cc1Cl ZINC000423415816 330197654 /nfs/dbraw/zinc/19/76/54/330197654.db2.gz BGWGMTACJGOIJR-JHJVBQTASA-N 1 3 298.833 3.895 20 0 CHADHO C[C@H]([NH2+][C@H]1CCN[C@H](C)C1)c1ccc(F)c2ccccc21 ZINC000423374742 330198636 /nfs/dbraw/zinc/19/86/36/330198636.db2.gz IHLSJPWDBMJSIQ-RDBSUJKOSA-N 1 3 286.394 3.770 20 0 CHADHO Cc1cccc2c1[C@@H](C)C[C@@H]2NCc1ccc2c(c1)C[NH2+]C2 ZINC000423382997 330199259 /nfs/dbraw/zinc/19/92/59/330199259.db2.gz KCVRQOJSWSVQAN-LIRRHRJNSA-N 1 3 292.426 3.936 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1cccc(-c2ccncc2)c1 ZINC000423382421 330199443 /nfs/dbraw/zinc/19/94/43/330199443.db2.gz OXGXUSJURPUWRD-SPYBWZPUSA-N 1 3 295.430 3.540 20 0 CHADHO Cc1ccccc1[C@H]([NH2+][C@H]1CCNC[C@@H]1C)C1CCCC1 ZINC000423386275 330199479 /nfs/dbraw/zinc/19/94/79/330199479.db2.gz GZZPJRJDEHSADI-ZYSHUDEJSA-N 1 3 286.463 3.814 20 0 CHADHO Cc1ccccc1[C@H](N[C@H]1CC[NH2+]C[C@@H]1C)C1CCCC1 ZINC000423386275 330199481 /nfs/dbraw/zinc/19/94/81/330199481.db2.gz GZZPJRJDEHSADI-ZYSHUDEJSA-N 1 3 286.463 3.814 20 0 CHADHO CC[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1ccc(Cl)s1 ZINC000423384288 330199725 /nfs/dbraw/zinc/19/97/25/330199725.db2.gz KSFAKOUBOQIYCX-DCAQKATOSA-N 1 3 272.845 3.712 20 0 CHADHO CC(C)C[C@H]([NH2+][C@H]1CCN[C@H](C)C1)c1ccccc1 ZINC000423386865 330199928 /nfs/dbraw/zinc/19/99/28/330199928.db2.gz RUMLAJUXCPTEMV-PVAVHDDUSA-N 1 3 260.425 3.504 20 0 CHADHO CC(C)C[C@H]([NH2+][C@@H]1CCN[C@@H](C)C1)c1ccccc1 ZINC000423386866 330199975 /nfs/dbraw/zinc/19/99/75/330199975.db2.gz RUMLAJUXCPTEMV-UAGQMJEPSA-N 1 3 260.425 3.504 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@H]2c2ccccc2)C1 ZINC000423387355 330200011 /nfs/dbraw/zinc/20/00/11/330200011.db2.gz MMEJHBHULQORGR-VSZNYVQBSA-N 1 3 272.436 3.572 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CCN[C@H](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423388661 330200133 /nfs/dbraw/zinc/20/01/33/330200133.db2.gz UNHGCUUDRHENTE-NJMOYASZSA-N 1 3 298.883 3.624 20 0 CHADHO C[C@@H](N[C@@H]1CC[NH2+][C@H](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423388661 330200134 /nfs/dbraw/zinc/20/01/34/330200134.db2.gz UNHGCUUDRHENTE-NJMOYASZSA-N 1 3 298.883 3.624 20 0 CHADHO COc1ccc([C@H](C)N[C@H]2CCC[C@@H]([NH3+])C2)c2ccccc12 ZINC000423394401 330200563 /nfs/dbraw/zinc/20/05/63/330200563.db2.gz RKGLEHXYAPKXIE-ZNMIVQPWSA-N 1 3 298.430 3.769 20 0 CHADHO CC(C)[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1cc2ccccc2o1 ZINC000423395157 330200960 /nfs/dbraw/zinc/20/09/60/330200960.db2.gz RTHQZLVHUIAJHX-MPGHIAIKSA-N 1 3 286.419 3.989 20 0 CHADHO CCC[C@H]([NH2+][C@@H](C)[C@@H](C)N)c1ccc(Cl)cc1 ZINC000423454141 330203405 /nfs/dbraw/zinc/20/34/05/330203405.db2.gz YQSKOLCZQHUZHW-SUNKGSAMSA-N 1 3 254.805 3.507 20 0 CHADHO CC[C@@H](N)C[NH2+][C@@H](c1ccc(C(F)(F)F)cc1)C(C)C ZINC000423465186 330204439 /nfs/dbraw/zinc/20/44/39/330204439.db2.gz MOZPEOAPIBQJDC-ZIAGYGMSSA-N 1 3 288.357 3.729 20 0 CHADHO CC[C@@H](N)C[NH2+][C@H](c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000423471008 330204992 /nfs/dbraw/zinc/20/49/92/330204992.db2.gz PMULTLFKRHVVBG-RISCZKNCSA-N 1 3 287.234 3.771 20 0 CHADHO C[C@@H](NCCC[C@H]1CCC[NH2+]1)c1ccccc1Cl ZINC000423486461 330206804 /nfs/dbraw/zinc/20/68/04/330206804.db2.gz SUOCMTCNFGMIDY-OLZOCXBDSA-N 1 3 266.816 3.523 20 0 CHADHO COc1ccc([C@@H](C)N[C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423494256 330207568 /nfs/dbraw/zinc/20/75/68/330207568.db2.gz AJZURGZOWWWEHA-BEFAXECRSA-N 1 3 298.430 3.826 20 0 CHADHO C[C@H](N[C@@H](CCC[NH3+])c1ccccc1)c1cccc(O)c1 ZINC000423496460 330207915 /nfs/dbraw/zinc/20/79/15/330207915.db2.gz DXBPIBNUNNFKIN-KSSFIOAISA-N 1 3 284.403 3.523 20 0 CHADHO CC[C@H](N[C@H](CCC[NH3+])c1ccccc1)c1ccncc1 ZINC000423499049 330208244 /nfs/dbraw/zinc/20/82/44/330208244.db2.gz ADUMSZOYWSDFLP-ZWKOTPCHSA-N 1 3 283.419 3.603 20 0 CHADHO C[C@H](N[C@H](CCC[NH3+])c1ccccc1)c1cccs1 ZINC000423510043 330209153 /nfs/dbraw/zinc/20/91/53/330209153.db2.gz RWHUHCBEVYBSEO-DZGCQCFKSA-N 1 3 274.433 3.879 20 0 CHADHO Cc1ccc([C@H](C)N[C@H](CCC[NH3+])c2ccccc2)o1 ZINC000423511531 330209392 /nfs/dbraw/zinc/20/93/92/330209392.db2.gz UAOIQOJDHCZJCT-GOEBONIOSA-N 1 3 272.392 3.719 20 0 CHADHO Clc1ccc([C@H]2CC[C@H]([NH2+]CCCNC3CC3)C2)cc1 ZINC000423542847 330211097 /nfs/dbraw/zinc/21/10/97/330211097.db2.gz BDVKPMYTMNBUGD-YOEHRIQHSA-N 1 3 292.854 3.708 20 0 CHADHO C[C@@H]1CCC[N@H+](Cc2ccc(CNCC3(F)CC3)cc2)C1 ZINC000527514141 330255727 /nfs/dbraw/zinc/25/57/27/330255727.db2.gz MZHDVYRORICAJN-OAHLLOKOSA-N 1 3 290.426 3.510 20 0 CHADHO C[C@@H]1CCC[N@@H+](Cc2ccc(CNCC3(F)CC3)cc2)C1 ZINC000527514141 330255729 /nfs/dbraw/zinc/25/57/29/330255729.db2.gz MZHDVYRORICAJN-OAHLLOKOSA-N 1 3 290.426 3.510 20 0 CHADHO C[C@H]1CCCC[N@@H+]1Cc1ccc(CNCC2(F)CC2)cc1 ZINC000527514186 330255907 /nfs/dbraw/zinc/25/59/07/330255907.db2.gz XREVKEHSWWRPOX-HNNXBMFYSA-N 1 3 290.426 3.653 20 0 CHADHO C[C@H]1CCCC[N@H+]1Cc1ccc(CNCC2(F)CC2)cc1 ZINC000527514186 330255908 /nfs/dbraw/zinc/25/59/08/330255908.db2.gz XREVKEHSWWRPOX-HNNXBMFYSA-N 1 3 290.426 3.653 20 0 CHADHO C[C@H]1CCC[N@H+](Cc2ccc(CNCC3(F)CC3)cc2)C1 ZINC000527514140 330255930 /nfs/dbraw/zinc/25/59/30/330255930.db2.gz MZHDVYRORICAJN-HNNXBMFYSA-N 1 3 290.426 3.510 20 0 CHADHO C[C@H]1CCC[N@@H+](Cc2ccc(CNCC3(F)CC3)cc2)C1 ZINC000527514140 330255931 /nfs/dbraw/zinc/25/59/31/330255931.db2.gz MZHDVYRORICAJN-HNNXBMFYSA-N 1 3 290.426 3.510 20 0 CHADHO CCC(F)(F)C(C)(C)C[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000527640073 330268186 /nfs/dbraw/zinc/26/81/86/330268186.db2.gz BEGBTHDTLPYVEY-UHFFFAOYSA-N 1 3 290.442 3.910 20 0 CHADHO CCC(F)(F)C(C)(C)CNC1CC[NH+](C(C)(C)C)CC1 ZINC000527640073 330268187 /nfs/dbraw/zinc/26/81/87/330268187.db2.gz BEGBTHDTLPYVEY-UHFFFAOYSA-N 1 3 290.442 3.910 20 0 CHADHO CN1CC=C(C[NH2+][C@H]2CCC[C@H](c3ccccc3)CC2)CC1 ZINC000527682503 330271059 /nfs/dbraw/zinc/27/10/59/330271059.db2.gz HJZAHRHFUSROGQ-PMACEKPBSA-N 1 3 298.474 3.954 20 0 CHADHO CC[C@H](N[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1cc(C)ccc1C ZINC000527817354 330282829 /nfs/dbraw/zinc/28/28/29/330282829.db2.gz CMXISNXUNAQDHN-AOIWGVFYSA-N 1 3 286.463 3.971 20 0 CHADHO CC[C@H](N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(C)ccc1C ZINC000527817354 330282830 /nfs/dbraw/zinc/28/28/30/330282830.db2.gz CMXISNXUNAQDHN-AOIWGVFYSA-N 1 3 286.463 3.971 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@@H](C)c2cccc(C(C)C)c2)C1 ZINC000527844245 330287548 /nfs/dbraw/zinc/28/75/48/330287548.db2.gz AJMWGYPYGPFQOF-HOTGVXAUSA-N 1 3 274.452 3.802 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@@H](C)c2cccc(C(C)C)c2)C1 ZINC000527844245 330287549 /nfs/dbraw/zinc/28/75/49/330287549.db2.gz AJMWGYPYGPFQOF-HOTGVXAUSA-N 1 3 274.452 3.802 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2cccc(C(C)C)c2)C1 ZINC000527844245 330287550 /nfs/dbraw/zinc/28/75/50/330287550.db2.gz AJMWGYPYGPFQOF-HOTGVXAUSA-N 1 3 274.452 3.802 20 0 CHADHO CC[C@H](C)[C@@H](C)[NH2+][C@H](C)c1ccc(OCCN(C)C)cc1 ZINC000536878742 330313375 /nfs/dbraw/zinc/31/33/75/330313375.db2.gz STKSPPQOTGZJLN-ARFHVFGLSA-N 1 3 292.467 3.712 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2c(C)cc(C)cc2C)[C@@H](C)C1 ZINC000533072663 330326937 /nfs/dbraw/zinc/32/69/37/330326937.db2.gz WZBXYBBOSYBNBI-HKUYNNGSSA-N 1 3 288.479 3.774 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2c(C)cc(C)cc2C)[C@@H](C)C1 ZINC000533072663 330326938 /nfs/dbraw/zinc/32/69/38/330326938.db2.gz WZBXYBBOSYBNBI-HKUYNNGSSA-N 1 3 288.479 3.774 20 0 CHADHO C[C@@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccc2c(c1)CCCC2 ZINC000044534231 330329731 /nfs/dbraw/zinc/32/97/31/330329731.db2.gz FBYWFVDSHKSONJ-CVEARBPZSA-N 1 3 286.463 3.558 20 0 CHADHO C[C@@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccc2c(c1)CCCC2 ZINC000044534231 330329732 /nfs/dbraw/zinc/32/97/32/330329732.db2.gz FBYWFVDSHKSONJ-CVEARBPZSA-N 1 3 286.463 3.558 20 0 CHADHO [NH3+][C@@H]1CCCC[C@H]1NCCCc1cccc2ccccc21 ZINC000424330497 330342189 /nfs/dbraw/zinc/34/21/89/330342189.db2.gz IDQMAEXFOBBOLO-RTBURBONSA-N 1 3 282.431 3.632 20 0 CHADHO C[C@H]([NH2+]CC(C)(C)CN(C)C)c1ccc(Cl)c(F)c1 ZINC000212813345 330366953 /nfs/dbraw/zinc/36/69/53/330366953.db2.gz LWBFEDJUPWCAMU-NSHDSACASA-N 1 3 286.822 3.718 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](c2ccc(F)c(C)c2)C2CC2)C1 ZINC000536948470 330373112 /nfs/dbraw/zinc/37/31/12/330373112.db2.gz UMGWULUHYFZVDP-KDOFPFPSSA-N 1 3 290.426 3.517 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](c2ccc(F)c(C)c2)C2CC2)C1 ZINC000536948470 330373113 /nfs/dbraw/zinc/37/31/13/330373113.db2.gz UMGWULUHYFZVDP-KDOFPFPSSA-N 1 3 290.426 3.517 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](c2ccc(F)c(C)c2)C2CC2)C1 ZINC000536948470 330373114 /nfs/dbraw/zinc/37/31/14/330373114.db2.gz UMGWULUHYFZVDP-KDOFPFPSSA-N 1 3 290.426 3.517 20 0 CHADHO C[C@@H]1C[C@H](N[C@@H](c2ccc(F)cc2)C(C)(C)C)CC[N@@H+]1C ZINC000120429182 330388723 /nfs/dbraw/zinc/38/87/23/330388723.db2.gz PUUMSKAMCQQZLR-XYPHTWIQSA-N 1 3 292.442 3.985 20 0 CHADHO C[C@@H]1C[C@H](N[C@@H](c2ccc(F)cc2)C(C)(C)C)CC[N@H+]1C ZINC000120429182 330388724 /nfs/dbraw/zinc/38/87/24/330388724.db2.gz PUUMSKAMCQQZLR-XYPHTWIQSA-N 1 3 292.442 3.985 20 0 CHADHO Cc1cc([C@@H](C)[NH2+]C[C@@H]2CCCN(C(C)C)C2)cs1 ZINC000453113598 331090415 /nfs/dbraw/zinc/09/04/15/331090415.db2.gz UMMPEFPTURWKJS-CABCVRRESA-N 1 3 280.481 3.828 20 0 CHADHO C[C@H]1CC[C@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2sccc21 ZINC000453347656 331120209 /nfs/dbraw/zinc/12/02/09/331120209.db2.gz KXMBHSRZKYTBSX-DUCPWMDDSA-N 1 3 290.476 3.901 20 0 CHADHO C[C@H]1CC[C@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2sccc21 ZINC000453347656 331120210 /nfs/dbraw/zinc/12/02/10/331120210.db2.gz KXMBHSRZKYTBSX-DUCPWMDDSA-N 1 3 290.476 3.901 20 0 CHADHO C[C@H]1CC[C@@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2sccc21 ZINC000453347673 331120286 /nfs/dbraw/zinc/12/02/86/331120286.db2.gz KXMBHSRZKYTBSX-QGMOTEBLSA-N 1 3 290.476 3.901 20 0 CHADHO C[C@H]1CC[C@@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2sccc21 ZINC000453347673 331120287 /nfs/dbraw/zinc/12/02/87/331120287.db2.gz KXMBHSRZKYTBSX-QGMOTEBLSA-N 1 3 290.476 3.901 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]CCc2ccc(Cl)cc2)C1 ZINC000459419172 331280486 /nfs/dbraw/zinc/28/04/86/331280486.db2.gz BDHXNKYEHGAULR-INIZCTEOSA-N 1 3 294.870 3.593 20 0 CHADHO CC(C)[N@@H+]1CCC[C@@H](CNCCc2ccc(Cl)cc2)C1 ZINC000459419172 331280487 /nfs/dbraw/zinc/28/04/87/331280487.db2.gz BDHXNKYEHGAULR-INIZCTEOSA-N 1 3 294.870 3.593 20 0 CHADHO CC(C)[N@H+]1CCC[C@@H](CNCCc2ccc(Cl)cc2)C1 ZINC000459419172 331280488 /nfs/dbraw/zinc/28/04/88/331280488.db2.gz BDHXNKYEHGAULR-INIZCTEOSA-N 1 3 294.870 3.593 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]CCc2cccc(Cl)c2)C1 ZINC000459425980 331280802 /nfs/dbraw/zinc/28/08/02/331280802.db2.gz LOLCHJOQDDFSIH-MRXNPFEDSA-N 1 3 294.870 3.593 20 0 CHADHO CC(C)[N@@H+]1CCC[C@H](CNCCc2cccc(Cl)c2)C1 ZINC000459425980 331280803 /nfs/dbraw/zinc/28/08/03/331280803.db2.gz LOLCHJOQDDFSIH-MRXNPFEDSA-N 1 3 294.870 3.593 20 0 CHADHO CC(C)[N@H+]1CCC[C@H](CNCCc2cccc(Cl)c2)C1 ZINC000459425980 331280804 /nfs/dbraw/zinc/28/08/04/331280804.db2.gz LOLCHJOQDDFSIH-MRXNPFEDSA-N 1 3 294.870 3.593 20 0 CHADHO CCCC[NH+]1CCC(Nc2cc(C)nc3ccccc32)CC1 ZINC000462381393 331321012 /nfs/dbraw/zinc/32/10/12/331321012.db2.gz VMNVRNPKVYVTJW-UHFFFAOYSA-N 1 3 297.446 3.642 20 0 CHADHO CC[NH+](CC)C[C@H]1CCN(CCC2CCCCC2)C1 ZINC000464782686 331368007 /nfs/dbraw/zinc/36/80/07/331368007.db2.gz ZJYJLQVIPPHSCT-QGZVFWFLSA-N 1 3 266.473 3.621 20 0 CHADHO CCN(CC)C[C@H]1CC[N@H+](CCC2CCCCC2)C1 ZINC000464782686 331368008 /nfs/dbraw/zinc/36/80/08/331368008.db2.gz ZJYJLQVIPPHSCT-QGZVFWFLSA-N 1 3 266.473 3.621 20 0 CHADHO CCN(CC)C[C@H]1CC[N@@H+](CCC2CCCCC2)C1 ZINC000464782686 331368009 /nfs/dbraw/zinc/36/80/09/331368009.db2.gz ZJYJLQVIPPHSCT-QGZVFWFLSA-N 1 3 266.473 3.621 20 0 CHADHO C[C@@H]([NH2+]Cc1cccc(CN(C)C)c1)C1CCCCC1 ZINC000474889391 331602896 /nfs/dbraw/zinc/60/28/96/331602896.db2.gz RHEMYZYQUYZVMR-OAHLLOKOSA-N 1 3 274.452 3.807 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCCC1)[C@@H](C)c1ccc(Cl)cc1 ZINC000474888568 331603028 /nfs/dbraw/zinc/60/30/28/331603028.db2.gz PKBUHKACDCRAJD-HUUCEWRRSA-N 1 3 294.870 3.908 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]([NH2+][C@@H]3CCN4CCC[C@H]4C3)C2)cc1 ZINC000488364970 332002130 /nfs/dbraw/zinc/00/21/30/332002130.db2.gz ICXIXLMEUNXKON-WCIQWLHISA-N 1 3 298.474 3.929 20 0 CHADHO c1ccc([C@@H]2CCC[C@H](N[C@@H]3CC[N@@H+]4CCC[C@H]4C3)C2)cc1 ZINC000488364970 332002131 /nfs/dbraw/zinc/00/21/31/332002131.db2.gz ICXIXLMEUNXKON-WCIQWLHISA-N 1 3 298.474 3.929 20 0 CHADHO c1ccc([C@@H]2CCC[C@H](N[C@@H]3CC[N@H+]4CCC[C@H]4C3)C2)cc1 ZINC000488364970 332002132 /nfs/dbraw/zinc/00/21/32/332002132.db2.gz ICXIXLMEUNXKON-WCIQWLHISA-N 1 3 298.474 3.929 20 0 CHADHO CC[NH+](CC)CC1CCN([C@@H](C)c2ccccc2F)CC1 ZINC000488419822 332006141 /nfs/dbraw/zinc/00/61/41/332006141.db2.gz MIHSQXBGBJYVKI-HNNXBMFYSA-N 1 3 292.442 3.941 20 0 CHADHO CC(C)(C[NH2+][C@H]1CS[C@H](C(C)(C)C)C1)CN1CCCC1 ZINC000488531949 332015904 /nfs/dbraw/zinc/01/59/04/332015904.db2.gz FSTIOVRZASIHLV-CABCVRRESA-N 1 3 298.540 3.618 20 0 CHADHO CC(C)(CN[C@H]1CS[C@H](C(C)(C)C)C1)C[NH+]1CCCC1 ZINC000488531949 332015905 /nfs/dbraw/zinc/01/59/05/332015905.db2.gz FSTIOVRZASIHLV-CABCVRRESA-N 1 3 298.540 3.618 20 0 CHADHO C[C@@H]1CCCC[C@@H]1[NH+]1CCC(N[C@H]2CCCSC2)CC1 ZINC000513336326 333014623 /nfs/dbraw/zinc/01/46/23/333014623.db2.gz WJTBVDKSFSFIOY-PVAVHDDUSA-N 1 3 296.524 3.515 20 0 CHADHO C[C@@H]1CCCC[C@@H]1N1CCC([NH2+][C@H]2CCCSC2)CC1 ZINC000513336326 333014625 /nfs/dbraw/zinc/01/46/25/333014625.db2.gz WJTBVDKSFSFIOY-PVAVHDDUSA-N 1 3 296.524 3.515 20 0 CHADHO C1=CC[C@@H](CN2CCC[C@H](C[NH+]3CCCCCC3)C2)CC1 ZINC000513411453 333018047 /nfs/dbraw/zinc/01/80/47/333018047.db2.gz MWUHPMQRYQESRL-RTBURBONSA-N 1 3 290.495 3.931 20 0 CHADHO C1=CC[C@@H](C[N@H+]2CCC[C@H](CN3CCCCCC3)C2)CC1 ZINC000513411453 333018048 /nfs/dbraw/zinc/01/80/48/333018048.db2.gz MWUHPMQRYQESRL-RTBURBONSA-N 1 3 290.495 3.931 20 0 CHADHO C1=CC[C@@H](C[N@@H+]2CCC[C@H](CN3CCCCCC3)C2)CC1 ZINC000513411453 333018050 /nfs/dbraw/zinc/01/80/50/333018050.db2.gz MWUHPMQRYQESRL-RTBURBONSA-N 1 3 290.495 3.931 20 0 CHADHO C[C@@H]([NH2+]C[C@H](C)CN1CCCC1)[C@@H]1C[C@H]1c1ccccc1 ZINC000516880649 333085284 /nfs/dbraw/zinc/08/52/84/333085284.db2.gz ZFHMTRYCNYZVBT-NBMJBFSESA-N 1 3 286.463 3.500 20 0 CHADHO C[C@H](CCC1CC1)[NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000186498758 333161997 /nfs/dbraw/zinc/16/19/97/333161997.db2.gz GQYDRUHKGQBFHQ-HLLBOEOZSA-N 1 3 278.484 3.808 20 0 CHADHO CC1=C[C@@H](C)C[C@@H](C[NH2+]C2CCN(C(C)(C)C)CC2)C1 ZINC000235700329 333371650 /nfs/dbraw/zinc/37/16/50/333371650.db2.gz UXSGJARHUHTGEU-GDBMZVCRSA-N 1 3 278.484 3.831 20 0 CHADHO C[N@H+](CCCNC/C=C/c1ccccc1)Cc1ccccc1 ZINC000237076893 333377332 /nfs/dbraw/zinc/37/73/32/333377332.db2.gz HZICWBHWPTUFMW-RIYZIHGNSA-N 1 3 294.442 3.812 20 0 CHADHO C[N@@H+](CCCNC/C=C/c1ccccc1)Cc1ccccc1 ZINC000237076893 333377333 /nfs/dbraw/zinc/37/73/33/333377333.db2.gz HZICWBHWPTUFMW-RIYZIHGNSA-N 1 3 294.442 3.812 20 0 CHADHO CN(Cc1ccc2ccccc2c1)C[C@@H]1CCC[N@H+](C)C1 ZINC000524970867 333394350 /nfs/dbraw/zinc/39/43/50/333394350.db2.gz CBEIWGUROZEONH-QGZVFWFLSA-N 1 3 282.431 3.613 20 0 CHADHO CN(Cc1ccc2ccccc2c1)C[C@@H]1CCC[N@@H+](C)C1 ZINC000524970867 333394352 /nfs/dbraw/zinc/39/43/52/333394352.db2.gz CBEIWGUROZEONH-QGZVFWFLSA-N 1 3 282.431 3.613 20 0 CHADHO C[C@H]([NH2+]CC[C@H]1CCCN1C)c1ccc2c(c1)CCCC2 ZINC000546936298 334056564 /nfs/dbraw/zinc/05/65/64/334056564.db2.gz ZJUDOBWAPLXPON-HNAYVOBHSA-N 1 3 286.463 3.700 20 0 CHADHO CC(C)CC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000564318908 334083788 /nfs/dbraw/zinc/08/37/88/334083788.db2.gz LRSUCJQEEYJEIQ-OKZBNKHCSA-N 1 3 280.500 3.911 20 0 CHADHO C[C@@H]1CC[N@H+](CCCN2CCCCC2)[C@H]2CCCC[C@@H]12 ZINC000547737602 334113528 /nfs/dbraw/zinc/11/35/28/334113528.db2.gz ZZKPMJSVJIYBRL-SQNIBIBYSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@@H]1CC[N@@H+](CCCN2CCCCC2)[C@H]2CCCC[C@@H]12 ZINC000547737602 334113529 /nfs/dbraw/zinc/11/35/29/334113529.db2.gz ZZKPMJSVJIYBRL-SQNIBIBYSA-N 1 3 278.484 3.763 20 0 CHADHO CC(C)CC[C@@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)C1CC1 ZINC000549228202 334188217 /nfs/dbraw/zinc/18/82/17/334188217.db2.gz HMCGCEVBCWIFBT-FUHWJXTLSA-N 1 3 280.500 3.911 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@H](C)c2ccc(C)c(C)c2)C1 ZINC000246948170 334272627 /nfs/dbraw/zinc/27/26/27/334272627.db2.gz HZRUASLERNNPBB-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@H](C)c2ccc(C)c(C)c2)C1 ZINC000246948170 334272629 /nfs/dbraw/zinc/27/26/29/334272629.db2.gz HZRUASLERNNPBB-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](C)c2ccc(C)c(C)c2)C1 ZINC000246948170 334272631 /nfs/dbraw/zinc/27/26/31/334272631.db2.gz HZRUASLERNNPBB-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO C[NH+]1CCC([C@@H]2CCN(Cc3cccc(Cl)c3)C2)CC1 ZINC000550199908 334215771 /nfs/dbraw/zinc/21/57/71/334215771.db2.gz WYTBRWQHGJFIFX-MRXNPFEDSA-N 1 3 292.854 3.504 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H]2c3ccccc3C[C@H]2C)C1 ZINC000247059366 334274606 /nfs/dbraw/zinc/27/46/06/334274606.db2.gz PMMKVJYJQKVAGS-MDZRGWNJSA-N 1 3 286.463 3.630 20 0 CHADHO CC(C)[N@@H+]1CCC[C@H](CN[C@@H]2c3ccccc3C[C@H]2C)C1 ZINC000247059366 334274607 /nfs/dbraw/zinc/27/46/07/334274607.db2.gz PMMKVJYJQKVAGS-MDZRGWNJSA-N 1 3 286.463 3.630 20 0 CHADHO CC(C)[N@H+]1CCC[C@H](CN[C@@H]2c3ccccc3C[C@H]2C)C1 ZINC000247059366 334274608 /nfs/dbraw/zinc/27/46/08/334274608.db2.gz PMMKVJYJQKVAGS-MDZRGWNJSA-N 1 3 286.463 3.630 20 0 CHADHO C(C1CCCCC1)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246447338 334257907 /nfs/dbraw/zinc/25/79/07/334257907.db2.gz DQADZARDUDACJO-WMZOPIPTSA-N 1 3 276.468 3.515 20 0 CHADHO C(C1CCCCC1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246447338 334257908 /nfs/dbraw/zinc/25/79/08/334257908.db2.gz DQADZARDUDACJO-WMZOPIPTSA-N 1 3 276.468 3.515 20 0 CHADHO C[C@H]([NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1)c1ccccc1 ZINC000248397591 334300106 /nfs/dbraw/zinc/30/01/06/334300106.db2.gz ICVXLZSOBBQCCT-BQFCYCMXSA-N 1 3 286.463 3.990 20 0 CHADHO CC[N@@H+]1CCC[C@@H]1CN[C@H](C)c1ccc(SC)cc1 ZINC000248533888 334305037 /nfs/dbraw/zinc/30/50/37/334305037.db2.gz UEIBCRSWBMYJRH-UKRRQHHQSA-N 1 3 278.465 3.543 20 0 CHADHO CC[N@H+]1CCC[C@@H]1CN[C@H](C)c1ccc(SC)cc1 ZINC000248533888 334305038 /nfs/dbraw/zinc/30/50/38/334305038.db2.gz UEIBCRSWBMYJRH-UKRRQHHQSA-N 1 3 278.465 3.543 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC000249091941 334327300 /nfs/dbraw/zinc/32/73/00/334327300.db2.gz DJKARLMOZLEMSD-XDQVBPFNSA-N 1 3 292.389 3.570 20 0 CHADHO c1ccc(C[C@@H]2CC[C@H]([NH2+][C@H]3CCN4CCC[C@H]4C3)C2)cc1 ZINC000249144204 334329110 /nfs/dbraw/zinc/32/91/10/334329110.db2.gz WWCLITQMCIRGLJ-MUGJNUQGSA-N 1 3 298.474 3.614 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+]CC[C@H](C)c2ccccc2)C1 ZINC000250517289 334345547 /nfs/dbraw/zinc/34/55/47/334345547.db2.gz RBZPSXXIIVDTMZ-IRXDYDNUSA-N 1 3 274.452 3.500 20 0 CHADHO CC(C)(C)[C@H](N[C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000250695674 334348762 /nfs/dbraw/zinc/34/87/62/334348762.db2.gz LXFPMWHMQPAMNU-OKZBNKHCSA-N 1 3 286.463 3.990 20 0 CHADHO CC(C)(C)[C@H](N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000250695674 334348763 /nfs/dbraw/zinc/34/87/63/334348763.db2.gz LXFPMWHMQPAMNU-OKZBNKHCSA-N 1 3 286.463 3.990 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CC[C@@H]([NH3+])[C@H](C)C2)cc1 ZINC000251918755 334372089 /nfs/dbraw/zinc/37/20/89/334372089.db2.gz XTZFYPMPALEZND-JKIFEVAISA-N 1 3 260.425 3.540 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](CC(C)C)c2ccccc2)C1 ZINC000252438744 334380244 /nfs/dbraw/zinc/38/02/44/334380244.db2.gz FZZYYOODDSSKCO-SJLPKXTDSA-N 1 3 274.452 3.705 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](CC(C)C)c2ccccc2)C1 ZINC000252438744 334380246 /nfs/dbraw/zinc/38/02/46/334380246.db2.gz FZZYYOODDSSKCO-SJLPKXTDSA-N 1 3 274.452 3.705 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](CC(C)C)c2ccccc2)C1 ZINC000252438744 334380247 /nfs/dbraw/zinc/38/02/47/334380247.db2.gz FZZYYOODDSSKCO-SJLPKXTDSA-N 1 3 274.452 3.705 20 0 CHADHO CC(C)(C)C1CCC([NH2+][C@H]2CCN3CCC[C@H]3C2)CC1 ZINC000252673756 334384828 /nfs/dbraw/zinc/38/48/28/334384828.db2.gz LZTKVVINMWYDFB-GQGLESIBSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@@H]1CC[C@H](N[C@@H]2C[C@@H]([NH3+])c3ccccc32)C[C@H]1C ZINC000252783415 334392773 /nfs/dbraw/zinc/39/27/73/334392773.db2.gz NWTWGZOFAMPNCJ-XIUQWWLSSA-N 1 3 258.409 3.546 20 0 CHADHO CC(C)CC[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)C1CC1 ZINC000555226817 334471680 /nfs/dbraw/zinc/47/16/80/334471680.db2.gz NGAJPDOCRXFWIN-ZACQAIPSSA-N 1 3 266.473 3.664 20 0 CHADHO CC(C)CC[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)C1CC1 ZINC000555226814 334471718 /nfs/dbraw/zinc/47/17/18/334471718.db2.gz NGAJPDOCRXFWIN-BBWFWOEESA-N 1 3 266.473 3.664 20 0 CHADHO CC(C)CN1CCC([NH2+]C[C@H]2C[C@H]2c2ccccc2)CC1 ZINC000163441039 334868245 /nfs/dbraw/zinc/86/82/45/334868245.db2.gz BDXLQSAWMUYXSG-MJGOQNOKSA-N 1 3 286.463 3.500 20 0 CHADHO CCC[C@@H](Cc1ccccc1)[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000576692827 335235231 /nfs/dbraw/zinc/23/52/31/335235231.db2.gz LEINXIPPGXMXGV-OALUTQOASA-N 1 3 288.479 3.718 20 0 CHADHO c1ccc(C2(CNC3C[C@H]4CC[C@@H](C3)[NH2+]4)CCCCC2)cc1 ZINC000580550499 335277595 /nfs/dbraw/zinc/27/75/95/335277595.db2.gz MNDVLZRWBHRVMQ-DFNIBXOVSA-N 1 3 298.474 3.761 20 0 CHADHO C[C@@H](NCCCCC[NH+]1CCCCC1)c1ccoc1 ZINC000178145056 335419568 /nfs/dbraw/zinc/41/95/68/335419568.db2.gz JGFBHAVEQYTBPM-OAHLLOKOSA-N 1 3 264.413 3.586 20 0 CHADHO CC[C@@H](C)N1CCCC2(CCC[N@@H+]([C@H](C)CC)C2)C1 ZINC000581280375 336036212 /nfs/dbraw/zinc/03/62/12/336036212.db2.gz AFPWMKHIULPSAB-YNPPLXCJSA-N 1 3 266.473 3.761 20 0 CHADHO CC[C@@H](C)N1CCCC2(CCC[N@H+]([C@H](C)CC)C2)C1 ZINC000581280375 336036214 /nfs/dbraw/zinc/03/62/14/336036214.db2.gz AFPWMKHIULPSAB-YNPPLXCJSA-N 1 3 266.473 3.761 20 0 CHADHO CC(C)C(C[NH2+]C1CC(C)(C)NC(C)(C)C1)C(C)C ZINC000381662395 336070172 /nfs/dbraw/zinc/07/01/72/336070172.db2.gz NJEHCWHOKHVZJE-UHFFFAOYSA-N 1 3 268.489 3.813 20 0 CHADHO Cc1cccc([C@H](C)[NH2+]C2CCN(c3ccncc3)CC2)c1 ZINC000387471685 336194108 /nfs/dbraw/zinc/19/41/08/336194108.db2.gz FOWITAUSTQPFPC-INIZCTEOSA-N 1 3 295.430 3.710 20 0 CHADHO CC(C)(CN[C@H]1C[C@@H]([NH3+])c2ccccc21)c1cccs1 ZINC000157473666 519270060 /nfs/dbraw/zinc/27/00/60/519270060.db2.gz XUTRKZJQGLNTDZ-CABCVRRESA-N 1 3 286.444 3.760 20 0 CHADHO CC[NH+](CC)Cc1ccc(CNCc2ccsc2)cc1 ZINC000020146476 520751245 /nfs/dbraw/zinc/75/12/45/520751245.db2.gz ACUSULBFCRDCAC-UHFFFAOYSA-N 1 3 288.460 3.880 20 0 CHADHO CC[C@H]([NH2+]CC1(SC)CCN(C)CC1)c1cccs1 ZINC000353612598 522574383 /nfs/dbraw/zinc/57/43/83/522574383.db2.gz SLIVQQBKUHKFNM-ZDUSSCGKSA-N 1 3 298.521 3.616 20 0 CHADHO C[C@@H]([NH2+]C/C=C/c1ccccc1)[C@H]1CCCN(C2CCC2)C1 ZINC000299105764 525392385 /nfs/dbraw/zinc/39/23/85/525392385.db2.gz VCMVFYMPGZATAM-UXYGNLPZSA-N 1 3 298.474 3.942 20 0 CHADHO C[C@@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1ccsc1 ZINC000050344076 525401705 /nfs/dbraw/zinc/40/17/05/525401705.db2.gz CKSLWWNVDDHWEH-GFCCVEGCSA-N 1 3 266.454 3.662 20 0 CHADHO Cc1ccsc1[C@@H](C)NC1CC[NH+](C(C)C)CC1 ZINC000070981946 525868123 /nfs/dbraw/zinc/86/81/23/525868123.db2.gz FSCJGYRGNMCSPE-CYBMUJFWSA-N 1 3 266.454 3.580 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]2[NH2+][C@@H]2CCN3CCC[C@H]3C2)cc1 ZINC000278450926 526490979 /nfs/dbraw/zinc/49/09/79/526490979.db2.gz LLSWZHQRDQURBB-YDZRNGNQSA-N 1 3 284.447 3.539 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]2N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000278450926 526490985 /nfs/dbraw/zinc/49/09/85/526490985.db2.gz LLSWZHQRDQURBB-YDZRNGNQSA-N 1 3 284.447 3.539 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]2N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000278450926 526490991 /nfs/dbraw/zinc/49/09/91/526490991.db2.gz LLSWZHQRDQURBB-YDZRNGNQSA-N 1 3 284.447 3.539 20 0 CHADHO [NH3+]CC1CCN(Cc2sc3ccccc3c2Cl)CC1 ZINC000044513458 527167478 /nfs/dbraw/zinc/16/74/78/527167478.db2.gz BTZIYTAFNTXQGR-UHFFFAOYSA-N 1 3 294.851 3.725 20 0 CHADHO [NH3+][C@@H]1C[C@H](NCCc2ccc(Cl)cc2)c2ccccc21 ZINC000157263427 527378047 /nfs/dbraw/zinc/37/80/47/527378047.db2.gz ZSRFUSKSVXTSEQ-SJORKVTESA-N 1 3 286.806 3.617 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2ccc3occc3c2)[C@@H](C)C1 ZINC000347862865 527755890 /nfs/dbraw/zinc/75/58/90/527755890.db2.gz WVRFIPOJNSEWCG-WMLDXEAASA-N 1 3 286.419 3.595 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2ccc3occc3c2)[C@@H](C)C1 ZINC000347862865 527755894 /nfs/dbraw/zinc/75/58/94/527755894.db2.gz WVRFIPOJNSEWCG-WMLDXEAASA-N 1 3 286.419 3.595 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2ccc3occc3c2)[C@H](C)C1 ZINC000347862861 527835688 /nfs/dbraw/zinc/83/56/88/527835688.db2.gz WVRFIPOJNSEWCG-PBHICJAKSA-N 1 3 286.419 3.595 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2ccc3occc3c2)[C@H](C)C1 ZINC000347862861 527835695 /nfs/dbraw/zinc/83/56/95/527835695.db2.gz WVRFIPOJNSEWCG-PBHICJAKSA-N 1 3 286.419 3.595 20 0 CHADHO CC(C)CC[C@H]([NH2+]CC(C)(C)CN(C)C)c1ccoc1 ZINC000353441479 527845800 /nfs/dbraw/zinc/84/58/00/527845800.db2.gz MVVOXAMUILNRBK-INIZCTEOSA-N 1 3 280.456 3.934 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H](C)C1CCC(F)(F)CC1 ZINC000353244225 528112244 /nfs/dbraw/zinc/11/22/44/528112244.db2.gz PMSXVKOKMUJWTK-ZDUSSCGKSA-N 1 3 276.415 3.522 20 0 CHADHO CCc1ccc([C@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)N3C)o1 ZINC000126803555 1125457335 /nfs/dbraw/zinc/45/73/35/1125457335.db2.gz GECMXYUESLGACI-AVOUXACISA-N 1 3 276.424 3.508 20 0 CHADHO CCCCc1ccc(CN2C[C@H](C[NH3+])CC[C@@H]2C)s1 ZINC001206772188 1117871758 /nfs/dbraw/zinc/87/17/58/1117871758.db2.gz ZAOVVUXBIUSOFV-KBPBESRZSA-N 1 3 280.481 3.650 20 0 CHADHO CC[C@@H](NC[C@@H]1CCCC[N@H+](C)C1)c1cccs1 ZINC000624120261 1117985784 /nfs/dbraw/zinc/98/57/84/1117985784.db2.gz VACWZPVSPSLYFC-UONOGXRCSA-N 1 3 266.454 3.521 20 0 CHADHO CC[C@@H](NC[C@@H]1CCCC[N@@H+](C)C1)c1cccs1 ZINC000624120261 1117985786 /nfs/dbraw/zinc/98/57/86/1117985786.db2.gz VACWZPVSPSLYFC-UONOGXRCSA-N 1 3 266.454 3.521 20 0 CHADHO CC[C@H]([NH2+]CC[C@@H]1CCCN1C)c1ccc(C)cc1 ZINC000181711710 1118004254 /nfs/dbraw/zinc/00/42/54/1118004254.db2.gz FQVKEFSNIPWRGK-IRXDYDNUSA-N 1 3 260.425 3.520 20 0 CHADHO CN(CCC1=CCCCC1)CC[C@@H]1CCCC[N@@H+]1C ZINC001657424498 1118455767 /nfs/dbraw/zinc/45/57/67/1118455767.db2.gz QSZQEJWPCWVWJN-KRWDZBQOSA-N 1 3 264.457 3.683 20 0 CHADHO CN(CCC1=CCCCC1)CC[C@@H]1CCCC[N@H+]1C ZINC001657424498 1118455773 /nfs/dbraw/zinc/45/57/73/1118455773.db2.gz QSZQEJWPCWVWJN-KRWDZBQOSA-N 1 3 264.457 3.683 20 0 CHADHO CN1CCCC[C@@H]1CC[N@H+](C)Cc1ccc2ncccc2c1 ZINC000130882289 1125485986 /nfs/dbraw/zinc/48/59/86/1125485986.db2.gz OENIJWXDCZOIQA-GOSISDBHSA-N 1 3 297.446 3.541 20 0 CHADHO CN1CCCC[C@@H]1CC[N@@H+](C)Cc1ccc2ncccc2c1 ZINC000130882289 1125485990 /nfs/dbraw/zinc/48/59/90/1125485990.db2.gz OENIJWXDCZOIQA-GOSISDBHSA-N 1 3 297.446 3.541 20 0 CHADHO Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]CC(C)(C)CN(C)C ZINC000132116509 1125499721 /nfs/dbraw/zinc/49/97/21/1125499721.db2.gz XOKUYPKGLVAZCF-GFCCVEGCSA-N 1 3 297.512 3.813 20 0 CHADHO C[C@H]1CCCC[C@H]1[NH+]1CCC(NCCC(C)(C)F)CC1 ZINC000658192278 1119699451 /nfs/dbraw/zinc/69/94/51/1119699451.db2.gz FDOWPJODDSEUQH-GOEBONIOSA-N 1 3 284.463 3.757 20 0 CHADHO CCC[C@@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccsc1 ZINC000187711246 1120032512 /nfs/dbraw/zinc/03/25/12/1120032512.db2.gz SNJYAUDQMBSQGL-DZGCQCFKSA-N 1 3 266.454 3.521 20 0 CHADHO CCC[C@@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccsc1 ZINC000187711246 1120032518 /nfs/dbraw/zinc/03/25/18/1120032518.db2.gz SNJYAUDQMBSQGL-DZGCQCFKSA-N 1 3 266.454 3.521 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@H](C)C2CCC(F)(F)CC2)C1 ZINC000685455740 1120177593 /nfs/dbraw/zinc/17/75/93/1120177593.db2.gz ZMDNNSCJPUKUDJ-ZIAGYGMSSA-N 1 3 288.426 3.520 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1csc(Cl)c1 ZINC000191166120 1120515757 /nfs/dbraw/zinc/51/57/57/1120515757.db2.gz YVPKEETZIMREKI-GHMZBOCLSA-N 1 3 284.856 3.536 20 0 CHADHO CCCCC[C@H](CCC)[N@@H+]1CC[C@@]2(C1)CNCC[C@H]2F ZINC001246693714 1131782417 /nfs/dbraw/zinc/78/24/17/1131782417.db2.gz QGRVIHYNLIELSU-BBWFWOEESA-N 1 3 284.463 3.759 20 0 CHADHO CCCCC[C@H](CCC)[N@H+]1CC[C@@]2(C1)CNCC[C@H]2F ZINC001246693714 1131782419 /nfs/dbraw/zinc/78/24/19/1131782419.db2.gz QGRVIHYNLIELSU-BBWFWOEESA-N 1 3 284.463 3.759 20 0 CHADHO CCC[C@@H](C)CC[C@H](C)[N@H+](CCOCC)C1CCNCC1 ZINC001246950575 1131828947 /nfs/dbraw/zinc/82/89/47/1131828947.db2.gz QEJDWTQNJTXZTL-SJORKVTESA-N 1 3 298.515 3.682 20 0 CHADHO CCC[C@@H](C)CC[C@H](C)[N@@H+](CCOCC)C1CCNCC1 ZINC001246950575 1131828954 /nfs/dbraw/zinc/82/89/54/1131828954.db2.gz QEJDWTQNJTXZTL-SJORKVTESA-N 1 3 298.515 3.682 20 0 CHADHO CCCCc1ccc(CN2CC[C@H](C)[C@@H](C[NH3+])C2)s1 ZINC001205306333 1133558362 /nfs/dbraw/zinc/55/83/62/1133558362.db2.gz VNYGXDFBGMFUCB-KBPBESRZSA-N 1 3 280.481 3.507 20 0 CHADHO c1ccc(C2([NH2+]C3CCNCC3)CCCCCC2)cc1 ZINC000168574632 1125545256 /nfs/dbraw/zinc/54/52/56/1125545256.db2.gz ZUEMZXPATUHQMP-UHFFFAOYSA-N 1 3 272.436 3.578 20 0 CHADHO c1ccc(C2(NC3CC[NH2+]CC3)CCCCCC2)cc1 ZINC000168574632 1125545265 /nfs/dbraw/zinc/54/52/65/1125545265.db2.gz ZUEMZXPATUHQMP-UHFFFAOYSA-N 1 3 272.436 3.578 20 0 CHADHO CSC1(C[NH2+]C2CCN(C3CCCCC3)CC2)CCC1 ZINC000193808963 1125549992 /nfs/dbraw/zinc/54/99/92/1125549992.db2.gz JEHNTXRVSNOPSQ-UHFFFAOYSA-N 1 3 296.524 3.659 20 0 CHADHO Cc1ccc([C@@H](C)NCc2ccc(F)c(CN(C)C)c2)o1 ZINC000120974382 1125554096 /nfs/dbraw/zinc/55/40/96/1125554096.db2.gz JWNHREQSORMAAP-CYBMUJFWSA-N 1 3 290.382 3.640 20 0 CHADHO Cc1ccc([C@@H](C)NCc2ccc(F)c(C[NH+](C)C)c2)o1 ZINC000120974382 1125554101 /nfs/dbraw/zinc/55/41/01/1125554101.db2.gz JWNHREQSORMAAP-CYBMUJFWSA-N 1 3 290.382 3.640 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(F)c(CN(C)C)c2)o1 ZINC000120974382 1125554105 /nfs/dbraw/zinc/55/41/05/1125554105.db2.gz JWNHREQSORMAAP-CYBMUJFWSA-N 1 3 290.382 3.640 20 0 CHADHO CCN1CC[C@H]([N@H+](C)Cc2ccc([C@@H]3C[C@@H]3C)o2)[C@@H](C)C1 ZINC000245771691 1125593975 /nfs/dbraw/zinc/59/39/75/1125593975.db2.gz RZASARWNGFBHJO-DIECFANBSA-N 1 3 290.451 3.565 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)Cc2ccc([C@@H]3C[C@@H]3C)o2)[C@@H](C)C1 ZINC000245771691 1125593978 /nfs/dbraw/zinc/59/39/78/1125593978.db2.gz RZASARWNGFBHJO-DIECFANBSA-N 1 3 290.451 3.565 20 0 CHADHO Cc1coc(C[NH2+]C2CCN([C@H](C)c3ccccc3)CC2)c1 ZINC000885990525 1125632791 /nfs/dbraw/zinc/63/27/91/1125632791.db2.gz JHVXSKXECWNUFS-MRXNPFEDSA-N 1 3 298.430 3.903 20 0 CHADHO C[C@@H]([NH2+]CC[C@@H]1C[C@H]1C1CC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000886127955 1125654047 /nfs/dbraw/zinc/65/40/47/1125654047.db2.gz YOFYJRLVWKIOFF-MYZZLAAOSA-N 1 3 290.495 3.665 20 0 CHADHO CCC1(N2CCC2)CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000886707621 1125712044 /nfs/dbraw/zinc/71/20/44/1125712044.db2.gz MQMCCTRDBSCZGC-INIZCTEOSA-N 1 3 272.436 3.698 20 0 CHADHO C[C@H]([NH3+])[C@@H]1CCCN(C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000262047630 1125750297 /nfs/dbraw/zinc/75/02/97/1125750297.db2.gz ZDMSFHSGDQSPDX-VNHYZAJKSA-N 1 3 280.843 3.503 20 0 CHADHO c1cc2c(cccc2CN2CCC[C@H]([NH+]3CCCC3)CC2)[nH]1 ZINC000093564167 1125770711 /nfs/dbraw/zinc/77/07/11/1125770711.db2.gz GFGSYLXIRWCORS-KRWDZBQOSA-N 1 3 297.446 3.618 20 0 CHADHO CCSc1ccc([C@H](C)[NH2+]CCCN2CCCC2)cc1 ZINC000533784303 1125781188 /nfs/dbraw/zinc/78/11/88/1125781188.db2.gz IOPFKCJXVMZWKV-HNNXBMFYSA-N 1 3 292.492 3.935 20 0 CHADHO CC1=C(c2ccco2)C[N@H+](CC[C@@H]2CCCCN2C)CC1 ZINC000338342109 1126736368 /nfs/dbraw/zinc/73/63/68/1126736368.db2.gz FKCNUSQPFCAJQA-INIZCTEOSA-N 1 3 288.435 3.633 20 0 CHADHO CC1=C(c2ccco2)C[N@@H+](CC[C@@H]2CCCCN2C)CC1 ZINC000338342109 1126736369 /nfs/dbraw/zinc/73/63/69/1126736369.db2.gz FKCNUSQPFCAJQA-INIZCTEOSA-N 1 3 288.435 3.633 20 0 CHADHO C(CC1CCCC1)CN1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000483200422 1126772702 /nfs/dbraw/zinc/77/27/02/1126772702.db2.gz QKPRANWRVIBUDE-GOSISDBHSA-N 1 3 278.484 3.907 20 0 CHADHO CC[C@@H]1CN([C@@H](C)c2ccc(C(C)C)cc2)CC[C@H]1[NH3+] ZINC000251899225 1126799868 /nfs/dbraw/zinc/79/98/68/1126799868.db2.gz WQNYHCPRIPLOBK-HDMKZQKVSA-N 1 3 274.452 3.930 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)c1cccc(Cl)c1 ZINC000484500316 1126822056 /nfs/dbraw/zinc/82/20/56/1126822056.db2.gz KOSGRLNHCKKOOT-RCBQFDQVSA-N 1 3 280.843 3.863 20 0 CHADHO Cc1cccc([C@H](C)[NH2+][C@@H]2CCC[C@H](N(C)C)C2)c1C ZINC000484482067 1126820858 /nfs/dbraw/zinc/82/08/58/1126820858.db2.gz BJHZATBGENROBM-BBWFWOEESA-N 1 3 274.452 3.827 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+][C@@H]1CCCC[C@H]1c1ccccc1 ZINC000484625112 1126837497 /nfs/dbraw/zinc/83/74/97/1126837497.db2.gz SXDGXSPXRPJMFB-CEXWTWQISA-N 1 3 286.463 3.787 20 0 CHADHO CCC[C@H](NC[C@@H]1CC[N@H+](CC)C1)c1ccsc1 ZINC000191208454 1126949156 /nfs/dbraw/zinc/94/91/56/1126949156.db2.gz HLCSCXOAOCYUNW-ZFWWWQNUSA-N 1 3 266.454 3.521 20 0 CHADHO CCC[C@H](NC[C@@H]1CC[N@@H+](CC)C1)c1ccsc1 ZINC000191208454 1126949159 /nfs/dbraw/zinc/94/91/59/1126949159.db2.gz HLCSCXOAOCYUNW-ZFWWWQNUSA-N 1 3 266.454 3.521 20 0 CHADHO CCC[C@H]([NH2+]C[C@@H]1CCN(CC)C1)c1ccsc1 ZINC000191208454 1126949161 /nfs/dbraw/zinc/94/91/61/1126949161.db2.gz HLCSCXOAOCYUNW-ZFWWWQNUSA-N 1 3 266.454 3.521 20 0 CHADHO C[C@@H](N[C@@H](C)CC[NH+](C)C)c1cccc(-c2ccncc2)c1 ZINC000268807061 1127024815 /nfs/dbraw/zinc/02/48/15/1127024815.db2.gz ABNFGWWOIOFAMD-JKSUJKDBSA-N 1 3 297.446 3.739 20 0 CHADHO CN(C)CC1(C[NH2+]Cc2cc(Cl)cs2)CCCC1 ZINC000487558291 1127034761 /nfs/dbraw/zinc/03/47/61/1127034761.db2.gz KPMBHSZZOBGHCY-UHFFFAOYSA-N 1 3 286.872 3.613 20 0 CHADHO Cc1ccc([C@H](C)NC2CC[NH+](C3CCC3)CC2)c(C)c1 ZINC000269001175 1127031961 /nfs/dbraw/zinc/03/19/61/1127031961.db2.gz LOFJUZKLXVBCHE-INIZCTEOSA-N 1 3 286.463 3.971 20 0 CHADHO [NH3+][C@H]1CCC[C@H](N[C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000629550433 1127042238 /nfs/dbraw/zinc/04/22/38/1127042238.db2.gz YKNNWWRISCUIDQ-DZKIICNBSA-N 1 3 278.827 3.577 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCNC2(CCC2)C1)c1cccc(Cl)c1 ZINC000666993920 1127138338 /nfs/dbraw/zinc/13/83/38/1127138338.db2.gz STUVPUQFPJDRMQ-CJNGLKHVSA-N 1 3 292.854 3.708 20 0 CHADHO CCCC[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCNC2(CCC2)C1 ZINC000666995598 1127139655 /nfs/dbraw/zinc/13/96/55/1127139655.db2.gz SVJCMIXPIDDSAD-BZUAXINKSA-N 1 3 264.457 3.610 20 0 CHADHO CCSc1ccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000165379504 1129215736 /nfs/dbraw/zinc/21/57/36/1129215736.db2.gz XLNWJCIKHAXCTA-IJEWVQPXSA-N 1 3 292.492 3.932 20 0 CHADHO CCSc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000165379504 1129215739 /nfs/dbraw/zinc/21/57/39/1129215739.db2.gz XLNWJCIKHAXCTA-IJEWVQPXSA-N 1 3 292.492 3.932 20 0 CHADHO C/C(=C/c1ccccc1)C[NH2+]CCCN1CCC(C)CC1 ZINC000588177205 1127179945 /nfs/dbraw/zinc/17/99/45/1127179945.db2.gz VBWYPCZPJSJTSA-SDXDJHTJSA-N 1 3 286.463 3.802 20 0 CHADHO Cc1ccnc([C@H](C)NCCCC[N@@H+]2CCCC[C@@H]2C)c1 ZINC000285472530 1127230526 /nfs/dbraw/zinc/23/05/26/1127230526.db2.gz AXWCMCKSJQGELK-IRXDYDNUSA-N 1 3 289.467 3.695 20 0 CHADHO Cc1ccnc([C@H](C)NCCCC[N@H+]2CCCC[C@@H]2C)c1 ZINC000285472530 1127230528 /nfs/dbraw/zinc/23/05/28/1127230528.db2.gz AXWCMCKSJQGELK-IRXDYDNUSA-N 1 3 289.467 3.695 20 0 CHADHO COc1ccc([C@@H](CCC(C)C)NCCC[NH+](C)C)cc1 ZINC000359378380 1127460587 /nfs/dbraw/zinc/46/05/87/1127460587.db2.gz LHZHVOGOMMQWEM-GOSISDBHSA-N 1 3 292.467 3.714 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H]2CCCc3sccc32)C1 ZINC000361062353 1127534964 /nfs/dbraw/zinc/53/49/64/1127534964.db2.gz XAQJGFMVIOQQDU-HOCLYGCPSA-N 1 3 292.492 3.836 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1ccc(F)cc1 ZINC000361967806 1127603300 /nfs/dbraw/zinc/60/33/00/1127603300.db2.gz MQSPIDFUJBYNIJ-ZACQAIPSSA-N 1 3 278.415 3.739 20 0 CHADHO C/C(=C/c1ccccc1)C[N@H+]1CCCC12CCN(C)CC2 ZINC000374321391 1127890653 /nfs/dbraw/zinc/89/06/53/1127890653.db2.gz ALCXJCYXZBCDPU-ICFOKQHNSA-N 1 3 284.447 3.650 20 0 CHADHO C/C(=C/c1ccccc1)C[N@@H+]1CCCC12CCN(C)CC2 ZINC000374321391 1127890659 /nfs/dbraw/zinc/89/06/59/1127890659.db2.gz ALCXJCYXZBCDPU-ICFOKQHNSA-N 1 3 284.447 3.650 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1NCc1csc2ccccc12 ZINC000540119430 1127961538 /nfs/dbraw/zinc/96/15/38/1127961538.db2.gz ZCRVNPWAKUADFG-IOASZLSFSA-N 1 3 288.460 3.720 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1NCc1csc2ccccc12 ZINC000540119430 1127961540 /nfs/dbraw/zinc/96/15/40/1127961540.db2.gz ZCRVNPWAKUADFG-IOASZLSFSA-N 1 3 288.460 3.720 20 0 CHADHO Cc1ccccc1[C@@H]([NH2+]CC[C@H]1CCCN1C)C(C)C ZINC000540360127 1127976628 /nfs/dbraw/zinc/97/66/28/1127976628.db2.gz PLTGFBXZLIFFGM-AEFFLSMTSA-N 1 3 274.452 3.766 20 0 CHADHO Cc1ccccc1[C@@H](NCC[C@H]1CCC[N@@H+]1C)C(C)C ZINC000540360127 1127976629 /nfs/dbraw/zinc/97/66/29/1127976629.db2.gz PLTGFBXZLIFFGM-AEFFLSMTSA-N 1 3 274.452 3.766 20 0 CHADHO Cc1ccccc1[C@@H](NCC[C@H]1CCC[N@H+]1C)C(C)C ZINC000540360127 1127976631 /nfs/dbraw/zinc/97/66/31/1127976631.db2.gz PLTGFBXZLIFFGM-AEFFLSMTSA-N 1 3 274.452 3.766 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](c2ccc(C)o2)C2CCCC2)C1 ZINC000540475300 1127980026 /nfs/dbraw/zinc/98/00/26/1127980026.db2.gz MLAVUTAKUITNTG-CRAIPNDOSA-N 1 3 290.451 3.751 20 0 CHADHO C[C@@H]([NH2+]CC1(CN(C)C)CCCC1)c1cccc(F)c1 ZINC000544899240 1127989155 /nfs/dbraw/zinc/98/91/55/1127989155.db2.gz RYEGDMWGTBXFGB-CQSZACIVSA-N 1 3 278.415 3.598 20 0 CHADHO CC[C@H](CN[C@H]1C[C@@H]([NH3+])c2ccccc21)CC(F)(F)F ZINC000402674557 1128022991 /nfs/dbraw/zinc/02/29/91/1128022991.db2.gz PFBOBAVVYCZLNT-GDLCADMTSA-N 1 3 286.341 3.699 20 0 CHADHO CCN1CCC[C@H](C[NH2+]C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000470198546 1128066127 /nfs/dbraw/zinc/06/61/27/1128066127.db2.gz SQHPSNJUUCTQJS-HUUCEWRRSA-N 1 3 294.870 3.765 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1cccc(Cl)c1 ZINC000470363500 1128070422 /nfs/dbraw/zinc/07/04/22/1128070422.db2.gz RKRVTNOWHRKFKQ-XOKHGSTOSA-N 1 3 294.870 3.906 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1cc2ccccc2[nH]1 ZINC000925217458 1128125602 /nfs/dbraw/zinc/12/56/02/1128125602.db2.gz PCNWRVAHGADYDW-NUEKZKHPSA-N 1 3 285.435 3.691 20 0 CHADHO CCC1([NH3+])CCN([C@@H](c2ccc(C)o2)C2CCC2)CC1 ZINC000925760051 1128140778 /nfs/dbraw/zinc/14/07/78/1128140778.db2.gz NSHYYQIXULBLLW-MRXNPFEDSA-N 1 3 276.424 3.633 20 0 CHADHO CCCc1ccc([C@@H](C)[NH2+]C[C@@H]2CNCCC2(F)F)cc1 ZINC000925781729 1128142341 /nfs/dbraw/zinc/14/23/41/1128142341.db2.gz ZXOUCLSEKKVGAO-CJNGLKHVSA-N 1 3 296.405 3.535 20 0 CHADHO CCC(CC)[N@@H+]1CC[C@H](N[C@H](C)Cc2cccc(F)c2)C1 ZINC001168470227 1128198182 /nfs/dbraw/zinc/19/81/82/1128198182.db2.gz XPAKDKGWOWSSEW-PBHICJAKSA-N 1 3 292.442 3.609 20 0 CHADHO CCC(CC)[N@H+]1CC[C@H](N[C@H](C)Cc2cccc(F)c2)C1 ZINC001168470227 1128198183 /nfs/dbraw/zinc/19/81/83/1128198183.db2.gz XPAKDKGWOWSSEW-PBHICJAKSA-N 1 3 292.442 3.609 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1cc2ccccc2[nH]1 ZINC000926753302 1128191977 /nfs/dbraw/zinc/19/19/77/1128191977.db2.gz MYQPSRVJJCXGMF-LSDHHAIUSA-N 1 3 285.435 3.550 20 0 CHADHO CCCC[C@H](CCC)[NH2+][C@H]1CCC[C@H](N(C)C)C1 ZINC000715232741 1128289998 /nfs/dbraw/zinc/28/99/98/1128289998.db2.gz ACJDYXHOCILAMT-JYJNAYRXSA-N 1 3 254.462 3.808 20 0 CHADHO CCCC[C@H](CC)[NH+]1CCC(N2CCCCC2)CC1 ZINC001257419621 1128352341 /nfs/dbraw/zinc/35/23/41/1128352341.db2.gz YRBPDDPWXRMNRM-INIZCTEOSA-N 1 3 266.473 3.906 20 0 CHADHO C[C@@H]1C[C@@H](N(C)Cc2ccc3ccccc3c2)CC[N@@H+]1C ZINC000123343038 1128411146 /nfs/dbraw/zinc/41/11/46/1128411146.db2.gz VDUVNDUAWYGGFI-BEFAXECRSA-N 1 3 282.431 3.754 20 0 CHADHO C[C@@H]1C[C@@H](N(C)Cc2ccc3ccccc3c2)CC[N@H+]1C ZINC000123343038 1128411148 /nfs/dbraw/zinc/41/11/48/1128411148.db2.gz VDUVNDUAWYGGFI-BEFAXECRSA-N 1 3 282.431 3.754 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@@H](C)c2ccc(C(C)(C)C)cc2)C1 ZINC000037644116 1128433990 /nfs/dbraw/zinc/43/39/90/1128433990.db2.gz RENKKHDIGMNJHX-HOTGVXAUSA-N 1 3 288.479 3.977 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@@H](C)c2ccc(C(C)(C)C)cc2)C1 ZINC000037644116 1128433992 /nfs/dbraw/zinc/43/39/92/1128433992.db2.gz RENKKHDIGMNJHX-HOTGVXAUSA-N 1 3 288.479 3.977 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2ccc(C(C)(C)C)cc2)C1 ZINC000037644116 1128433994 /nfs/dbraw/zinc/43/39/94/1128433994.db2.gz RENKKHDIGMNJHX-HOTGVXAUSA-N 1 3 288.479 3.977 20 0 CHADHO CCN1CC[C@@H](C[NH2+]C2CC(c3ccccc3Cl)C2)C1 ZINC000037644360 1128434209 /nfs/dbraw/zinc/43/42/09/1128434209.db2.gz ZLTGNCYMSDNESP-NFOMZHRRSA-N 1 3 292.854 3.517 20 0 CHADHO c1ccc([C@H]2CCCCN2CC[C@@H]2CCCC[NH2+]2)cc1 ZINC001205171645 1128434530 /nfs/dbraw/zinc/43/45/30/1128434530.db2.gz VDBQPVWKEUPYLU-ZWKOTPCHSA-N 1 3 272.436 3.746 20 0 CHADHO Cc1cc(C)c(C[NH2+]C2CCN(C(C)(C)C)CC2)cc1C ZINC000037786454 1128436272 /nfs/dbraw/zinc/43/62/72/1128436272.db2.gz VOFVOLNAEHLOGZ-UHFFFAOYSA-N 1 3 288.479 3.964 20 0 CHADHO Cc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)CC2 ZINC000125908932 1128456547 /nfs/dbraw/zinc/45/65/47/1128456547.db2.gz GAOZNJKUVURGDN-QFBILLFUSA-N 1 3 286.463 3.692 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000129435745 1128541035 /nfs/dbraw/zinc/54/10/35/1128541035.db2.gz IFNYFGRWWCXWPU-RLFYNMQTSA-N 1 3 274.452 3.943 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000129435745 1128541038 /nfs/dbraw/zinc/54/10/38/1128541038.db2.gz IFNYFGRWWCXWPU-RLFYNMQTSA-N 1 3 274.452 3.943 20 0 CHADHO C[C@H](CC[NH2+][C@@H]1CC[C@H]1C(C)(C)C)N1CCCCC1 ZINC000566382213 1128543342 /nfs/dbraw/zinc/54/33/42/1128543342.db2.gz IRZKOXBLXLTGIH-BZUAXINKSA-N 1 3 266.473 3.665 20 0 CHADHO CCN1CCC[C@@H](C[NH2+][C@H](C)c2cc3ccccc3o2)C1 ZINC000567718566 1128570287 /nfs/dbraw/zinc/57/02/87/1128570287.db2.gz GYAXLBMSWDYBOV-CABCVRRESA-N 1 3 286.419 3.815 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@@H](C)CCC2CCCC2)C1 ZINC000568564739 1128587954 /nfs/dbraw/zinc/58/79/54/1128587954.db2.gz ARDCUSGGMWZIKA-RDJZCZTQSA-N 1 3 266.473 3.665 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H]2CCCc3c(Cl)cccc32)C1 ZINC000568801504 1128592500 /nfs/dbraw/zinc/59/25/00/1128592500.db2.gz XQIQNLYGOLPVIP-CXAGYDPISA-N 1 3 292.854 3.649 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H]2CCCc3c(Cl)cccc32)C1 ZINC000568801504 1128592504 /nfs/dbraw/zinc/59/25/04/1128592504.db2.gz XQIQNLYGOLPVIP-CXAGYDPISA-N 1 3 292.854 3.649 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H]2CCCc3c(Cl)cccc32)C1 ZINC000568801504 1128592508 /nfs/dbraw/zinc/59/25/08/1128592508.db2.gz XQIQNLYGOLPVIP-CXAGYDPISA-N 1 3 292.854 3.649 20 0 CHADHO CC[C@@H](Cc1ccc(C)cc1)[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000569039321 1128596804 /nfs/dbraw/zinc/59/68/04/1128596804.db2.gz TXBAJEUKHBSXDX-OALUTQOASA-N 1 3 288.479 3.636 20 0 CHADHO C[C@H]1C[C@@H](N)CC[N@@H+]1CC1CCC(c2ccccc2)CC1 ZINC000569706868 1128607587 /nfs/dbraw/zinc/60/75/87/1128607587.db2.gz UPIRSMBHBUIMQS-GSHBMFQSSA-N 1 3 286.463 3.772 20 0 CHADHO C[C@H]1C[C@@H](N)CC[N@H+]1CC1CCC(c2ccccc2)CC1 ZINC000569706868 1128607589 /nfs/dbraw/zinc/60/75/89/1128607589.db2.gz UPIRSMBHBUIMQS-GSHBMFQSSA-N 1 3 286.463 3.772 20 0 CHADHO CCC1CC([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000570349296 1128622055 /nfs/dbraw/zinc/62/20/55/1128622055.db2.gz OROFZQWCQIEMNR-UHFFFAOYSA-N 1 3 264.457 3.562 20 0 CHADHO CC[N@H+](CCCN(C)C)Cc1cc2ccccc2s1 ZINC000571926396 1128640842 /nfs/dbraw/zinc/64/08/42/1128640842.db2.gz ZBXMNFHBYAEMSW-UHFFFAOYSA-N 1 3 276.449 3.675 20 0 CHADHO CC[N@@H+](CCCN(C)C)Cc1cc2ccccc2s1 ZINC000571926396 1128640845 /nfs/dbraw/zinc/64/08/45/1128640845.db2.gz ZBXMNFHBYAEMSW-UHFFFAOYSA-N 1 3 276.449 3.675 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](C[C@@H]2CC(C)=C[C@@H](C)C2)C1 ZINC000577945712 1128700485 /nfs/dbraw/zinc/70/04/85/1128700485.db2.gz VIUOUIDQQSPSOW-NJAFHUGGSA-N 1 3 278.484 3.643 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](C[C@@H]2CC(C)=C[C@@H](C)C2)C1 ZINC000577945712 1128700488 /nfs/dbraw/zinc/70/04/88/1128700488.db2.gz VIUOUIDQQSPSOW-NJAFHUGGSA-N 1 3 278.484 3.643 20 0 CHADHO CC(C)C[C@H](C)C[C@@H](C)[NH2+]CC[C@H]1CCCN1C ZINC001258056463 1128713006 /nfs/dbraw/zinc/71/30/06/1128713006.db2.gz PKZDFKPVILAWFX-ARFHVFGLSA-N 1 3 254.462 3.521 20 0 CHADHO [NH3+]CCC[C@H](N[C@H]1CCCc2cccnc21)c1ccccc1 ZINC000643543723 1117783082 /nfs/dbraw/zinc/78/30/82/1117783082.db2.gz YEVUBDAZXVNYKP-ROUUACIJSA-N 1 3 295.430 3.529 20 0 CHADHO c1ccc2c(c1)CCCC[C@@H]2N[C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643545717 1117791241 /nfs/dbraw/zinc/79/12/41/1117791241.db2.gz BFYWVZVJRUVWFS-WMZOPIPTSA-N 1 3 284.447 3.718 20 0 CHADHO c1ccc([C@@H]2CC[C@H]([NH2+][C@H]3CCNC4(CCC4)C3)C2)cc1 ZINC000643548870 1117800281 /nfs/dbraw/zinc/80/02/81/1117800281.db2.gz WKMFZAKCGPWTIR-SQNIBIBYSA-N 1 3 284.447 3.587 20 0 CHADHO CC[C@@H]1CCN1CC(C)(C)C[N@H+](C)Cc1ccccc1 ZINC000430198790 1117852980 /nfs/dbraw/zinc/85/29/80/1117852980.db2.gz PZFVVEAJEAONNW-QGZVFWFLSA-N 1 3 274.452 3.629 20 0 CHADHO CC[C@@H]1CCN1CC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC000430198790 1117852984 /nfs/dbraw/zinc/85/29/84/1117852984.db2.gz PZFVVEAJEAONNW-QGZVFWFLSA-N 1 3 274.452 3.629 20 0 CHADHO CC1=C[C@@H](C)[C@@H](C[NH+]2CCC(N(C)C3CC3)CC2)CC1 ZINC001208181397 1117860967 /nfs/dbraw/zinc/86/09/67/1117860967.db2.gz MBOPKHIVPSUOPX-HZPDHXFCSA-N 1 3 276.468 3.537 20 0 CHADHO Cc1ccc2oc(C[NH2+][C@@H]3CCN(C)C(C)(C)C3)cc2c1 ZINC000623569596 1117873730 /nfs/dbraw/zinc/87/37/30/1117873730.db2.gz NNOPYSXZTFRQQU-OAHLLOKOSA-N 1 3 286.419 3.704 20 0 CHADHO CCCCCC[NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000185725236 1117879020 /nfs/dbraw/zinc/87/90/20/1117879020.db2.gz UOFUTKNBNHUFID-JKSUJKDBSA-N 1 3 266.473 3.809 20 0 CHADHO CC[C@@H](C[NH2+]C[C@H]1CCCCN(C)C1)c1ccccc1 ZINC000623657492 1117884865 /nfs/dbraw/zinc/88/48/65/1117884865.db2.gz RPXGQSHOKDHOQI-SJORKVTESA-N 1 3 274.452 3.502 20 0 CHADHO CC[C@@H](C[NH2+]C[C@@H]1CCCCN(C)C1)c1ccccc1 ZINC000623657491 1117885761 /nfs/dbraw/zinc/88/57/61/1117885761.db2.gz RPXGQSHOKDHOQI-IRXDYDNUSA-N 1 3 274.452 3.502 20 0 CHADHO C[C@@H]([NH2+]C1CCN(CC2CCCC2)CC1)C1CCCC1 ZINC000178160155 1117888056 /nfs/dbraw/zinc/88/80/56/1117888056.db2.gz ASOFBTQCCVGPLS-OAHLLOKOSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H]1C[C@H](NC2(c3ccc(Cl)cc3)CCC2)CC[N@@H+]1C ZINC000180355540 1117928518 /nfs/dbraw/zinc/92/85/18/1117928518.db2.gz CYPSMFXOKLFXCK-CZUORRHYSA-N 1 3 292.854 3.792 20 0 CHADHO C[C@@H]1C[C@H](NC2(c3ccc(Cl)cc3)CCC2)CC[N@H+]1C ZINC000180355540 1117928520 /nfs/dbraw/zinc/92/85/20/1117928520.db2.gz CYPSMFXOKLFXCK-CZUORRHYSA-N 1 3 292.854 3.792 20 0 CHADHO CC[C@@H]([NH2+]C[C@H]1CCN(CC)C1)c1cc(C)ccc1C ZINC000623867011 1117947693 /nfs/dbraw/zinc/94/76/93/1117947693.db2.gz NGDSZVUDBBOWDQ-SJLPKXTDSA-N 1 3 274.452 3.686 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]C[C@@H](C)CCc2ccccc2)C1 ZINC000579388889 1128747616 /nfs/dbraw/zinc/74/76/16/1128747616.db2.gz OKHFYVKVBAVWPV-PKOBYXMFSA-N 1 3 288.479 3.575 20 0 CHADHO Cc1ccc([C@H](C)NC[C@H]2CCCC[N@H+](C)C2)c(C)c1 ZINC000624119548 1117984052 /nfs/dbraw/zinc/98/40/52/1117984052.db2.gz DXJMZTXMBHHISL-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc([C@H](C)NC[C@H]2CCCC[N@@H+](C)C2)c(C)c1 ZINC000624119548 1117984054 /nfs/dbraw/zinc/98/40/54/1117984054.db2.gz DXJMZTXMBHHISL-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCCN(C)C2)c(C)c1 ZINC000624119548 1117984057 /nfs/dbraw/zinc/98/40/57/1117984057.db2.gz DXJMZTXMBHHISL-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)cc1C ZINC000624120431 1117984614 /nfs/dbraw/zinc/98/46/14/1117984614.db2.gz YWRSRYUBFZLOQS-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO Cc1cc(C)cc([C@H](C)[NH2+]C[C@H]2CCCCN(C)C2)c1 ZINC000624120944 1117985184 /nfs/dbraw/zinc/98/51/84/1117985184.db2.gz KOOBHLYFMIJLOT-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCCN(C)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000624122972 1117985228 /nfs/dbraw/zinc/98/52/28/1117985228.db2.gz BZLRAUUJNHHDNX-NBMJBFSESA-N 1 3 286.463 3.500 20 0 CHADHO CC[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1cccc(F)c1 ZINC000624123742 1117987529 /nfs/dbraw/zinc/98/75/29/1117987529.db2.gz RVKLLIKBYSUEIZ-YOEHRIQHSA-N 1 3 278.415 3.598 20 0 CHADHO CC[C@@H](NCC[C@H]1CCC[N@@H+]1C)c1ccc(C)cc1 ZINC000181711766 1118004096 /nfs/dbraw/zinc/00/40/96/1118004096.db2.gz FQVKEFSNIPWRGK-IAGOWNOFSA-N 1 3 260.425 3.520 20 0 CHADHO CC[C@@H](NCC[C@H]1CCC[N@H+]1C)c1ccc(C)cc1 ZINC000181711766 1118004101 /nfs/dbraw/zinc/00/41/01/1118004101.db2.gz FQVKEFSNIPWRGK-IAGOWNOFSA-N 1 3 260.425 3.520 20 0 CHADHO CC[C@@H]([NH2+]CC[C@H]1CCCN1C)c1ccc(C)cc1 ZINC000181711766 1118004107 /nfs/dbraw/zinc/00/41/07/1118004107.db2.gz FQVKEFSNIPWRGK-IAGOWNOFSA-N 1 3 260.425 3.520 20 0 CHADHO CC[C@H](NCC[C@@H]1CCC[N@@H+]1C)c1ccc(C)cc1 ZINC000181711710 1118004244 /nfs/dbraw/zinc/00/42/44/1118004244.db2.gz FQVKEFSNIPWRGK-IRXDYDNUSA-N 1 3 260.425 3.520 20 0 CHADHO CC[C@H](NCC[C@@H]1CCC[N@H+]1C)c1ccc(C)cc1 ZINC000181711710 1118004249 /nfs/dbraw/zinc/00/42/49/1118004249.db2.gz FQVKEFSNIPWRGK-IRXDYDNUSA-N 1 3 260.425 3.520 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](CC(C)C)c2ccccc2)C1 ZINC000037643949 1118033662 /nfs/dbraw/zinc/03/36/62/1118033662.db2.gz FZZYYOODDSSKCO-AEFFLSMTSA-N 1 3 274.452 3.705 20 0 CHADHO C[C@H](c1cccs1)N(C)Cc1ccc2c(c1)C[NH2+]CC2 ZINC000211953488 1118055923 /nfs/dbraw/zinc/05/59/23/1118055923.db2.gz AUMCMHZCAPJKJL-CYBMUJFWSA-N 1 3 286.444 3.587 20 0 CHADHO C[C@H](C[NH2+][C@H](C)c1cccc2ccccc21)CN(C)C ZINC000380423379 1118069826 /nfs/dbraw/zinc/06/98/26/1118069826.db2.gz IJAJHGKORJTMSV-HUUCEWRRSA-N 1 3 270.420 3.688 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)CSC(C)(C)C)CN1CCCCC1 ZINC000765240682 1118140288 /nfs/dbraw/zinc/14/02/88/1118140288.db2.gz WCELPZFMKDVMJI-CABCVRRESA-N 1 3 286.529 3.618 20 0 CHADHO Cc1cc2c(c(C)c1)[C@@H](NC1CC[NH+](C(C)C)CC1)CC2 ZINC000655724998 1118194704 /nfs/dbraw/zinc/19/47/04/1118194704.db2.gz KBYQIDQXGAWDIP-SFHVURJKSA-N 1 3 286.463 3.753 20 0 CHADHO C[C@@H](CC[NH2+][C@@H]1CC(C)(C)C[C@H]1C)N1CCCCC1 ZINC001650935108 1118220060 /nfs/dbraw/zinc/22/00/60/1118220060.db2.gz AAABEPCGDZCIAR-OWCLPIDISA-N 1 3 266.473 3.665 20 0 CHADHO CSc1ccc([C@H](C)N[C@@H]2CCC[N@H+](C)CC2)cc1 ZINC000086817901 1118397171 /nfs/dbraw/zinc/39/71/71/1118397171.db2.gz KYGQOUSRAZUDMQ-DZGCQCFKSA-N 1 3 278.465 3.543 20 0 CHADHO CSc1ccc([C@H](C)N[C@@H]2CCC[N@@H+](C)CC2)cc1 ZINC000086817901 1118397177 /nfs/dbraw/zinc/39/71/77/1118397177.db2.gz KYGQOUSRAZUDMQ-DZGCQCFKSA-N 1 3 278.465 3.543 20 0 CHADHO CSc1ccc([C@H](C)N[C@H]2CCC[N@H+](C)CC2)cc1 ZINC000086817903 1118397804 /nfs/dbraw/zinc/39/78/04/1118397804.db2.gz KYGQOUSRAZUDMQ-ZFWWWQNUSA-N 1 3 278.465 3.543 20 0 CHADHO CSc1ccc([C@H](C)N[C@H]2CCC[N@@H+](C)CC2)cc1 ZINC000086817903 1118397808 /nfs/dbraw/zinc/39/78/08/1118397808.db2.gz KYGQOUSRAZUDMQ-ZFWWWQNUSA-N 1 3 278.465 3.543 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](NC2(c3cccc(Cl)c3)CCC2)C1 ZINC000656200200 1118439988 /nfs/dbraw/zinc/43/99/88/1118439988.db2.gz HBJMPKZWEZHCFW-CABCVRRESA-N 1 3 278.827 3.579 20 0 CHADHO Cc1ccccc1-c1cccc(CN2CC[C@@H]([NH3+])C[C@H]2C)c1 ZINC000580841147 1118513386 /nfs/dbraw/zinc/51/33/86/1118513386.db2.gz IGZNFPCKQNYEMK-VQIMIIECSA-N 1 3 294.442 3.974 20 0 CHADHO Cc1cccc([C@H](C)N2CCC[C@@H]([C@@H]3CCC[NH2+]3)C2)c1 ZINC000389354871 1118521504 /nfs/dbraw/zinc/52/15/04/1118521504.db2.gz TZYRBSXRNQDPBR-JQHSSLGASA-N 1 3 272.436 3.520 20 0 CHADHO NC[C@H]1CCCC[C@@H]1[NH2+]C1CCC(c2ccccc2)CC1 ZINC000089141229 1118529084 /nfs/dbraw/zinc/52/90/84/1118529084.db2.gz RKDZTDLYCRFSIM-CHPDAQJUSA-N 1 3 286.463 3.820 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H](C)CCC(C)(C)C)C1 ZINC000306041023 1118584143 /nfs/dbraw/zinc/58/41/43/1118584143.db2.gz NGRJOWRHOPDJFB-LSDHHAIUSA-N 1 3 254.462 3.521 20 0 CHADHO c1csc([C@@H](NC[C@@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC000132151858 1118826594 /nfs/dbraw/zinc/82/65/94/1118826594.db2.gz UTRKZQYJDQJNBS-CJNGLKHVSA-N 1 3 278.465 3.569 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](C)CCC(C)(C)C)C1 ZINC000582196462 1119031720 /nfs/dbraw/zinc/03/17/20/1119031720.db2.gz AGADJROJZMAWJA-CABCVRRESA-N 1 3 254.462 3.523 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](C)CCC(C)(C)C)C1 ZINC000582196464 1119032073 /nfs/dbraw/zinc/03/20/73/1119032073.db2.gz AGADJROJZMAWJA-HUUCEWRRSA-N 1 3 254.462 3.523 20 0 CHADHO COCC(C)(C)CCC[NH2+]C1CCN(CCC(C)C)CC1 ZINC000926425342 1119201801 /nfs/dbraw/zinc/20/18/01/1119201801.db2.gz ADVBVVZTMHRWKF-UHFFFAOYSA-N 1 3 298.515 3.539 20 0 CHADHO CC(C)(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1C[C@@H](N)c2ccccc21 ZINC000650741628 1119396176 /nfs/dbraw/zinc/39/61/76/1119396176.db2.gz IFDHTJDAFKAOLY-AEAUEXCSSA-N 1 3 258.409 3.546 20 0 CHADHO CC[C@@H](NCc1ccc(C[NH3+])cc1F)c1cccc(C)c1 ZINC000650756088 1119413339 /nfs/dbraw/zinc/41/33/39/1119413339.db2.gz UJSYDJKNSZXPHE-GOSISDBHSA-N 1 3 286.394 3.834 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@H]1CCCc2sccc21 ZINC000650757790 1119416174 /nfs/dbraw/zinc/41/61/74/1119416174.db2.gz AVGDFBGDFLXMMX-INIZCTEOSA-N 1 3 286.444 3.635 20 0 CHADHO CCOc1ccc([C@H](C)NCc2ccccc2C[NH2+]C)cc1 ZINC000650758511 1119416837 /nfs/dbraw/zinc/41/68/37/1119416837.db2.gz QZYUUPXADPMKDG-HNNXBMFYSA-N 1 3 298.430 3.656 20 0 CHADHO CC1(C[NH2+]C2CCN(C3CCCCC3)CC2)CCC1 ZINC000090220074 1119543393 /nfs/dbraw/zinc/54/33/93/1119543393.db2.gz OPZQQUOSXNIPQA-UHFFFAOYSA-N 1 3 264.457 3.563 20 0 CHADHO c1ccc([C@@H]2C[C@@H]2C[N@@H+]2CC[C@H](CN3CCCCC3)C2)cc1 ZINC000093683617 1119572030 /nfs/dbraw/zinc/57/20/30/1119572030.db2.gz SQTRIKJGZDPUTP-RLLQIKCJSA-N 1 3 298.474 3.598 20 0 CHADHO c1ccc([C@@H]2C[C@@H]2C[N@H+]2CC[C@H](CN3CCCCC3)C2)cc1 ZINC000093683617 1119572033 /nfs/dbraw/zinc/57/20/33/1119572033.db2.gz SQTRIKJGZDPUTP-RLLQIKCJSA-N 1 3 298.474 3.598 20 0 CHADHO c1ccc([C@@H]2C[C@@H]2CN2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC000093683617 1119572038 /nfs/dbraw/zinc/57/20/38/1119572038.db2.gz SQTRIKJGZDPUTP-RLLQIKCJSA-N 1 3 298.474 3.598 20 0 CHADHO C[C@H]1CCCC[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000132186002 1119654239 /nfs/dbraw/zinc/65/42/39/1119654239.db2.gz ZILPDEQVNLOXDW-YJBOKZPZSA-N 1 3 278.484 3.952 20 0 CHADHO CC(C)[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCN(C(C)C)C2)C1 ZINC000300316685 1119696603 /nfs/dbraw/zinc/69/66/03/1119696603.db2.gz VCHCKMSSNSFOMP-ZACQAIPSSA-N 1 3 266.473 3.521 20 0 CHADHO C[C@H](Cc1ccccc1)[NH+]1CCC(NCC2=CCCC2)CC1 ZINC000658290476 1119718523 /nfs/dbraw/zinc/71/85/23/1119718523.db2.gz AQBIKBYZWSZNEW-QGZVFWFLSA-N 1 3 298.474 3.782 20 0 CHADHO CCCCN1CCC([NH2+][C@H](C)c2csc(C)c2)CC1 ZINC000394481438 1119758551 /nfs/dbraw/zinc/75/85/51/1119758551.db2.gz LMADASBNOCXCCD-CQSZACIVSA-N 1 3 280.481 3.972 20 0 CHADHO Cc1ccc([C@@H](C)C[N@@H+]2CCC[C@H](N(C)C)CC2)cc1 ZINC000628252095 1119761880 /nfs/dbraw/zinc/76/18/80/1119761880.db2.gz HZWZWWGIEXCHBI-WMZOPIPTSA-N 1 3 274.452 3.515 20 0 CHADHO Cc1ccc([C@@H](C)C[N@H+]2CCC[C@H](N(C)C)CC2)cc1 ZINC000628252095 1119761883 /nfs/dbraw/zinc/76/18/83/1119761883.db2.gz HZWZWWGIEXCHBI-WMZOPIPTSA-N 1 3 274.452 3.515 20 0 CHADHO Cc1ccc([C@H](C)C[N@@H+]2CCC[C@H](N(C)C)CC2)cc1 ZINC000628252092 1119761985 /nfs/dbraw/zinc/76/19/85/1119761985.db2.gz HZWZWWGIEXCHBI-AEFFLSMTSA-N 1 3 274.452 3.515 20 0 CHADHO Cc1ccc([C@H](C)C[N@H+]2CCC[C@H](N(C)C)CC2)cc1 ZINC000628252092 1119761988 /nfs/dbraw/zinc/76/19/88/1119761988.db2.gz HZWZWWGIEXCHBI-AEFFLSMTSA-N 1 3 274.452 3.515 20 0 CHADHO CC[C@H]([NH2+]C1CCN(C2CCCCC2)CC1)[C@@H]1C[C@H]1C ZINC000414092832 1119894657 /nfs/dbraw/zinc/89/46/57/1119894657.db2.gz FJFUOKZEURGFMQ-OLMNPRSZSA-N 1 3 278.484 3.808 20 0 CHADHO CC[C@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)[C@@H]1CC1(C)C ZINC000414111331 1119901974 /nfs/dbraw/zinc/90/19/74/1119901974.db2.gz IYKZWWOTWWFCER-JYJNAYRXSA-N 1 3 266.473 3.521 20 0 CHADHO CC[C@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)[C@H]1CC1(C)C ZINC000414111332 1119902058 /nfs/dbraw/zinc/90/20/58/1119902058.db2.gz IYKZWWOTWWFCER-OAGGEKHMSA-N 1 3 266.473 3.521 20 0 CHADHO C[C@H](NCC[C@@H]1CCC[N@H+](C)C1)c1ccc(F)cc1Cl ZINC000414188349 1119931129 /nfs/dbraw/zinc/93/11/29/1119931129.db2.gz QOTKGYLAJVPRKP-STQMWFEESA-N 1 3 298.833 3.862 20 0 CHADHO C[C@H](NCC[C@@H]1CCC[N@@H+](C)C1)c1ccc(F)cc1Cl ZINC000414188349 1119931132 /nfs/dbraw/zinc/93/11/32/1119931132.db2.gz QOTKGYLAJVPRKP-STQMWFEESA-N 1 3 298.833 3.862 20 0 CHADHO CC(C)(C)N1CCC([NH2+]C[C@H]2CCC[C@H]2C2CC2)CC1 ZINC000414207163 1119939673 /nfs/dbraw/zinc/93/96/73/1119939673.db2.gz ZENXGGYHNWJDTQ-WBVHZDCISA-N 1 3 278.484 3.665 20 0 CHADHO C[C@@H](Cc1ccc(Cl)cc1)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000623657760 1120065630 /nfs/dbraw/zinc/06/56/30/1120065630.db2.gz YGQHFTCKSTXLPU-HOCLYGCPSA-N 1 3 294.870 3.593 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCc1ccc(SC(F)(F)F)cc1 ZINC000843127097 1120125147 /nfs/dbraw/zinc/12/51/47/1120125147.db2.gz CGLIKZSMJMDMLN-NXEZZACHSA-N 1 3 292.370 3.514 20 0 CHADHO Cc1nc(CNCCCCC[NH+]2CCCCC2)sc1C ZINC000892882030 1120154960 /nfs/dbraw/zinc/15/49/60/1120154960.db2.gz HIUYZOZYWCNSCL-UHFFFAOYSA-N 1 3 295.496 3.506 20 0 CHADHO CCCCN1CCC([NH2+][C@@H](C)c2ccc(Cl)nc2)CC1 ZINC000179115274 1120241185 /nfs/dbraw/zinc/24/11/85/1120241185.db2.gz PUNRVQBRSCGIBR-ZDUSSCGKSA-N 1 3 295.858 3.650 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@H]2CCCC23CCCCC3)C1 ZINC000313042173 1120381907 /nfs/dbraw/zinc/38/19/07/1120381907.db2.gz QNCIMRXVMPZCBT-IRXDYDNUSA-N 1 3 278.484 3.809 20 0 CHADHO CCC[C@H]([NH2+]C[C@@H]1CCN(C(C)C)C1)C1CCCC1 ZINC000313413513 1120396275 /nfs/dbraw/zinc/39/62/75/1120396275.db2.gz QQHKJHNNJSATNL-RDJZCZTQSA-N 1 3 266.473 3.665 20 0 CHADHO CCC(F)(F)C(C)(C)CN[C@H](Cc1ccccc1)[C@@H](C)[NH3+] ZINC000629531342 1128914125 /nfs/dbraw/zinc/91/41/25/1128914125.db2.gz HWPGDHITNWKFED-UKRRQHHQSA-N 1 3 298.421 3.606 20 0 CHADHO C[C@@H]([NH2+]CCCC1CCC1)[C@H]1CCCN(C2CCC2)C1 ZINC000660255339 1120467971 /nfs/dbraw/zinc/46/79/71/1120467971.db2.gz BIKHNUHUVDQPIM-WBVHZDCISA-N 1 3 278.484 3.809 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1)[C@H]1CCCN(C2CCC2)C1 ZINC000660256033 1120468606 /nfs/dbraw/zinc/46/86/06/1120468606.db2.gz IDOMVLYDEVXEOO-PNKHAZJDSA-N 1 3 290.495 3.665 20 0 CHADHO C[C@@H]([NH2+][C@@H]1C[C@@H]1c1ccccc1)[C@H]1CCCN(C2CCC2)C1 ZINC000660258100 1120469390 /nfs/dbraw/zinc/46/93/90/1120469390.db2.gz ZZTPDSFCTIYLAE-MCYKXBRJSA-N 1 3 298.474 3.785 20 0 CHADHO C[C@@H](N[C@@H]1C[C@@H]1c1ccccc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000660258100 1120469395 /nfs/dbraw/zinc/46/93/95/1120469395.db2.gz ZZTPDSFCTIYLAE-MCYKXBRJSA-N 1 3 298.474 3.785 20 0 CHADHO C[C@@H](N[C@@H]1C[C@@H]1c1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000660258100 1120469398 /nfs/dbraw/zinc/46/93/98/1120469398.db2.gz ZZTPDSFCTIYLAE-MCYKXBRJSA-N 1 3 298.474 3.785 20 0 CHADHO CC1CCN(CCC[NH2+][C@H]2CCc3ccc(F)cc32)CC1 ZINC000479418116 1120478422 /nfs/dbraw/zinc/47/84/22/1120478422.db2.gz DFFPEFDFLABVRD-SFHVURJKSA-N 1 3 290.426 3.525 20 0 CHADHO C[C@@H]([NH2+]CC(C)(C)CN(C)C)c1ccc(Cl)cc1 ZINC000019905756 1120490704 /nfs/dbraw/zinc/49/07/04/1120490704.db2.gz NEMFVDXMCFCSOC-GFCCVEGCSA-N 1 3 268.832 3.578 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]CC[C@H](C)N2CCCCC2)cc1 ZINC000543418538 1120518991 /nfs/dbraw/zinc/51/89/91/1120518991.db2.gz WRKFXTJPSUWBPI-DLBZAZTESA-N 1 3 274.452 3.910 20 0 CHADHO CS[C@H](C[NH2+]C1CCN(C2CCCC2)CC1)C(C)(C)C ZINC000543427414 1120520248 /nfs/dbraw/zinc/52/02/48/1120520248.db2.gz LLWZUPXRAKCXDS-MRXNPFEDSA-N 1 3 298.540 3.761 20 0 CHADHO C[C@@H](c1ccc2ccccc2c1)N1CC[C@H]([NH3+])[C@H](C)C1 ZINC000094339023 1120533777 /nfs/dbraw/zinc/53/37/77/1120533777.db2.gz DJNCNITVVJWAKN-GLJUWKHASA-N 1 3 268.404 3.570 20 0 CHADHO CC(C)C[C@H]1CCC[C@@H]([NH2+]CCCN(C)C(C)C)C1 ZINC000226334891 1120611763 /nfs/dbraw/zinc/61/17/63/1120611763.db2.gz PBGOESCDZTYCDD-IAGOWNOFSA-N 1 3 268.489 3.911 20 0 CHADHO C[C@@H]1CCCC[C@@H]1N1CCC([NH2+]C2(C3CCC3)CC2)CC1 ZINC000652272286 1120806439 /nfs/dbraw/zinc/80/64/39/1120806439.db2.gz GYYCOBDSHNCUJW-QAPCUYQASA-N 1 3 290.495 3.952 20 0 CHADHO CCCC[C@H](CC)C[N@@H+]1CCC[C@@]2(CCCNC2)C1 ZINC000228103272 1120806765 /nfs/dbraw/zinc/80/67/65/1120806765.db2.gz KAYYHDRGNXERAT-DLBZAZTESA-N 1 3 266.473 3.668 20 0 CHADHO CCCC[C@H](CC)C[N@H+]1CCC[C@@]2(CCCNC2)C1 ZINC000228103272 1120806768 /nfs/dbraw/zinc/80/67/68/1120806768.db2.gz KAYYHDRGNXERAT-DLBZAZTESA-N 1 3 266.473 3.668 20 0 CHADHO C[C@H](Cc1ccsc1)N[C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000251423377 1120882930 /nfs/dbraw/zinc/88/29/30/1120882930.db2.gz HMISIGYAFMMJFU-IIAWOOMASA-N 1 3 280.481 3.580 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@H]2CCC(C)(C)C[C@H]2C)C1 ZINC000252117370 1120883836 /nfs/dbraw/zinc/88/38/36/1120883836.db2.gz KJYLCIXIBPTWOC-OAGGEKHMSA-N 1 3 266.473 3.521 20 0 CHADHO c1ccc([C@@H]2C[C@H]2C[NH2+]C[C@H]2CCCN(CC3CC3)C2)cc1 ZINC000663344233 1120940669 /nfs/dbraw/zinc/94/06/69/1120940669.db2.gz PSHPKJLUBUDFAN-HOJAQTOUSA-N 1 3 298.474 3.502 20 0 CHADHO CC(C)C[C@H]([NH2+]C[C@@H](C)CN(C)C)c1ccccc1 ZINC000311870686 1120971884 /nfs/dbraw/zinc/97/18/84/1120971884.db2.gz WUTRMHJNBODUHT-WBVHZDCISA-N 1 3 262.441 3.561 20 0 CHADHO CC(C)C[C@H](NC[C@@H](C)C[NH+](C)C)c1ccccc1 ZINC000311870686 1120971887 /nfs/dbraw/zinc/97/18/87/1120971887.db2.gz WUTRMHJNBODUHT-WBVHZDCISA-N 1 3 262.441 3.561 20 0 CHADHO CC1(C)[C@H]([NH2+]C[C@H]2CCCN(CC3CC3)C2)[C@@H]2CCC[C@@H]21 ZINC000663467271 1120980838 /nfs/dbraw/zinc/98/08/38/1120980838.db2.gz ZTPINUKUFKJUEA-ZJPYXAASSA-N 1 3 290.495 3.523 20 0 CHADHO C[C@@H]1Cc2ccccc2[C@H]1NC[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663467307 1120982106 /nfs/dbraw/zinc/98/21/06/1120982106.db2.gz DTSHZNQNHRDYSR-SYNHAJSKSA-N 1 3 298.474 3.632 20 0 CHADHO C[C@@H]1Cc2ccccc2[C@H]1NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663467307 1120982108 /nfs/dbraw/zinc/98/21/08/1120982108.db2.gz DTSHZNQNHRDYSR-SYNHAJSKSA-N 1 3 298.474 3.632 20 0 CHADHO C[C@@H]1Cc2ccccc2[C@H]1[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663467307 1120982111 /nfs/dbraw/zinc/98/21/11/1120982111.db2.gz DTSHZNQNHRDYSR-SYNHAJSKSA-N 1 3 298.474 3.632 20 0 CHADHO C[C@@H](CC1CCCC1)[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663470222 1120984804 /nfs/dbraw/zinc/98/48/04/1120984804.db2.gz TTXJHVYICVPVLQ-MAUKXSAKSA-N 1 3 278.484 3.667 20 0 CHADHO CC(C)CC[C@@H]1CC[C@H]([NH2+][C@@H]2CCNC3(CCC3)C2)C1 ZINC000643548133 1121012427 /nfs/dbraw/zinc/01/24/27/1121012427.db2.gz MWTDKUGGECSQDJ-IXDOHACOSA-N 1 3 278.484 3.856 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](CC2CCC2)c2ccccc2)C1 ZINC000344035136 1121061786 /nfs/dbraw/zinc/06/17/86/1121061786.db2.gz PYQHZNZKUQRKSI-IEBWSBKVSA-N 1 3 286.463 3.849 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCc3ccc(F)cc32)C1 ZINC000344077337 1121074932 /nfs/dbraw/zinc/07/49/32/1121074932.db2.gz QHLNETKUEWSJDH-LZLYRXPVSA-N 1 3 290.426 3.666 20 0 CHADHO Cc1ccc(CC[NH2+]C2CCN(C(C)(C)C)CC2)cc1C ZINC000658178003 1121205835 /nfs/dbraw/zinc/20/58/35/1121205835.db2.gz UDBGBRBNWSJBAB-UHFFFAOYSA-N 1 3 288.479 3.698 20 0 CHADHO CC(C)C[C@H](C)[NH2+][C@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000512334060 1121272278 /nfs/dbraw/zinc/27/22/78/1121272278.db2.gz ZFEWIPSLUFAGKA-XHSDSOJGSA-N 1 3 266.473 3.664 20 0 CHADHO CC[NH+](CC)Cc1cccc(CNCc2ccc(O)cc2)c1 ZINC000236925863 1121434018 /nfs/dbraw/zinc/43/40/18/1121434018.db2.gz UQDYIASCABBAON-UHFFFAOYSA-N 1 3 298.430 3.524 20 0 CHADHO C[C@@H]1C[C@@H]1C[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000512642955 1121505120 /nfs/dbraw/zinc/50/51/20/1121505120.db2.gz UNTLLEZRMNUHEZ-YHUYVZNPSA-N 1 3 298.474 3.533 20 0 CHADHO C[C@@H]1C[C@@H]1C[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000512642952 1121505749 /nfs/dbraw/zinc/50/57/49/1121505749.db2.gz UNTLLEZRMNUHEZ-HKUYMTLNSA-N 1 3 298.474 3.533 20 0 CHADHO CCC1([NH+]2CCC2)CCN(CCCC2CCC2)CC1 ZINC001176244456 1121583977 /nfs/dbraw/zinc/58/39/77/1121583977.db2.gz YBRYQAJAMLXIIG-UHFFFAOYSA-N 1 3 264.457 3.517 20 0 CHADHO CCC1(N2CCC2)CC[NH+](CCCC2CCC2)CC1 ZINC001176244456 1121583978 /nfs/dbraw/zinc/58/39/78/1121583978.db2.gz YBRYQAJAMLXIIG-UHFFFAOYSA-N 1 3 264.457 3.517 20 0 CHADHO CCN(CCC[NH+](C)C)Cc1ccc2cccccc1-2 ZINC001237186416 1128998306 /nfs/dbraw/zinc/99/83/06/1128998306.db2.gz ZWKKFLRWODTIKZ-UHFFFAOYSA-N 1 3 270.420 3.565 20 0 CHADHO C[C@H](c1ccc(F)c(F)c1)N1CCC(CC[NH+](C)C)CC1 ZINC000052442313 1121686060 /nfs/dbraw/zinc/68/60/60/1121686060.db2.gz RNHYTCNJDYPXEW-CYBMUJFWSA-N 1 3 296.405 3.690 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N[C@@H](C)c1nc(C)sc1C ZINC000020089037 1121690980 /nfs/dbraw/zinc/69/09/80/1121690980.db2.gz WFNXXNMFJGEFFG-STQMWFEESA-N 1 3 297.512 3.921 20 0 CHADHO C1CCC2(C1)CCC([N@@H+]1CC[C@@]3(C1)CCCNC3)CC2 ZINC000709972776 1121692139 /nfs/dbraw/zinc/69/21/39/1121692139.db2.gz XTJVRUIUNJFPIN-SFHVURJKSA-N 1 3 276.468 3.565 20 0 CHADHO C1CCC2(C1)CCC([N@H+]1CC[C@@]3(C1)CCCNC3)CC2 ZINC000709972776 1121692144 /nfs/dbraw/zinc/69/21/44/1121692144.db2.gz XTJVRUIUNJFPIN-SFHVURJKSA-N 1 3 276.468 3.565 20 0 CHADHO C[NH2+]C[C@H]1CCCN(C2c3ccccc3-c3ccccc32)C1 ZINC000261948185 1129008804 /nfs/dbraw/zinc/00/88/04/1129008804.db2.gz MQKIGCAOMSNKEK-OAHLLOKOSA-N 1 3 292.426 3.688 20 0 CHADHO CC1(C)CNCC[C@@H]1[NH2+]CCCc1cccc2ccccc21 ZINC000420366053 1122002328 /nfs/dbraw/zinc/00/23/28/1122002328.db2.gz QUPUWRCTMVQMDW-IBGZPJMESA-N 1 3 296.458 3.750 20 0 CHADHO C[NH+](C)Cc1cccc(CNCc2cccc(C3CC3)c2)c1 ZINC000421324687 1122093076 /nfs/dbraw/zinc/09/30/76/1122093076.db2.gz CFEMXQZFQLITEC-UHFFFAOYSA-N 1 3 294.442 3.915 20 0 CHADHO CN1C[C@@H]2CC[C@@H]([NH2+]C3CCC(c4ccccc4)CC3)[C@@H]2C1 ZINC001184387481 1122272724 /nfs/dbraw/zinc/27/27/24/1122272724.db2.gz LFGSNAGWLOPSSI-KMMPOOCJSA-N 1 3 298.474 3.643 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CC[C@@H](C)[C@@H](CN)C1 ZINC001205295750 1122272812 /nfs/dbraw/zinc/27/28/12/1122272812.db2.gz BOAJNTJZHARPFS-UIZHIOIMSA-N 1 3 266.473 3.820 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CC[C@@H](C)[C@@H](CN)C1 ZINC001205295750 1122272815 /nfs/dbraw/zinc/27/28/15/1122272815.db2.gz BOAJNTJZHARPFS-UIZHIOIMSA-N 1 3 266.473 3.820 20 0 CHADHO CC[C@H](NC1CC[NH+](CC2CC2)CC1)c1ccc(C)cc1 ZINC000154458910 1122365791 /nfs/dbraw/zinc/36/57/91/1122365791.db2.gz GRUYKBORPPQQSX-IBGZPJMESA-N 1 3 286.463 3.910 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000436283361 1122531010 /nfs/dbraw/zinc/53/10/10/1122531010.db2.gz UUHBLQLMKRDMPY-QZTJIDSGSA-N 1 3 274.452 3.643 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+][C@H]2CCC(C)(C)C2)C1 ZINC000516038655 1122564238 /nfs/dbraw/zinc/56/42/38/1122564238.db2.gz WVUHWDXTIGIHKM-CVEARBPZSA-N 1 3 266.473 3.523 20 0 CHADHO CCSc1ccc([C@H](C)[NH2+]C[C@@H](C)CN(C)C)cc1 ZINC000425932503 1122662509 /nfs/dbraw/zinc/66/25/09/1122662509.db2.gz QKTOJQWQZNNOSR-KGLIPLIRSA-N 1 3 280.481 3.647 20 0 CHADHO CCCC(CCC)[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167965891 1122819197 /nfs/dbraw/zinc/81/91/97/1122819197.db2.gz PKSDUJZGWFDCCY-AYHJJNSGSA-N 1 3 278.484 3.950 20 0 CHADHO C(C1CC1)N1[C@@H]2CC[C@H]1CC([NH+]1C[C@@H]3CCCC[C@H]3C1)C2 ZINC001167982827 1122903842 /nfs/dbraw/zinc/90/38/42/1122903842.db2.gz BNZZYJZUVOUFKD-ZWKKMZQASA-N 1 3 288.479 3.514 20 0 CHADHO CCCC[N@H+](CCCCOC)C1CC(C)(C)NC(C)(C)C1 ZINC001196546243 1122926713 /nfs/dbraw/zinc/92/67/13/1122926713.db2.gz XWFNSSKMGIGLJM-UHFFFAOYSA-N 1 3 298.515 3.824 20 0 CHADHO CCCC[N@@H+](CCCCOC)C1CC(C)(C)NC(C)(C)C1 ZINC001196546243 1122926716 /nfs/dbraw/zinc/92/67/16/1122926716.db2.gz XWFNSSKMGIGLJM-UHFFFAOYSA-N 1 3 298.515 3.824 20 0 CHADHO CC[C@@H](C)[C@H](C)N1CCC(CC)([NH+]2CCCC2)CC1 ZINC001196728073 1122931407 /nfs/dbraw/zinc/93/14/07/1122931407.db2.gz UBUGRNAUCASTQS-CVEARBPZSA-N 1 3 266.473 3.761 20 0 CHADHO CC(C)CN(CC=C(Cl)Cl)CC1CC[NH+](C)CC1 ZINC001197193862 1122947693 /nfs/dbraw/zinc/94/76/93/1122947693.db2.gz GXLUQYPEIPPICK-UHFFFAOYSA-N 1 3 293.282 3.605 20 0 CHADHO CSc1ccccc1[C@H](C)[NH2+]CC[C@H]1CCCCN1C ZINC000440612447 1123022230 /nfs/dbraw/zinc/02/22/30/1123022230.db2.gz JJTSHHVANFVMOA-LSDHHAIUSA-N 1 3 292.492 3.934 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)c1ccoc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000309915814 1129094986 /nfs/dbraw/zinc/09/49/86/1129094986.db2.gz OCBDZMTUQPHYNQ-SOLBZPMBSA-N 1 3 298.430 3.841 20 0 CHADHO CC1(C)CCC([NH2+]C2CCN(C3CCCC3)CC2)CC1 ZINC001200922547 1123064385 /nfs/dbraw/zinc/06/43/85/1123064385.db2.gz NOLMISNQAMEIIH-UHFFFAOYSA-N 1 3 278.484 3.952 20 0 CHADHO C[C@H]1[C@@H](C[NH3+])CCCN1Cc1ccc(C(C)(C)C)cc1 ZINC001205903958 1123069592 /nfs/dbraw/zinc/06/95/92/1123069592.db2.gz SGGNQUYSLJOWJB-GOEBONIOSA-N 1 3 274.452 3.543 20 0 CHADHO CC[C@@H](c1ccccc1)N(C)CC[C@@H]1CCCC[N@@H+]1C ZINC000441342233 1123080587 /nfs/dbraw/zinc/08/05/87/1123080587.db2.gz YDGIDQNXYXRKFQ-ROUUACIJSA-N 1 3 274.452 3.944 20 0 CHADHO CC[C@@H](c1ccccc1)N(C)CC[C@@H]1CCCC[N@H+]1C ZINC000441342233 1123080592 /nfs/dbraw/zinc/08/05/92/1123080592.db2.gz YDGIDQNXYXRKFQ-ROUUACIJSA-N 1 3 274.452 3.944 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@@H](C)c1cc2ccccc2s1 ZINC000157180811 1123112385 /nfs/dbraw/zinc/11/23/85/1123112385.db2.gz ZQFWSNKSSNKYRQ-OLZOCXBDSA-N 1 3 276.449 3.892 20 0 CHADHO C[C@@H]1C[C@@H](C)CC[N@H+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167996144 1123116870 /nfs/dbraw/zinc/11/68/70/1123116870.db2.gz XLADJYAQEXSJSH-PJFKJEBRSA-N 1 3 276.468 3.512 20 0 CHADHO C[C@@H]1C[C@@H](C)CC[N@@H+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167996144 1123116872 /nfs/dbraw/zinc/11/68/72/1123116872.db2.gz XLADJYAQEXSJSH-PJFKJEBRSA-N 1 3 276.468 3.512 20 0 CHADHO CCCCC[N@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001201745406 1123145293 /nfs/dbraw/zinc/14/52/93/1123145293.db2.gz YVJTVIUTUVSQON-UHFFFAOYSA-N 1 3 266.473 3.906 20 0 CHADHO CCCCC[N@@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001201745406 1123145295 /nfs/dbraw/zinc/14/52/95/1123145295.db2.gz YVJTVIUTUVSQON-UHFFFAOYSA-N 1 3 266.473 3.906 20 0 CHADHO CCC[N@H+](CC(C)C)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001168002088 1123164458 /nfs/dbraw/zinc/16/44/58/1123164458.db2.gz DQDZRCBYBQIGQZ-JWTNVVGKSA-N 1 3 278.484 3.760 20 0 CHADHO CCC[N@@H+](CC(C)C)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001168002088 1123164459 /nfs/dbraw/zinc/16/44/59/1123164459.db2.gz DQDZRCBYBQIGQZ-JWTNVVGKSA-N 1 3 278.484 3.760 20 0 CHADHO CC(C)[C@@H](Cc1ccccc1)[NH2+]CCCN(C)C(C)C ZINC000427612010 1123195093 /nfs/dbraw/zinc/19/50/93/1123195093.db2.gz JZNNUQHSGIJKRB-GOSISDBHSA-N 1 3 276.468 3.574 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+]C2(CF)CC2)C[C@H](C)N1Cc1ccccc1 ZINC001168005185 1123197154 /nfs/dbraw/zinc/19/71/54/1123197154.db2.gz HQAYYVVXTGZVBX-SCAQPMJSSA-N 1 3 290.426 3.520 20 0 CHADHO COc1ccc([C@H](C)[NH2+]CC2(N)CCCC2)c2ccccc12 ZINC000665248789 1123259004 /nfs/dbraw/zinc/25/90/04/1123259004.db2.gz CMRGEWPUGVVHEM-AWEZNQCLSA-N 1 3 298.430 3.771 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CCc2ccc3[nH]ccc3c2)CC1 ZINC000442810827 1123341473 /nfs/dbraw/zinc/34/14/73/1123341473.db2.gz NXWHGFDQXISAPT-UHFFFAOYSA-N 1 3 299.462 3.563 20 0 CHADHO F[C@H]1CCC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000335383561 1123367098 /nfs/dbraw/zinc/36/70/98/1123367098.db2.gz AZVFNWDFPWNFGP-HOCLYGCPSA-N 1 3 282.447 3.654 20 0 CHADHO [NH3+][C@H]1C[C@H](NC2CCC(C(F)F)CC2)c2ccccc21 ZINC000335615195 1123385225 /nfs/dbraw/zinc/38/52/25/1123385225.db2.gz QPCSOXCBXUXPIC-HBGGEXNNSA-N 1 3 280.362 3.545 20 0 CHADHO C[C@@H]([NH2+]C1CCN([C@@H]2CCC[C@@H](C)C2)CC1)C1(C)CC1 ZINC000776883502 1123557118 /nfs/dbraw/zinc/55/71/18/1123557118.db2.gz ZLOMCXVEISFVEH-BFYDXBDKSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@H](N[C@@H]1CCCC[C@H]1C[NH3+])c1cccc(Cl)c1 ZINC000147865418 1123560809 /nfs/dbraw/zinc/56/08/09/1123560809.db2.gz MUZQWDAOIPKCBH-CORIIIEPSA-N 1 3 266.816 3.508 20 0 CHADHO CCCN1CC[C@@H](C[NH2+]C[C@@H](c2ccccc2)C(C)C)C1 ZINC000474633564 1123562233 /nfs/dbraw/zinc/56/22/33/1123562233.db2.gz ZEBDNFBZAIHXDV-PKOBYXMFSA-N 1 3 288.479 3.748 20 0 CHADHO CC[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCN(C(C)C)C2)CC1 ZINC000086906395 1123800279 /nfs/dbraw/zinc/80/02/79/1123800279.db2.gz IUKFUGFMWPVCHQ-IXDOHACOSA-N 1 3 266.473 3.665 20 0 CHADHO CC1(C)CCC(C)([NH2+]Cc2cc3c(s2)CCNC3)CC1 ZINC000864049657 1123914310 /nfs/dbraw/zinc/91/43/10/1123914310.db2.gz KFBQSEWOPRSEFO-UHFFFAOYSA-N 1 3 292.492 3.842 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN(c2ccnc3ccc(C)cc32)C1 ZINC000302181819 1123959556 /nfs/dbraw/zinc/95/95/56/1123959556.db2.gz ZXADJZLQXJOCMP-INIZCTEOSA-N 1 3 297.446 3.711 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN(c2ccnc3ccc(C)cc32)C1 ZINC000302181819 1123959560 /nfs/dbraw/zinc/95/95/60/1123959560.db2.gz ZXADJZLQXJOCMP-INIZCTEOSA-N 1 3 297.446 3.711 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H]2CCCc3ccc(C)cc32)C1 ZINC000339072792 1123971591 /nfs/dbraw/zinc/97/15/91/1123971591.db2.gz XTYRZKRWRULIIP-APWZRJJASA-N 1 3 286.463 3.694 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H]2CCCc3ccc(C)cc32)C1 ZINC000339072792 1123971593 /nfs/dbraw/zinc/97/15/93/1123971593.db2.gz XTYRZKRWRULIIP-APWZRJJASA-N 1 3 286.463 3.694 20 0 CHADHO CC(C)c1cnc(CNC2CCC(C)([NH+](C)C)CC2)s1 ZINC000865765236 1124012456 /nfs/dbraw/zinc/01/24/56/1124012456.db2.gz MCNSFSLOXPSIGU-UHFFFAOYSA-N 1 3 295.496 3.619 20 0 CHADHO C[C@H](CNC1CC([NH+]2CCCCC2)C1)c1ccc(F)cc1 ZINC000475566586 1124013833 /nfs/dbraw/zinc/01/38/33/1124013833.db2.gz TZKGNTWEUSODIX-RWBZWWBESA-N 1 3 290.426 3.536 20 0 CHADHO C[C@@H](CN(C)CCC[NH+]1CCCCC1)c1ccccc1 ZINC000444574281 1124042631 /nfs/dbraw/zinc/04/26/31/1124042631.db2.gz PIJLKFZXODYKGU-KRWDZBQOSA-N 1 3 274.452 3.598 20 0 CHADHO CS[C@H]1C[C@H](NC2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)C1 ZINC000866486436 1124071900 /nfs/dbraw/zinc/07/19/00/1124071900.db2.gz HMWSULICPMXXES-HJWJTTGWSA-N 1 3 296.524 3.513 20 0 CHADHO COc1c(C)cc(CNCc2ccc([C@@H](C)[NH3+])cc2)cc1C ZINC000841030238 1124108499 /nfs/dbraw/zinc/10/84/99/1124108499.db2.gz VEMMDRMGTVRIBI-OAHLLOKOSA-N 1 3 298.430 3.622 20 0 CHADHO CC1(C)C[NH2+]CC[C@@H](N[C@@H](c2ccccc2)C2CC2)C1 ZINC000635008480 1129170528 /nfs/dbraw/zinc/17/05/28/1129170528.db2.gz DXDQOXZEZPXDSU-SJORKVTESA-N 1 3 272.436 3.506 20 0 CHADHO C[C@H](CC[NH2+]C[C@@H](C)c1ccc(F)cc1)N1CCCCC1 ZINC000526116307 1124510910 /nfs/dbraw/zinc/51/09/10/1124510910.db2.gz VBOIHYLIIOKTHY-HZPDHXFCSA-N 1 3 292.442 3.783 20 0 CHADHO C[C@H]([NH2+]CCCC(F)(F)F)[C@@H]1CCCN(C2CCC2)C1 ZINC001119931340 1131266788 /nfs/dbraw/zinc/26/67/88/1131266788.db2.gz KXBHLRKSTPMPIX-QWHCGFSZSA-N 1 3 292.389 3.572 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H]2C[C@H](C)CC[C@@H]2C)C1 ZINC000449129621 1124652754 /nfs/dbraw/zinc/65/27/54/1124652754.db2.gz CYNZLLUTJXIFBG-LTIDMASMSA-N 1 3 266.473 3.521 20 0 CHADHO COC(C)(C)CNC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449177318 1124661822 /nfs/dbraw/zinc/66/18/22/1124661822.db2.gz SBLNKDRCNOKMGL-UHFFFAOYSA-N 1 3 298.515 3.680 20 0 CHADHO CC[C@@H]([NH2+]C1CCN(C2CCCC2)CC1)C1CCCC1 ZINC000449181904 1124666181 /nfs/dbraw/zinc/66/61/81/1124666181.db2.gz JAMVUMMAXYOAGF-GOSISDBHSA-N 1 3 278.484 3.952 20 0 CHADHO Cc1cc(F)ccc1[C@@H](C)NCc1cccc2c1CC[NH2+]C2 ZINC000873235548 1124753641 /nfs/dbraw/zinc/75/36/41/1124753641.db2.gz OGCCYPUQRASTCJ-CQSZACIVSA-N 1 3 298.405 3.631 20 0 CHADHO CC/C=C/CNC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449463654 1124758621 /nfs/dbraw/zinc/75/86/21/1124758621.db2.gz XDZZGIBDOGJRFA-IOMDMTNGSA-N 1 3 286.463 3.638 20 0 CHADHO CCCC[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC[C@H]2C)CCN1 ZINC001246092134 1131303630 /nfs/dbraw/zinc/30/36/30/1131303630.db2.gz CSCBWAXEZIOFAU-YYIAUSFCSA-N 1 3 266.473 3.713 20 0 CHADHO C[N@H+](CC1CC1)C[C@@H]1CCN(CC/C=C\c2ccccc2)C1 ZINC000450459107 1125036361 /nfs/dbraw/zinc/03/63/61/1125036361.db2.gz ZRGCURRDFKBSFK-JUIXODQZSA-N 1 3 298.474 3.754 20 0 CHADHO C[N@@H+](CC1CC1)C[C@@H]1CCN(CC/C=C\c2ccccc2)C1 ZINC000450459107 1125036368 /nfs/dbraw/zinc/03/63/68/1125036368.db2.gz ZRGCURRDFKBSFK-JUIXODQZSA-N 1 3 298.474 3.754 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CCNC23CCC3)cc1 ZINC000530176267 1125130611 /nfs/dbraw/zinc/13/06/11/1125130611.db2.gz AGEIQBYPQBAEKJ-OKZBNKHCSA-N 1 3 284.447 3.505 20 0 CHADHO CCc1ccc(CCN(C)[C@H]2CC[N@@H+](CC)[C@@H](C)C2)cc1 ZINC000530901508 1125185487 /nfs/dbraw/zinc/18/54/87/1125185487.db2.gz GNVRNFKHUQHJAC-LPHOPBHVSA-N 1 3 288.479 3.596 20 0 CHADHO CCc1ccc(CCN(C)[C@H]2CC[N@H+](CC)[C@@H](C)C2)cc1 ZINC000530901508 1125185491 /nfs/dbraw/zinc/18/54/91/1125185491.db2.gz GNVRNFKHUQHJAC-LPHOPBHVSA-N 1 3 288.479 3.596 20 0 CHADHO C[NH+](C)[C@@H]1CCC[C@H](N[C@H](CC2CC2)c2ccccc2)C1 ZINC000532248068 1125243728 /nfs/dbraw/zinc/24/37/28/1125243728.db2.gz DDUROECHIDYVCX-IPMKNSEASA-N 1 3 286.463 3.990 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@H](CC2CC2)c2ccccc2)C1 ZINC000532248068 1125243733 /nfs/dbraw/zinc/24/37/33/1125243733.db2.gz DDUROECHIDYVCX-IPMKNSEASA-N 1 3 286.463 3.990 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+]C2CCC3(CCCC3)CC2)C[C@H](C)N1 ZINC001246128805 1131343736 /nfs/dbraw/zinc/34/37/36/1131343736.db2.gz NLQACJHKMNMQSK-MIFYACCESA-N 1 3 264.457 3.608 20 0 CHADHO CC1(C)C[C@H]([NH2+]C2CCC3(CCCC3)CC2)CCN1 ZINC001246130164 1131344266 /nfs/dbraw/zinc/34/42/66/1131344266.db2.gz STBONFYBDJOJLY-OAHLLOKOSA-N 1 3 264.457 3.610 20 0 CHADHO Cc1ccc(C2CC([NH2+]C[C@@H]3CCN(C(C)C)C3)C2)cc1 ZINC000040622718 1125389285 /nfs/dbraw/zinc/38/92/85/1125389285.db2.gz KVRJMOIGGGVMSM-IVMQYODDSA-N 1 3 286.463 3.561 20 0 CHADHO CC[C@@H](NC[C@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1 ZINC000125783357 1125452876 /nfs/dbraw/zinc/45/28/76/1125452876.db2.gz NYISISIFOCYTHP-SJLPKXTDSA-N 1 3 274.452 3.848 20 0 CHADHO CC[C@@H](NC[C@H]1CCC[N@H+](C(C)C)C1)c1ccccc1 ZINC000125783357 1125452879 /nfs/dbraw/zinc/45/28/79/1125452879.db2.gz NYISISIFOCYTHP-SJLPKXTDSA-N 1 3 274.452 3.848 20 0 CHADHO CC[C@@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)c1ccccc1 ZINC000125783357 1125452882 /nfs/dbraw/zinc/45/28/82/1125452882.db2.gz NYISISIFOCYTHP-SJLPKXTDSA-N 1 3 274.452 3.848 20 0 CHADHO CC[C@H](NC[C@@H]1CCC[NH2+]C1)c1cccc2ccccc21 ZINC000643500810 1129442778 /nfs/dbraw/zinc/44/27/78/1129442778.db2.gz UYQOEEDIHDDYLS-BEFAXECRSA-N 1 3 282.431 3.880 20 0 CHADHO CC(C)C[C@@H]1CCC[C@H]([NH2+][C@H]2CCNC3(CCC3)C2)C1 ZINC000643548673 1129445843 /nfs/dbraw/zinc/44/58/43/1129445843.db2.gz SXQKHRHQLYSTLQ-ULQDDVLXSA-N 1 3 278.484 3.856 20 0 CHADHO Fc1ccc(CN(C[C@H]2CC[NH2+]C2)C2CCCCC2)cc1 ZINC000647872760 1129586083 /nfs/dbraw/zinc/58/60/83/1129586083.db2.gz PBARJDYHCSDCNO-INIZCTEOSA-N 1 3 290.426 3.570 20 0 CHADHO C[C@@H]1CC[C@@H](N[C@H](C[NH3+])c2ccc3ccccc3c2)C1 ZINC000253259716 1129624554 /nfs/dbraw/zinc/62/45/54/1129624554.db2.gz HOPZDBDYOOZPMX-FSPWUOQZSA-N 1 3 268.404 3.618 20 0 CHADHO C(C1CCCCC1)N1CCC([NH2+][C@H]2CC[C@H]2C2CC2)CC1 ZINC000798005396 1129674498 /nfs/dbraw/zinc/67/44/98/1129674498.db2.gz VBFKGAIWVUZJMU-OALUTQOASA-N 1 3 290.495 3.809 20 0 CHADHO CC[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc(C)c1 ZINC001169099544 1129696278 /nfs/dbraw/zinc/69/62/78/1129696278.db2.gz ATPOCOQFUXODEK-ZJPYXAASSA-N 1 3 272.436 3.661 20 0 CHADHO CC[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(C)c1 ZINC001169099544 1129696279 /nfs/dbraw/zinc/69/62/79/1129696279.db2.gz ATPOCOQFUXODEK-ZJPYXAASSA-N 1 3 272.436 3.661 20 0 CHADHO CCC[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccs1 ZINC001169096062 1129696298 /nfs/dbraw/zinc/69/62/98/1129696298.db2.gz UJPJZIHJCKCRPY-APIJFGDWSA-N 1 3 278.465 3.804 20 0 CHADHO CCC[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccs1 ZINC001169096062 1129696301 /nfs/dbraw/zinc/69/63/01/1129696301.db2.gz UJPJZIHJCKCRPY-APIJFGDWSA-N 1 3 278.465 3.804 20 0 CHADHO CCC[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC001169098876 1129696523 /nfs/dbraw/zinc/69/65/23/1129696523.db2.gz LXDGQVIVYCZIGQ-ZJPYXAASSA-N 1 3 272.436 3.743 20 0 CHADHO CCC[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC001169098876 1129696525 /nfs/dbraw/zinc/69/65/25/1129696525.db2.gz LXDGQVIVYCZIGQ-ZJPYXAASSA-N 1 3 272.436 3.743 20 0 CHADHO Cc1cccc(C2(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4C)CCC2)c1 ZINC001169109564 1129703238 /nfs/dbraw/zinc/70/32/38/1129703238.db2.gz DIUNDQKSFJQFAD-NNZMDNLPSA-N 1 3 284.447 3.589 20 0 CHADHO Cc1cccc(C2(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CCC2)c1 ZINC001169109564 1129703240 /nfs/dbraw/zinc/70/32/40/1129703240.db2.gz DIUNDQKSFJQFAD-NNZMDNLPSA-N 1 3 284.447 3.589 20 0 CHADHO CC[NH+]1CCC(N[C@@H](c2cccc(F)c2)C(C)C)CC1 ZINC001169229885 1129710644 /nfs/dbraw/zinc/71/06/44/1129710644.db2.gz JJDZZEDTAPEQOS-QGZVFWFLSA-N 1 3 278.415 3.597 20 0 CHADHO CC[C@H](NCc1ccccc1C[NH2+]C)c1cccc(F)c1 ZINC000650757412 1129722053 /nfs/dbraw/zinc/72/20/53/1129722053.db2.gz WTGHLPBCHHWAOL-SFHVURJKSA-N 1 3 286.394 3.786 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@H]1CCCc2cc(F)ccc21 ZINC000650756659 1129722269 /nfs/dbraw/zinc/72/22/69/1129722269.db2.gz HEWWORKVVPVGML-IBGZPJMESA-N 1 3 298.405 3.712 20 0 CHADHO C[C@@H](C[NH2+][C@H]1CCCC(C)(C)CC1)CN1CCCC1 ZINC000086908808 1129829597 /nfs/dbraw/zinc/82/95/97/1129829597.db2.gz AMTYPBMZGRBXBC-HOTGVXAUSA-N 1 3 266.473 3.667 20 0 CHADHO C(C1CCCCC1)N1CCC([NH2+][C@H]2CCC23CCC3)CC1 ZINC000800475859 1129876479 /nfs/dbraw/zinc/87/64/79/1129876479.db2.gz ZVFIWFABAISZGX-SFHVURJKSA-N 1 3 290.495 3.953 20 0 CHADHO [NH3+][C@@H]1C[C@H](NCC[C@H]2CCC(F)(F)C2)c2ccccc21 ZINC000902458879 1130013835 /nfs/dbraw/zinc/01/38/35/1130013835.db2.gz ZCUUDISSIJABGQ-DFBGVHRSSA-N 1 3 280.362 3.546 20 0 CHADHO c1ccc([C@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC2)C2CC2)cc1 ZINC000903062452 1130107622 /nfs/dbraw/zinc/10/76/22/1130107622.db2.gz RVMUQNGBTZUXRH-QZNYNHHHSA-N 1 3 296.458 3.885 20 0 CHADHO c1ccc([C@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)C2CC2)cc1 ZINC000903062452 1130107624 /nfs/dbraw/zinc/10/76/24/1130107624.db2.gz RVMUQNGBTZUXRH-QZNYNHHHSA-N 1 3 296.458 3.885 20 0 CHADHO C[C@H](CSC(C)(C)C)[NH2+]CC(C)(C)CN1CCCC1 ZINC000790751983 1130328606 /nfs/dbraw/zinc/32/86/06/1130328606.db2.gz ZGNQFAXMWUPLKR-CQSZACIVSA-N 1 3 286.529 3.618 20 0 CHADHO CCN(CCC[NH+](C)C)[C@H](C)Cc1ccccc1Cl ZINC001170290354 1130480811 /nfs/dbraw/zinc/48/08/11/1130480811.db2.gz AJXMIEZIUHHGDT-CQSZACIVSA-N 1 3 282.859 3.545 20 0 CHADHO Fc1cc(C=C2CC[NH2+]CC2)ccc1CN1CCCCC1 ZINC001240879649 1130500967 /nfs/dbraw/zinc/50/09/67/1130500967.db2.gz VXNUGVPPWIYZAL-UHFFFAOYSA-N 1 3 288.410 3.578 20 0 CHADHO CC1=C[C@H](C)[C@@H](C[N@@H+](C(C)C)[C@H]2CCCNCC2)CC1 ZINC001206580568 1130538183 /nfs/dbraw/zinc/53/81/83/1130538183.db2.gz FCJDFVADZOZECY-KSZLIROESA-N 1 3 278.484 3.831 20 0 CHADHO CC1=C[C@H](C)[C@@H](C[N@H+](C(C)C)[C@H]2CCCNCC2)CC1 ZINC001206580568 1130538190 /nfs/dbraw/zinc/53/81/90/1130538190.db2.gz FCJDFVADZOZECY-KSZLIROESA-N 1 3 278.484 3.831 20 0 CHADHO Cc1ccc(C[N@@H+](C)C2CCN(C(C)(C)C)CC2)cc1C ZINC001256576989 1130676662 /nfs/dbraw/zinc/67/66/62/1130676662.db2.gz XDDOIIYPXFOUDG-UHFFFAOYSA-N 1 3 288.479 3.998 20 0 CHADHO Cc1ccc(C[N@H+](C)C2CCN(C(C)(C)C)CC2)cc1C ZINC001256576989 1130676668 /nfs/dbraw/zinc/67/66/68/1130676668.db2.gz XDDOIIYPXFOUDG-UHFFFAOYSA-N 1 3 288.479 3.998 20 0 CHADHO CC/C=C\CCCCCCN1CC[C@@]2(CC[NH2+]C2)C1 ZINC001235033243 1130702741 /nfs/dbraw/zinc/70/27/41/1130702741.db2.gz WLTSYVDPUVYROZ-CWIOURORSA-N 1 3 264.457 3.589 20 0 CHADHO c1c2ccccc2sc1C[N@@H+]1CCCC12CCNCC2 ZINC001235140260 1130714237 /nfs/dbraw/zinc/71/42/37/1130714237.db2.gz HZMZNZWAKQEBOA-UHFFFAOYSA-N 1 3 286.444 3.619 20 0 CHADHO c1c2ccccc2sc1C[N@H+]1CCCC12CCNCC2 ZINC001235140260 1130714243 /nfs/dbraw/zinc/71/42/43/1130714243.db2.gz HZMZNZWAKQEBOA-UHFFFAOYSA-N 1 3 286.444 3.619 20 0 CHADHO c1c2ccccc2sc1CN1CCCC12CC[NH2+]CC2 ZINC001235140260 1130714247 /nfs/dbraw/zinc/71/42/47/1130714247.db2.gz HZMZNZWAKQEBOA-UHFFFAOYSA-N 1 3 286.444 3.619 20 0 CHADHO CC1=C[C@H](C)[C@@H](C[N@@H+]2CCCC[C@]23CCCNC3)CC1 ZINC001235171270 1130717460 /nfs/dbraw/zinc/71/74/60/1130717460.db2.gz IHKLNJCNUVTFIK-RCCFBDPRSA-N 1 3 276.468 3.587 20 0 CHADHO CC1=C[C@H](C)[C@@H](C[N@H+]2CCCC[C@]23CCCNC3)CC1 ZINC001235171270 1130717465 /nfs/dbraw/zinc/71/74/65/1130717465.db2.gz IHKLNJCNUVTFIK-RCCFBDPRSA-N 1 3 276.468 3.587 20 0 CHADHO C[C@H](N[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccc[nH]1 ZINC000781515909 1130723149 /nfs/dbraw/zinc/72/31/49/1130723149.db2.gz AVYONHUWZKGVCK-RYRKJORJSA-N 1 3 297.446 3.718 20 0 CHADHO C[C@H](N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccc[nH]1 ZINC000781515909 1130723154 /nfs/dbraw/zinc/72/31/54/1130723154.db2.gz AVYONHUWZKGVCK-RYRKJORJSA-N 1 3 297.446 3.718 20 0 CHADHO CC/C=C\CCCCC[N@@H+]1CC[C@@]2(C1)CNCC[C@@H]2F ZINC001235402326 1130739045 /nfs/dbraw/zinc/73/90/45/1130739045.db2.gz IWNDTQHDWOOAOA-QCDWVSHVSA-N 1 3 282.447 3.537 20 0 CHADHO CC/C=C\CCCCC[N@H+]1CC[C@@]2(C1)CNCC[C@@H]2F ZINC001235402326 1130739047 /nfs/dbraw/zinc/73/90/47/1130739047.db2.gz IWNDTQHDWOOAOA-QCDWVSHVSA-N 1 3 282.447 3.537 20 0 CHADHO CC[C@H](N)C[NH+]1CCC(c2ccc3ccccc3c2)CC1 ZINC001235714122 1130771489 /nfs/dbraw/zinc/77/14/89/1130771489.db2.gz HEOYEFOGQDFXPA-IBGZPJMESA-N 1 3 282.431 3.757 20 0 CHADHO c1ccc2cc(C3CCN(C[C@H]4CC[NH2+]C4)CC3)ccc2c1 ZINC001235715249 1130771925 /nfs/dbraw/zinc/77/19/25/1130771925.db2.gz OHYSBPKEMRMUDV-INIZCTEOSA-N 1 3 294.442 3.629 20 0 CHADHO Cc1cc(F)cc(Cl)c1CN(C)CCC1CC[NH2+]CC1 ZINC001235718290 1130773446 /nfs/dbraw/zinc/77/34/46/1130773446.db2.gz WGZDVPPBTYESRC-UHFFFAOYSA-N 1 3 298.833 3.609 20 0 CHADHO Cc1ccccc1-c1ccccc1CN1CCC(C)([NH3+])CC1 ZINC001235748074 1130777528 /nfs/dbraw/zinc/77/75/28/1130777528.db2.gz IAIWDZVOOZAIKW-UHFFFAOYSA-N 1 3 294.442 3.975 20 0 CHADHO Cc1c(C)c(C)c(C[N@H+]2C[C@@H](N)CC[C@@H]2C)c(C)c1C ZINC001235905057 1130802496 /nfs/dbraw/zinc/80/24/96/1130802496.db2.gz KPAJBFSCOJQOMK-GTNSWQLSSA-N 1 3 274.452 3.540 20 0 CHADHO Cc1c(C)c(C)c(C[N@@H+]2C[C@@H](N)CC[C@@H]2C)c(C)c1C ZINC001235905057 1130802500 /nfs/dbraw/zinc/80/25/00/1130802500.db2.gz KPAJBFSCOJQOMK-GTNSWQLSSA-N 1 3 274.452 3.540 20 0 CHADHO CCCCCCc1ccc(CN2CC(CC[NH3+])C2)s1 ZINC001235919051 1130805234 /nfs/dbraw/zinc/80/52/34/1130805234.db2.gz QHSDCCACKAJFJJ-UHFFFAOYSA-N 1 3 280.481 3.652 20 0 CHADHO [NH3+]CC[C@@H]1CCCN1Cc1cc(-c2ccsc2)cs1 ZINC001235925366 1130806079 /nfs/dbraw/zinc/80/60/79/1130806079.db2.gz JMKFHPRKRPDRRY-AWEZNQCLSA-N 1 3 292.473 3.790 20 0 CHADHO [NH3+]CC[C@@H]1CCCN1Cc1ccc(Oc2ccccc2)cc1 ZINC001235925156 1130806811 /nfs/dbraw/zinc/80/68/11/1130806811.db2.gz JEXMTIOJCQJYNN-KRWDZBQOSA-N 1 3 296.414 3.792 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@H+](C)C[C@@H]1CCCNC1 ZINC001235951961 1130815557 /nfs/dbraw/zinc/81/55/57/1130815557.db2.gz WKLDPZZMYCQVHB-IAGOWNOFSA-N 1 3 266.473 3.690 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@@H+](C)C[C@@H]1CCCNC1 ZINC001235951961 1130815564 /nfs/dbraw/zinc/81/55/64/1130815564.db2.gz WKLDPZZMYCQVHB-IAGOWNOFSA-N 1 3 266.473 3.690 20 0 CHADHO Cc1ccc2ccccc2c1CN(C)C[C@H]1CCC[NH2+]C1 ZINC001235956777 1130817254 /nfs/dbraw/zinc/81/72/54/1130817254.db2.gz HZCRMVMUDQJLBK-INIZCTEOSA-N 1 3 282.431 3.580 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@H+]1C[C@H](N)C[C@H](C)C1 ZINC001236049861 1130838336 /nfs/dbraw/zinc/83/83/36/1130838336.db2.gz QZIOGPIHUXMEIT-MAUKXSAKSA-N 1 3 294.442 3.831 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@@H+]1C[C@H](N)C[C@H](C)C1 ZINC001236049861 1130838341 /nfs/dbraw/zinc/83/83/41/1130838341.db2.gz QZIOGPIHUXMEIT-MAUKXSAKSA-N 1 3 294.442 3.831 20 0 CHADHO CC[NH+](CC)CCCC1CCN(Cc2ccoc2)CC1 ZINC000783595542 1130841461 /nfs/dbraw/zinc/84/14/61/1130841461.db2.gz RZZSUZOYFVCVPY-UHFFFAOYSA-N 1 3 278.440 3.614 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@@H+]1CCCN[C@@H](C)C1 ZINC001236094393 1130858760 /nfs/dbraw/zinc/85/87/60/1130858760.db2.gz DESZLSTXJVPULP-KRWDZBQOSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@H+]1CCCN[C@@H](C)C1 ZINC001236094393 1130858767 /nfs/dbraw/zinc/85/87/67/1130858767.db2.gz DESZLSTXJVPULP-KRWDZBQOSA-N 1 3 294.442 3.846 20 0 CHADHO CSc1ccccc1[C@H]1CCCN1C[C@@H]1CCC[NH2+]C1 ZINC001236109667 1130865696 /nfs/dbraw/zinc/86/56/96/1130865696.db2.gz VNVLVDJVOLGJEG-GDBMZVCRSA-N 1 3 290.476 3.545 20 0 CHADHO c1[nH]c2ccccc2c1[C@@H]1CCCN1CC[C@H]1CCCC[NH2+]1 ZINC001236191016 1130884138 /nfs/dbraw/zinc/88/41/38/1130884138.db2.gz JBZAAJUQJQQYRF-BEFAXECRSA-N 1 3 297.446 3.837 20 0 CHADHO C[N@H+](Cc1cccc2sccc21)[C@@H]1CCCC[C@@H]1N ZINC001236214547 1130889962 /nfs/dbraw/zinc/88/99/62/1130889962.db2.gz FSPQWLVATJOUPH-LSDHHAIUSA-N 1 3 274.433 3.603 20 0 CHADHO C[N@@H+](Cc1cccc2sccc21)[C@@H]1CCCC[C@@H]1N ZINC001236214547 1130889970 /nfs/dbraw/zinc/88/99/70/1130889970.db2.gz FSPQWLVATJOUPH-LSDHHAIUSA-N 1 3 274.433 3.603 20 0 CHADHO C[NH2+]C1CCC(N(C)Cc2cc(F)cc(C)c2Cl)CC1 ZINC001236216807 1130893960 /nfs/dbraw/zinc/89/39/60/1130893960.db2.gz VEZHFQGMTBMRQT-UHFFFAOYSA-N 1 3 298.833 3.750 20 0 CHADHO C1=CC[C@@H](C[N@@H+](C[C@H]2CCCNC2)C2CCCC2)CC1 ZINC001236371704 1130922199 /nfs/dbraw/zinc/92/21/99/1130922199.db2.gz MEZFNZYRMSBYRR-SJORKVTESA-N 1 3 276.468 3.587 20 0 CHADHO C1=CC[C@@H](C[N@H+](C[C@H]2CCCNC2)C2CCCC2)CC1 ZINC001236371704 1130922201 /nfs/dbraw/zinc/92/22/01/1130922201.db2.gz MEZFNZYRMSBYRR-SJORKVTESA-N 1 3 276.468 3.587 20 0 CHADHO Cc1ccc([C@H](C)CCN(C[C@H]2CCC[NH2+]C2)C2CC2)o1 ZINC001236584505 1130980361 /nfs/dbraw/zinc/98/03/61/1130980361.db2.gz FUJBVSVJJZDDLJ-ZBFHGGJFSA-N 1 3 290.451 3.546 20 0 CHADHO C[C@@H](CC[N@H+](C[C@H]1CCCNC1)C1CC1)CC(C)(C)C ZINC001236584549 1130980883 /nfs/dbraw/zinc/98/08/83/1130980883.db2.gz LURVNLRTXIGCKM-HOTGVXAUSA-N 1 3 280.500 3.913 20 0 CHADHO C[C@@H](CC[N@@H+](C[C@H]1CCCNC1)C1CC1)CC(C)(C)C ZINC001236584549 1130980885 /nfs/dbraw/zinc/98/08/85/1130980885.db2.gz LURVNLRTXIGCKM-HOTGVXAUSA-N 1 3 280.500 3.913 20 0 CHADHO c1cc(C2CC2)ccc1C[N@H+](C1CCC1)C1CCNCC1 ZINC001236636303 1130987573 /nfs/dbraw/zinc/98/75/73/1130987573.db2.gz CIBQDMCLWSJYPR-UHFFFAOYSA-N 1 3 284.447 3.671 20 0 CHADHO c1cc(C2CC2)ccc1C[N@@H+](C1CCC1)C1CCNCC1 ZINC001236636303 1130987576 /nfs/dbraw/zinc/98/75/76/1130987576.db2.gz CIBQDMCLWSJYPR-UHFFFAOYSA-N 1 3 284.447 3.671 20 0 CHADHO c1cc(C2CC2)ccc1CN(C1CCC1)C1CC[NH2+]CC1 ZINC001236636303 1130987580 /nfs/dbraw/zinc/98/75/80/1130987580.db2.gz CIBQDMCLWSJYPR-UHFFFAOYSA-N 1 3 284.447 3.671 20 0 CHADHO CCCN(Cc1c[nH]c2c1cccc2CC)C[C@@H]1CC[NH2+]C1 ZINC001236835572 1131019974 /nfs/dbraw/zinc/01/99/74/1131019974.db2.gz NJIGDPYXUQKKSV-OAHLLOKOSA-N 1 3 299.462 3.552 20 0 CHADHO CCCCc1ccc(CN(CCC)C[C@H]2CC[NH2+]C2)cc1 ZINC001236842661 1131020978 /nfs/dbraw/zinc/02/09/78/1131020978.db2.gz GYPCEQJASZRPRL-IBGZPJMESA-N 1 3 288.479 3.851 20 0 CHADHO CC[NH+]1C[C@H]2CN(Cc3ccc(C)c4ccccc34)C[C@@H]2C1 ZINC001138017988 1131026286 /nfs/dbraw/zinc/02/62/86/1131026286.db2.gz DOVZLDMIWBYUPH-ROUUACIJSA-N 1 3 294.442 3.532 20 0 CHADHO Cc1c2ccccc2sc1CN1CCC[C@@](C)(C[NH3+])C1 ZINC001237057448 1131043247 /nfs/dbraw/zinc/04/32/47/1131043247.db2.gz MWVQNJYBUAGUMT-KRWDZBQOSA-N 1 3 288.460 3.771 20 0 CHADHO CC(C)(C)c1ccc(CN2CCC[C@](C)(C[NH3+])C2)cc1 ZINC001237058531 1131044100 /nfs/dbraw/zinc/04/41/00/1131044100.db2.gz QHFJZBYZTCQDQT-GOSISDBHSA-N 1 3 274.452 3.545 20 0 CHADHO CCN(CCC[NH+](C)C)Cc1cccc2c(F)cccc12 ZINC001237520036 1131108843 /nfs/dbraw/zinc/10/88/43/1131108843.db2.gz YSVPOFVIRVEPLC-UHFFFAOYSA-N 1 3 288.410 3.753 20 0 CHADHO CCCCCC[C@H](C)[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000817893190 1131186792 /nfs/dbraw/zinc/18/67/92/1131186792.db2.gz QMIAJQPGTGWKTR-KBPBESRZSA-N 1 3 277.456 3.858 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(CN)nc2C)s1 ZINC000817895385 1131186945 /nfs/dbraw/zinc/18/69/45/1131186945.db2.gz URFDJEUUCOYGMR-DGCLKSJQSA-N 1 3 289.448 3.630 20 0 CHADHO CCN1CCC[C@H](C[NH2+][C@@H](C)c2nccc3ccccc32)C1 ZINC001117671530 1131191985 /nfs/dbraw/zinc/19/19/85/1131191985.db2.gz KASHBMGUUJBNRT-JKSUJKDBSA-N 1 3 297.446 3.617 20 0 CHADHO CCN(CC)CCC[N@H+](C)[C@@H]1CCC[C@H]1c1ccccc1 ZINC001171018912 1131429157 /nfs/dbraw/zinc/42/91/57/1131429157.db2.gz UAGUMUGEEBVRBW-RBUKOAKNSA-N 1 3 288.479 3.986 20 0 CHADHO CCN(CC)CCC[N@@H+](C)[C@@H]1CCC[C@H]1c1ccccc1 ZINC001171018912 1131429160 /nfs/dbraw/zinc/42/91/60/1131429160.db2.gz UAGUMUGEEBVRBW-RBUKOAKNSA-N 1 3 288.479 3.986 20 0 CHADHO CC[NH+](CC)CCCN(C)[C@@H]1CCC[C@H]1c1ccccc1 ZINC001171018912 1131429162 /nfs/dbraw/zinc/42/91/62/1131429162.db2.gz UAGUMUGEEBVRBW-RBUKOAKNSA-N 1 3 288.479 3.986 20 0 CHADHO CC[C@H]([NH3+])CCN[C@@H](C)Cc1ccc(Cl)cc1Cl ZINC001246307712 1131457044 /nfs/dbraw/zinc/45/70/44/1131457044.db2.gz NXOKGETZQQVMMQ-GWCFXTLKSA-N 1 3 289.250 3.641 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246332887 1131472389 /nfs/dbraw/zinc/47/23/89/1131472389.db2.gz NQMJIPPDWVARKE-SMLCLMEVSA-N 1 3 266.473 3.854 20 0 CHADHO CC(C)C[C@@H](C)C[C@H](C)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246332455 1131473224 /nfs/dbraw/zinc/47/32/24/1131473224.db2.gz MEVQNONUQLUQKQ-ALYAQQCSSA-N 1 3 266.473 3.710 20 0 CHADHO CC[C@H]1C[C@H]([N@@H+](Cc2ccccc2)CC(C)C)CCN1 ZINC001246556210 1131618013 /nfs/dbraw/zinc/61/80/13/1131618013.db2.gz BNDKSEIWRLINSC-ZWKOTPCHSA-N 1 3 274.452 3.675 20 0 CHADHO CC[C@H]1C[C@H]([N@H+](Cc2ccccc2)CC(C)C)CCN1 ZINC001246556210 1131618014 /nfs/dbraw/zinc/61/80/14/1131618014.db2.gz BNDKSEIWRLINSC-ZWKOTPCHSA-N 1 3 274.452 3.675 20 0 CHADHO CCCCCC[C@H](CC)[N@@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001246559388 1131621072 /nfs/dbraw/zinc/62/10/72/1131621072.db2.gz ANKJRNYOQYSXHF-JYJNAYRXSA-N 1 3 254.462 3.795 20 0 CHADHO CCCCCC[C@H](CC)[N@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001246559388 1131621074 /nfs/dbraw/zinc/62/10/74/1131621074.db2.gz ANKJRNYOQYSXHF-JYJNAYRXSA-N 1 3 254.462 3.795 20 0 CHADHO CCN(CCC[NH+](C)C)Cc1ccc(F)c2ccccc12 ZINC001139893126 1131648623 /nfs/dbraw/zinc/64/86/23/1131648623.db2.gz GQRYYIQKPDCWNC-UHFFFAOYSA-N 1 3 288.410 3.753 20 0 CHADHO CCC(C)(C)C1CCC([N@@H+]2CCC23CCNCC3)CC1 ZINC001246641517 1131765450 /nfs/dbraw/zinc/76/54/50/1131765450.db2.gz IXPKTLIJDMPSFJ-UHFFFAOYSA-N 1 3 278.484 3.809 20 0 CHADHO CCC(C)(C)C1CCC([N@H+]2CCC23CCNCC3)CC1 ZINC001246641517 1131765454 /nfs/dbraw/zinc/76/54/54/1131765454.db2.gz IXPKTLIJDMPSFJ-UHFFFAOYSA-N 1 3 278.484 3.809 20 0 CHADHO CCC(C)(C)C1CCC([N@@H+]2CCC[C@H]2CCN)CC1 ZINC001246835026 1131787254 /nfs/dbraw/zinc/78/72/54/1131787254.db2.gz XWMNOZLBBWCVDO-PCKAHOCUSA-N 1 3 266.473 3.795 20 0 CHADHO CCC(C)(C)C1CCC([N@H+]2CCC[C@H]2CCN)CC1 ZINC001246835026 1131787260 /nfs/dbraw/zinc/78/72/60/1131787260.db2.gz XWMNOZLBBWCVDO-PCKAHOCUSA-N 1 3 266.473 3.795 20 0 CHADHO CCC[N@H+](CCCN(C)C)Cc1cc(F)cc(Cl)c1 ZINC001140543303 1131787423 /nfs/dbraw/zinc/78/74/23/1131787423.db2.gz ZUIPPIWZNXETIR-UHFFFAOYSA-N 1 3 286.822 3.643 20 0 CHADHO CCC[N@@H+](CCCN(C)C)Cc1cc(F)cc(Cl)c1 ZINC001140543303 1131787426 /nfs/dbraw/zinc/78/74/26/1131787426.db2.gz ZUIPPIWZNXETIR-UHFFFAOYSA-N 1 3 286.822 3.643 20 0 CHADHO Cc1ccc([C@H]2CCCN2CC[C@H]2CCC[N@H+]2C)s1 ZINC000348155880 1131891817 /nfs/dbraw/zinc/89/18/17/1131891817.db2.gz CKIIULIKIXGELX-HUUCEWRRSA-N 1 3 278.465 3.678 20 0 CHADHO Cc1ccc([C@H]2CCCN2CC[C@H]2CCC[N@@H+]2C)s1 ZINC000348155880 1131891826 /nfs/dbraw/zinc/89/18/26/1131891826.db2.gz CKIIULIKIXGELX-HUUCEWRRSA-N 1 3 278.465 3.678 20 0 CHADHO C1=CCC(C[NH2+][C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)C1 ZINC000716619025 1132029070 /nfs/dbraw/zinc/02/90/70/1132029070.db2.gz AMXSIIPVCYCDNB-ZCNNSNEGSA-N 1 3 296.458 3.595 20 0 CHADHO CN(CCc1ccccc1)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171628563 1132060790 /nfs/dbraw/zinc/06/07/90/1132060790.db2.gz BFBDGHGEZJWPCI-UHFFFAOYSA-N 1 3 288.479 3.812 20 0 CHADHO CN1C(C)(C)CC([N@H+](C)CCc2ccccc2)CC1(C)C ZINC001171628563 1132060801 /nfs/dbraw/zinc/06/08/01/1132060801.db2.gz BFBDGHGEZJWPCI-UHFFFAOYSA-N 1 3 288.479 3.812 20 0 CHADHO CN1C(C)(C)CC([N@@H+](C)CCc2ccccc2)CC1(C)C ZINC001171628563 1132060803 /nfs/dbraw/zinc/06/08/03/1132060803.db2.gz BFBDGHGEZJWPCI-UHFFFAOYSA-N 1 3 288.479 3.812 20 0 CHADHO CN1C(C)(C)CC([NH2+]CCc2cccs2)CC1(C)C ZINC001171616450 1132065697 /nfs/dbraw/zinc/06/56/97/1132065697.db2.gz CCHOLHQZUJZYDX-UHFFFAOYSA-N 1 3 280.481 3.532 20 0 CHADHO CN1C(C)(C)CC([NH2+]C2CC3(CCC3)C2)CC1(C)C ZINC001171627495 1132068082 /nfs/dbraw/zinc/06/80/82/1132068082.db2.gz SIFNCOHYHFFODP-UHFFFAOYSA-N 1 3 264.457 3.560 20 0 CHADHO C[C@@H]1C[C@H](C)C[N@H+](C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001171639969 1132080230 /nfs/dbraw/zinc/08/02/30/1132080230.db2.gz XEZFYPRLIUSCMQ-OKILXGFUSA-N 1 3 266.473 3.616 20 0 CHADHO C[C@@H]1C[C@H](C)C[N@@H+](C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001171639969 1132080236 /nfs/dbraw/zinc/08/02/36/1132080236.db2.gz XEZFYPRLIUSCMQ-OKILXGFUSA-N 1 3 266.473 3.616 20 0 CHADHO C[C@H]1CCN1[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171975469 1132118168 /nfs/dbraw/zinc/11/81/68/1132118168.db2.gz DCWFEUXTHBFQFX-DOTOQJQBSA-N 1 3 272.436 3.524 20 0 CHADHO C[C@H]1CCN1[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171975469 1132118174 /nfs/dbraw/zinc/11/81/74/1132118174.db2.gz DCWFEUXTHBFQFX-DOTOQJQBSA-N 1 3 272.436 3.524 20 0 CHADHO CC[C@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001172101628 1132122651 /nfs/dbraw/zinc/12/26/51/1132122651.db2.gz GNWNGZXDABSILH-MHORFTMASA-N 1 3 290.426 3.882 20 0 CHADHO CC[C@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001172101628 1132122655 /nfs/dbraw/zinc/12/26/55/1132122655.db2.gz GNWNGZXDABSILH-MHORFTMASA-N 1 3 290.426 3.882 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1Cc3ccc(Cl)cc3C1)C2 ZINC001172127698 1132127033 /nfs/dbraw/zinc/12/70/33/1132127033.db2.gz KXHQFJOQBZREAT-BJWYYQGGSA-N 1 3 290.838 3.671 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1Cc3ccc(Cl)cc3C1)C2 ZINC001172127698 1132127037 /nfs/dbraw/zinc/12/70/37/1132127037.db2.gz KXHQFJOQBZREAT-BJWYYQGGSA-N 1 3 290.838 3.671 20 0 CHADHO Cc1ccc(CN(C)[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1C ZINC001172122370 1132136247 /nfs/dbraw/zinc/13/62/47/1132136247.db2.gz AGEQZCVMKLEAOW-REPLKXPHSA-N 1 3 286.463 3.751 20 0 CHADHO Cc1ccc(CN(C)[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1C ZINC001172122370 1132136249 /nfs/dbraw/zinc/13/62/49/1132136249.db2.gz AGEQZCVMKLEAOW-REPLKXPHSA-N 1 3 286.463 3.751 20 0 CHADHO CCCCN(C)CCC[NH2+][C@@H]1CC[C@H](C)[C@@H](C)C1 ZINC001172358138 1132187319 /nfs/dbraw/zinc/18/73/19/1132187319.db2.gz DONTXSRYFVDXGB-HRCADAONSA-N 1 3 254.462 3.523 20 0 CHADHO C[C@@H]1CC[C@@H]([NH2+]C2CCN(C3CCCC3)CC2)C[C@H]1C ZINC001172370795 1132195738 /nfs/dbraw/zinc/19/57/38/1132195738.db2.gz XRKAFZNONNYEJZ-BFYDXBDKSA-N 1 3 278.484 3.808 20 0 CHADHO CCOCC[C@H](C)[N@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001172430500 1132206011 /nfs/dbraw/zinc/20/60/11/1132206011.db2.gz GVWRFFMUJDNTAQ-INIZCTEOSA-N 1 3 296.499 3.530 20 0 CHADHO CCOCC[C@H](C)[N@@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001172430500 1132206019 /nfs/dbraw/zinc/20/60/19/1132206019.db2.gz GVWRFFMUJDNTAQ-INIZCTEOSA-N 1 3 296.499 3.530 20 0 CHADHO CC1(C)CC([NH+]2C(C)(C)CC(N)CC2(C)C)CC(C)(C)O1 ZINC001172649655 1132288143 /nfs/dbraw/zinc/28/81/43/1132288143.db2.gz SDTZTRFCKPZFIC-UHFFFAOYSA-N 1 3 296.499 3.703 20 0 CHADHO CCCCc1ccc(C[NH+]2CCC3(CN(C)C3)CC2)cc1 ZINC001231781442 1132358833 /nfs/dbraw/zinc/35/88/33/1132358833.db2.gz HVRNMFLWOIZYHA-UHFFFAOYSA-N 1 3 286.463 3.557 20 0 CHADHO CCCOC1CCC([NH2+]CCCN2CCCC[C@H]2C)CC1 ZINC001173092568 1132384756 /nfs/dbraw/zinc/38/47/56/1132384756.db2.gz VEDRAZPLUIRQLF-WWDZGPRUSA-N 1 3 296.499 3.578 20 0 CHADHO CC(C)C[NH+](Cc1cc2cnccc2[nH]1)CC(C)C ZINC001232012344 1132410425 /nfs/dbraw/zinc/41/04/25/1132410425.db2.gz ZGRJLVPHRPKRNU-UHFFFAOYSA-N 1 3 259.397 3.677 20 0 CHADHO C[N@H+](Cc1cc2cnccc2[nH]1)C12CC3CC(CC(C3)C1)C2 ZINC001232015017 1132410882 /nfs/dbraw/zinc/41/08/82/1132410882.db2.gz ZSVGKEAIVGCMAZ-UHFFFAOYSA-N 1 3 295.430 3.964 20 0 CHADHO C[N@@H+](Cc1cc2cnccc2[nH]1)C12CC3CC(CC(C3)C1)C2 ZINC001232015017 1132410886 /nfs/dbraw/zinc/41/08/86/1132410886.db2.gz ZSVGKEAIVGCMAZ-UHFFFAOYSA-N 1 3 295.430 3.964 20 0 CHADHO CC[C@@H]1CC[C@H]([NH+]2C(C)(C)CC(N)CC2(C)C)C1 ZINC001173261857 1132429465 /nfs/dbraw/zinc/42/94/65/1132429465.db2.gz DGINHYKBYWIJSO-OCCSQVGLSA-N 1 3 252.446 3.545 20 0 CHADHO CC[C@@H]1CC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC001173271667 1132436059 /nfs/dbraw/zinc/43/60/59/1132436059.db2.gz HONVTVWWCXQGQW-WBVHZDCISA-N 1 3 278.484 3.952 20 0 CHADHO CC[C@@H]1CC[C@@H]([NH2+]C2CCN(C[C@H]3CC=CCC3)CC2)C1 ZINC001173275164 1132438820 /nfs/dbraw/zinc/43/88/20/1132438820.db2.gz LMQAUAPBHWUGLH-ZIFCJYIRSA-N 1 3 290.495 3.975 20 0 CHADHO CC1(N)CC[NH+]([C@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173341876 1132468889 /nfs/dbraw/zinc/46/88/89/1132468889.db2.gz SACPLBHJXIMBAI-HNNXBMFYSA-N 1 3 264.457 3.693 20 0 CHADHO Cc1cc(Nc2ccccc2C[NH+](C)C)c2ccccc2n1 ZINC001173927848 1132641500 /nfs/dbraw/zinc/64/15/00/1132641500.db2.gz PXWWZYVIPJPDMP-UHFFFAOYSA-N 1 3 291.398 3.770 20 0 CHADHO CC(C)(C)c1cc(Nc2ccc3c(c2)C[NH2+]CC3)ccn1 ZINC001159615448 1132876396 /nfs/dbraw/zinc/87/63/96/1132876396.db2.gz NMKHFHCGORLDFW-UHFFFAOYSA-N 1 3 281.403 3.768 20 0 CHADHO CC(C)(C)c1cc(Nc2ccc3c(c2)CC[NH2+]CC3)ccn1 ZINC001159681184 1132890974 /nfs/dbraw/zinc/89/09/74/1132890974.db2.gz HWWLTHRTXMCTGM-UHFFFAOYSA-N 1 3 295.430 3.811 20 0 CHADHO Cc1ccccc1CN1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001203706799 1133356305 /nfs/dbraw/zinc/35/63/05/1133356305.db2.gz PRKYYPPTVJTULR-LJQANCHMSA-N 1 3 286.463 3.835 20 0 CHADHO Cc1ccccc1C[N@@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001203706799 1133356312 /nfs/dbraw/zinc/35/63/12/1133356312.db2.gz PRKYYPPTVJTULR-LJQANCHMSA-N 1 3 286.463 3.835 20 0 CHADHO Cc1ccccc1C[N@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001203706799 1133356317 /nfs/dbraw/zinc/35/63/17/1133356317.db2.gz PRKYYPPTVJTULR-LJQANCHMSA-N 1 3 286.463 3.835 20 0 CHADHO Cc1ccsc1C[N@@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001204020880 1133399427 /nfs/dbraw/zinc/39/94/27/1133399427.db2.gz LRSRQTBMDHEFLK-MRXNPFEDSA-N 1 3 292.492 3.897 20 0 CHADHO Cc1ccsc1C[N@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001204020880 1133399430 /nfs/dbraw/zinc/39/94/30/1133399430.db2.gz LRSRQTBMDHEFLK-MRXNPFEDSA-N 1 3 292.492 3.897 20 0 CHADHO C[C@@H](Cc1ccc(C(C)(C)C)cc1)C[N@@H+]1CCC[C@H](N)C1 ZINC001204877507 1133494897 /nfs/dbraw/zinc/49/48/97/1133494897.db2.gz KYAREGYWBFMHIB-YJBOKZPZSA-N 1 3 288.479 3.586 20 0 CHADHO C[C@@H](Cc1ccc(C(C)(C)C)cc1)C[N@H+]1CCC[C@H](N)C1 ZINC001204877507 1133494899 /nfs/dbraw/zinc/49/48/99/1133494899.db2.gz KYAREGYWBFMHIB-YJBOKZPZSA-N 1 3 288.479 3.586 20 0 CHADHO CC(C)=CCCC1=CC[C@H](CN2CC[C@@H]([NH3+])[C@H]2C)CC1 ZINC001205171141 1133541005 /nfs/dbraw/zinc/54/10/05/1133541005.db2.gz LEKJLOMJEGASQT-BPQIPLTHSA-N 1 3 276.468 3.881 20 0 CHADHO C[C@]1([NH3+])CCCN(Cc2cc3ccccc3s2)CC1 ZINC001205266326 1133552486 /nfs/dbraw/zinc/55/24/86/1133552486.db2.gz TUHWCDWDXSVGSI-INIZCTEOSA-N 1 3 274.433 3.605 20 0 CHADHO C[C@]1([NH3+])CCCN(Cc2csc3ccccc23)CC1 ZINC001205274390 1133553334 /nfs/dbraw/zinc/55/33/34/1133553334.db2.gz WXOVJRDQIIPMFZ-INIZCTEOSA-N 1 3 274.433 3.605 20 0 CHADHO CCC(C)(C)c1ccc(CN2CC[C@H](C)[C@@H](C[NH3+])C2)cc1 ZINC001205305520 1133558395 /nfs/dbraw/zinc/55/83/95/1133558395.db2.gz SBEDSRHZOUYPBR-RDJZCZTQSA-N 1 3 288.479 3.791 20 0 CHADHO Cc1cccc(-c2ccc(C[N@H+]3CCNCC[C@H]3C)cc2)c1 ZINC001205331137 1133562279 /nfs/dbraw/zinc/56/22/79/1133562279.db2.gz FLFKSWQVHHQHGX-QGZVFWFLSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1cccc(-c2ccc(C[N@@H+]3CCNCC[C@H]3C)cc2)c1 ZINC001205331137 1133562281 /nfs/dbraw/zinc/56/22/81/1133562281.db2.gz FLFKSWQVHHQHGX-QGZVFWFLSA-N 1 3 294.442 3.846 20 0 CHADHO C[C@H]1CCNCC[N@@H+]1Cc1ccc(-c2cccs2)cc1 ZINC001205331023 1133562648 /nfs/dbraw/zinc/56/26/48/1133562648.db2.gz CPYVFRIIWCNKBJ-AWEZNQCLSA-N 1 3 286.444 3.599 20 0 CHADHO C[C@H]1CCNCC[N@H+]1Cc1ccc(-c2cccs2)cc1 ZINC001205331023 1133562653 /nfs/dbraw/zinc/56/26/53/1133562653.db2.gz CPYVFRIIWCNKBJ-AWEZNQCLSA-N 1 3 286.444 3.599 20 0 CHADHO C[C@@H](CC[NH2+]CCc1cccc(Cl)c1)N1CCCCC1 ZINC001205391399 1133573390 /nfs/dbraw/zinc/57/33/90/1133573390.db2.gz NDHXERVAJLNMCH-HNNXBMFYSA-N 1 3 294.870 3.737 20 0 CHADHO C[C@@H](CCNCCc1cccc(Cl)c1)[NH+]1CCCCC1 ZINC001205391399 1133573393 /nfs/dbraw/zinc/57/33/93/1133573393.db2.gz NDHXERVAJLNMCH-HNNXBMFYSA-N 1 3 294.870 3.737 20 0 CHADHO C[C@@H]1[C@@H](C[NH3+])CCCN1Cc1ccc(F)c2ccccc12 ZINC001205903011 1133628539 /nfs/dbraw/zinc/62/85/39/1133628539.db2.gz MSGAWBXZRIQQNL-ZIAGYGMSSA-N 1 3 286.394 3.538 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@@H+]1CCC[C@H](CN)[C@@H]1C ZINC001205902995 1133628651 /nfs/dbraw/zinc/62/86/51/1133628651.db2.gz MHQRCIYDFDGVNN-YESZJQIVSA-N 1 3 298.515 3.667 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@H+]1CCC[C@H](CN)[C@@H]1C ZINC001205902995 1133628652 /nfs/dbraw/zinc/62/86/52/1133628652.db2.gz MHQRCIYDFDGVNN-YESZJQIVSA-N 1 3 298.515 3.667 20 0 CHADHO N[C@H]1CCCC[N@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001205931550 1133633441 /nfs/dbraw/zinc/63/34/41/1133633441.db2.gz LCWWRJQYSMUPEN-SFHVURJKSA-N 1 3 280.415 3.667 20 0 CHADHO N[C@H]1CCCC[N@@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001205931550 1133633444 /nfs/dbraw/zinc/63/34/44/1133633444.db2.gz LCWWRJQYSMUPEN-SFHVURJKSA-N 1 3 280.415 3.667 20 0 CHADHO [NH3+]Cc1cccc(CN2CCC[C@H]2c2ccc(F)cc2)c1 ZINC001206049558 1133649029 /nfs/dbraw/zinc/64/90/29/1133649029.db2.gz OEVDUJIHHJTIJA-SFHVURJKSA-N 1 3 284.378 3.622 20 0 CHADHO CCc1ccc(CN(C(C)C)[C@H]2CCC[NH2+]CC2)s1 ZINC001206592224 1133724463 /nfs/dbraw/zinc/72/44/63/1133724463.db2.gz YUNUPSOFQJEXDH-AWEZNQCLSA-N 1 3 280.481 3.663 20 0 CHADHO C[C@H](CC[N@@H+]1CCCC[C@@H](CN)C1)CC(C)(C)C ZINC001206606452 1133726359 /nfs/dbraw/zinc/72/63/59/1133726359.db2.gz NOXNNASPNSHQMX-CABCVRRESA-N 1 3 254.462 3.510 20 0 CHADHO C[C@H](CC[N@H+]1CCCC[C@@H](CN)C1)CC(C)(C)C ZINC001206606452 1133726362 /nfs/dbraw/zinc/72/63/62/1133726362.db2.gz NOXNNASPNSHQMX-CABCVRRESA-N 1 3 254.462 3.510 20 0 CHADHO CC/C=C\CCCCC[N@@H+]1C[C@@H](CN)CC[C@@H]1C ZINC001206761319 1133743393 /nfs/dbraw/zinc/74/33/93/1133743393.db2.gz WTBZLPRLEXPXDY-XETQRACLSA-N 1 3 252.446 3.572 20 0 CHADHO CC/C=C\CCCCC[N@H+]1C[C@@H](CN)CC[C@@H]1C ZINC001206761319 1133743396 /nfs/dbraw/zinc/74/33/96/1133743396.db2.gz WTBZLPRLEXPXDY-XETQRACLSA-N 1 3 252.446 3.572 20 0 CHADHO C[C@H]1CC[C@@H](C[NH3+])CN1Cc1cccc2c(F)cccc12 ZINC001206811440 1133750722 /nfs/dbraw/zinc/75/07/22/1133750722.db2.gz UPSZZBCVTAQHJT-KBPBESRZSA-N 1 3 286.394 3.538 20 0 CHADHO CC1=CC[C@@H](CC[NH+]2CCN(c3ccncc3)CC2)C1(C)C ZINC001207267218 1133783670 /nfs/dbraw/zinc/78/36/70/1133783670.db2.gz BVFKLXVXGDZSSJ-KRWDZBQOSA-N 1 3 299.462 3.586 20 0 CHADHO CC1=CC[C@@H](CCN2CCN(c3cc[nH+]cc3)CC2)C1(C)C ZINC001207267218 1133783675 /nfs/dbraw/zinc/78/36/75/1133783675.db2.gz BVFKLXVXGDZSSJ-KRWDZBQOSA-N 1 3 299.462 3.586 20 0 CHADHO C[C@@H](CCN1CCC(C)([NH+]2CCC2)CC1)c1ccccc1 ZINC001207295066 1133789225 /nfs/dbraw/zinc/78/92/25/1133789225.db2.gz XBOPYEWMZMLESA-KRWDZBQOSA-N 1 3 286.463 3.740 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@H]1CC(C)(C)C[C@@H]1C ZINC001207857994 1133855080 /nfs/dbraw/zinc/85/50/80/1133855080.db2.gz AGYWAZYUQYBPCW-KKUMJFAQSA-N 1 3 254.462 3.521 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@H](C)Cc1ccc(C)cc1 ZINC001207858581 1133855729 /nfs/dbraw/zinc/85/57/29/1133855729.db2.gz VQSIDDMNDPRYHS-DLBZAZTESA-N 1 3 276.468 3.636 20 0 CHADHO CN(C)CC1(C[N@H+](C)C/C=C/c2ccccc2)CCCC1 ZINC001208186688 1133902764 /nfs/dbraw/zinc/90/27/64/1133902764.db2.gz YOSKPMJHWYWJHX-FMIVXFBMSA-N 1 3 286.463 3.754 20 0 CHADHO CN(C)CC1(C[N@@H+](C)C/C=C/c2ccccc2)CCCC1 ZINC001208186688 1133902767 /nfs/dbraw/zinc/90/27/67/1133902767.db2.gz YOSKPMJHWYWJHX-FMIVXFBMSA-N 1 3 286.463 3.754 20 0 CHADHO CC/C=C\CCCCC[NH+]1C[C@@H]2CN(CCC)C[C@H]2C1 ZINC001208193893 1133903827 /nfs/dbraw/zinc/90/38/27/1133903827.db2.gz GXESVTSFDICLAR-SLXDBMQSSA-N 1 3 278.484 3.787 20 0 CHADHO CC/C=C\CCCCCN1C[C@@H]2C[NH+](CCC)C[C@H]2C1 ZINC001208193893 1133903830 /nfs/dbraw/zinc/90/38/30/1133903830.db2.gz GXESVTSFDICLAR-SLXDBMQSSA-N 1 3 278.484 3.787 20 0 CHADHO CCN(Cc1ccc(Cl)cc1)C[C@H]1CCC[N@H+](C)C1 ZINC001208613861 1133918010 /nfs/dbraw/zinc/91/80/10/1133918010.db2.gz BOKUGSXIHLMLFE-HNNXBMFYSA-N 1 3 280.843 3.504 20 0 CHADHO CCN(Cc1ccc(Cl)cc1)C[C@H]1CCC[N@@H+](C)C1 ZINC001208613861 1133918015 /nfs/dbraw/zinc/91/80/15/1133918015.db2.gz BOKUGSXIHLMLFE-HNNXBMFYSA-N 1 3 280.843 3.504 20 0 CHADHO c1ccc(CN2CCC[C@@H](C[NH+]3CCC4(CC4)CC3)C2)cc1 ZINC001208934339 1133966456 /nfs/dbraw/zinc/96/64/56/1133966456.db2.gz ZZSZLCQPGKKOMA-IBGZPJMESA-N 1 3 298.474 3.775 20 0 CHADHO c1ccc(C[N@H+]2CCC[C@@H](CN3CCC4(CC4)CC3)C2)cc1 ZINC001208934339 1133966461 /nfs/dbraw/zinc/96/64/61/1133966461.db2.gz ZZSZLCQPGKKOMA-IBGZPJMESA-N 1 3 298.474 3.775 20 0 CHADHO c1ccc(C[N@@H+]2CCC[C@@H](CN3CCC4(CC4)CC3)C2)cc1 ZINC001208934339 1133966465 /nfs/dbraw/zinc/96/64/65/1133966465.db2.gz ZZSZLCQPGKKOMA-IBGZPJMESA-N 1 3 298.474 3.775 20 0 CHADHO C[C@@H]1CC[N@H+](Cc2cccc3c4ccccc4oc32)CCN1 ZINC001210497882 1134230634 /nfs/dbraw/zinc/23/06/34/1134230634.db2.gz OWZMMJBWJAJTBW-CQSZACIVSA-N 1 3 294.398 3.770 20 0 CHADHO C[C@@H]1CC[N@@H+](Cc2cccc3c4ccccc4oc32)CCN1 ZINC001210497882 1134230637 /nfs/dbraw/zinc/23/06/37/1134230637.db2.gz OWZMMJBWJAJTBW-CQSZACIVSA-N 1 3 294.398 3.770 20 0 CHADHO CN(C)Cc1ccccc1NC1=CC[C@@H]([NH+]2CCCC2)CC1 ZINC001210711991 1134278826 /nfs/dbraw/zinc/27/88/26/1134278826.db2.gz NMAMJPWKOIHBAC-GOSISDBHSA-N 1 3 299.462 3.692 20 0 CHADHO CCc1cc(Nc2ccnc(C(C)(C)C)c2)cc[nH+]1 ZINC001213163888 1134432918 /nfs/dbraw/zinc/43/29/18/1134432918.db2.gz BOBGWCJFFXVKRX-UHFFFAOYSA-N 1 3 255.365 3.502 20 0 CHADHO Cc1ccc(CN2CC[C@]3(C2)CCC[NH2+]C3)c2ccccc12 ZINC001222142209 1135199933 /nfs/dbraw/zinc/19/99/33/1135199933.db2.gz XBEHZBLVDZAYLU-HXUWFJFHSA-N 1 3 294.442 3.724 20 0 CHADHO Cc1cccc(CN2CCCC[C@]3(CCCC[NH2+]C3)C2)c1 ZINC001222162078 1135203227 /nfs/dbraw/zinc/20/32/27/1135203227.db2.gz XIFQZCIMMDKWNA-IBGZPJMESA-N 1 3 286.463 3.741 20 0 CHADHO CCc1cccc(C)c1CN1CCC[C@]2(CCC[NH2+]C2)C1 ZINC001222277686 1135217326 /nfs/dbraw/zinc/21/73/26/1135217326.db2.gz QMAFQGGBAHXKHI-IBGZPJMESA-N 1 3 286.463 3.523 20 0 CHADHO Cc1cc(CN2CCC[C@@]23CCC[NH2+]CC3)cc(C)c1F ZINC001222316800 1135224927 /nfs/dbraw/zinc/22/49/27/1135224927.db2.gz YOQNUAMXGVOFJT-GOSISDBHSA-N 1 3 290.426 3.551 20 0 CHADHO CC[C@H](N[C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000221934128 262328444 /nfs/dbraw/zinc/32/84/44/262328444.db2.gz OKKDMGPFEUHTQZ-MAZHCROVSA-N 1 3 280.843 3.863 20 0 CHADHO CC[C@H](N[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000221934128 262328445 /nfs/dbraw/zinc/32/84/45/262328445.db2.gz OKKDMGPFEUHTQZ-MAZHCROVSA-N 1 3 280.843 3.863 20 0 CHADHO CCN(CC)CCC[NH2+][C@H]1C[C@H](C)c2ccccc21 ZINC000311903389 262343970 /nfs/dbraw/zinc/34/39/70/262343970.db2.gz QVHKQONYPQSKRE-YOEHRIQHSA-N 1 3 260.425 3.556 20 0 CHADHO C[C@@H](C[NH2+]C1CC(c2ccccc2)C1)CN1CCCCC1 ZINC000038041972 174044788 /nfs/dbraw/zinc/04/47/88/174044788.db2.gz DTESOZYFTNZNTJ-IVMQYODDSA-N 1 3 286.463 3.644 20 0 CHADHO C[C@@H](CNC1CC(c2ccccc2)C1)C[NH+]1CCCCC1 ZINC000038041972 174044789 /nfs/dbraw/zinc/04/47/89/174044789.db2.gz DTESOZYFTNZNTJ-IVMQYODDSA-N 1 3 286.463 3.644 20 0 CHADHO [NH3+]CC[C@H]1CCCCN1Cc1cc2ccccc2s1 ZINC000352546708 227051583 /nfs/dbraw/zinc/05/15/83/227051583.db2.gz ZHZUYUYTLCJEGC-CQSZACIVSA-N 1 3 274.433 3.605 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N[C@H](C)c1csc(C)n1 ZINC000036914511 260050682 /nfs/dbraw/zinc/05/06/82/260050682.db2.gz XEDWABKHQGERJB-CHWSQXEVSA-N 1 3 283.485 3.613 20 0 CHADHO CC(C)C[C@H](N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000093977914 260340248 /nfs/dbraw/zinc/34/02/48/260340248.db2.gz IEDOGMLVVNUSIJ-QRVBRYPASA-N 1 3 286.463 3.990 20 0 CHADHO CC(C)C[C@H](N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000093977914 260340250 /nfs/dbraw/zinc/34/02/50/260340250.db2.gz IEDOGMLVVNUSIJ-QRVBRYPASA-N 1 3 286.463 3.990 20 0 CHADHO C[C@@H]1CC[C@@H](NCCC[NH+]2CCCC2)c2ccccc21 ZINC000126474725 260353006 /nfs/dbraw/zinc/35/30/06/260353006.db2.gz HSVYGUZZRBZOFC-CRAIPNDOSA-N 1 3 272.436 3.701 20 0 CHADHO C[C@@H]1CC[C@@H]([NH2+]CCCN2CCCC2)c2ccccc21 ZINC000126474725 260353007 /nfs/dbraw/zinc/35/30/07/260353007.db2.gz HSVYGUZZRBZOFC-CRAIPNDOSA-N 1 3 272.436 3.701 20 0 CHADHO C[C@@H]1C[C@@H](NCc2ccc(C(C)(C)C)cc2)CC[N@@H+]1C ZINC000090721268 260393081 /nfs/dbraw/zinc/39/30/81/260393081.db2.gz ODHSOFJSMAUKQW-PBHICJAKSA-N 1 3 274.452 3.556 20 0 CHADHO C[C@@H]1C[C@@H](NCc2ccc(C(C)(C)C)cc2)CC[N@H+]1C ZINC000090721268 260393083 /nfs/dbraw/zinc/39/30/83/260393083.db2.gz ODHSOFJSMAUKQW-PBHICJAKSA-N 1 3 274.452 3.556 20 0 CHADHO CC(C)(C)[C@H](NC[C@H]1CCC[NH2+]C1)c1ccc(F)cc1 ZINC000130952084 260399745 /nfs/dbraw/zinc/39/97/45/260399745.db2.gz UQQAYABQKXOSPA-XJKSGUPXSA-N 1 3 278.415 3.502 20 0 CHADHO CCC[C@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1cccnc1 ZINC000185940817 262072904 /nfs/dbraw/zinc/07/29/04/262072904.db2.gz ZHWZZOGJRYDUFU-KRWDZBQOSA-N 1 3 289.467 3.775 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@@H]1C[C@H](C)c2ccccc21 ZINC000311721004 262339851 /nfs/dbraw/zinc/33/98/51/262339851.db2.gz PCTVMWVKJLIYJS-WMLDXEAASA-N 1 3 260.425 3.555 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H]1C[C@@H](C)c2ccccc21 ZINC000311903387 262344032 /nfs/dbraw/zinc/34/40/32/262344032.db2.gz QVHKQONYPQSKRE-RHSMWYFYSA-N 1 3 260.425 3.556 20 0 CHADHO CCCCN1CCC([NH2+][C@@H]2CCCc3occc32)CC1 ZINC000122190526 262344930 /nfs/dbraw/zinc/34/49/30/262344930.db2.gz JKNDNGDRULMHES-MRXNPFEDSA-N 1 3 276.424 3.511 20 0 CHADHO CCCOc1ccc([C@H](C)[NH2+]CCCN2CCCC2)cc1 ZINC000021013772 262373716 /nfs/dbraw/zinc/37/37/16/262373716.db2.gz KYJLYEAUZVKWSA-INIZCTEOSA-N 1 3 290.451 3.612 20 0 CHADHO CCC(CC)(CC)C[NH2+]C1CCN(c2ccncc2)CC1 ZINC000391159927 262384188 /nfs/dbraw/zinc/38/41/88/262384188.db2.gz BFDPGQIEINLCKR-UHFFFAOYSA-N 1 3 289.467 3.856 20 0 CHADHO CC(C)CC(C)(C)C[NH2+]C1CCN(c2ccncc2)CC1 ZINC000391190719 262386927 /nfs/dbraw/zinc/38/69/27/262386927.db2.gz GBCIYQDHUSCCSQ-UHFFFAOYSA-N 1 3 289.467 3.712 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H]2CN(Cc3ccc(-c4ccccc4)o3)C[C@@H]21 ZINC000414671225 263029541 /nfs/dbraw/zinc/02/95/41/263029541.db2.gz NLEQZFIRDKOCOD-BPQIPLTHSA-N 1 3 296.414 3.506 20 0 CHADHO Cc1ccc([C@@H]2CCC[N@H+]2C[C@H](N)CC(C)C)s1 ZINC000414685986 263032347 /nfs/dbraw/zinc/03/23/47/263032347.db2.gz ADMRAPHIJKUZLQ-KGLIPLIRSA-N 1 3 266.454 3.567 20 0 CHADHO Cc1ccc([C@@H]2CCC[N@@H+]2C[C@H](N)CC(C)C)s1 ZINC000414685986 263032348 /nfs/dbraw/zinc/03/23/48/263032348.db2.gz ADMRAPHIJKUZLQ-KGLIPLIRSA-N 1 3 266.454 3.567 20 0 CHADHO Cc1ccc([C@H]2CCC[N@H+]2C[C@@H](N)CC(C)C)s1 ZINC000414685987 263032389 /nfs/dbraw/zinc/03/23/89/263032389.db2.gz ADMRAPHIJKUZLQ-UONOGXRCSA-N 1 3 266.454 3.567 20 0 CHADHO Cc1ccc([C@H]2CCC[N@@H+]2C[C@@H](N)CC(C)C)s1 ZINC000414685987 263032390 /nfs/dbraw/zinc/03/23/90/263032390.db2.gz ADMRAPHIJKUZLQ-UONOGXRCSA-N 1 3 266.454 3.567 20 0 CHADHO CCCN(CCC[NH3+])[C@H](C)c1cc2ccccc2o1 ZINC000414687747 263032615 /nfs/dbraw/zinc/03/26/15/263032615.db2.gz HZGWKUVFSZGDCS-CYBMUJFWSA-N 1 3 260.381 3.555 20 0 CHADHO C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@@H]2CCC[C@H]2CN)C1 ZINC000414794860 263049637 /nfs/dbraw/zinc/04/96/37/263049637.db2.gz FYTZWUWLTKZVOO-BHNDVYRESA-N 1 3 286.463 3.676 20 0 CHADHO Clc1ccc([C@@H]2CCC[C@@H]2[NH2+]C[C@@H]2CCCNC2)cc1 ZINC000414822293 263055078 /nfs/dbraw/zinc/05/50/78/263055078.db2.gz COPPJEVEVZPULR-COXVUDFISA-N 1 3 292.854 3.565 20 0 CHADHO c1ccc([C@@H]2CCCC[C@H]([NH2+]C[C@@H]3CCCNC3)C2)cc1 ZINC000414825734 263055821 /nfs/dbraw/zinc/05/58/21/263055821.db2.gz HPDHGNGXQUAZEM-QRQLOZEOSA-N 1 3 286.463 3.692 20 0 CHADHO C[C@H](c1ccccc1)[C@H](C)NCC1([NH3+])CCCCCC1 ZINC000414858049 263074096 /nfs/dbraw/zinc/07/40/96/263074096.db2.gz HPAPQDQYTJOVNY-HOTGVXAUSA-N 1 3 274.452 3.820 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+][C@@H](C)[C@H]1CCCNC1 ZINC000414857861 263074338 /nfs/dbraw/zinc/07/43/38/263074338.db2.gz QIUCOYPFLIRCFF-YTQUADARSA-N 1 3 288.479 3.766 20 0 CHADHO C[C@H](CN)C[NH2+]CCCCc1ccc(Cl)c(Cl)c1 ZINC000414872088 263086489 /nfs/dbraw/zinc/08/64/89/263086489.db2.gz FEOUNPNUBHKROC-LLVKDONJSA-N 1 3 289.250 3.501 20 0 CHADHO C[C@H]([NH3+])[C@H]1CCN([C@@H](C)c2ccc(C(C)(C)C)cc2)C1 ZINC000226541076 263103482 /nfs/dbraw/zinc/10/34/82/263103482.db2.gz JSSYKNNQGDSSRL-DZKIICNBSA-N 1 3 274.452 3.714 20 0 CHADHO Cc1ccccc1-c1cccc(C[NH2+]CC2(N)CCC2)c1 ZINC000414894689 263103922 /nfs/dbraw/zinc/10/39/22/263103922.db2.gz ZWCYVXZRBHEVLC-UHFFFAOYSA-N 1 3 280.415 3.633 20 0 CHADHO CCC[C@@H](C[NH2+]C[C@]1(C)CCCNC1)c1ccccc1 ZINC000414903802 263111345 /nfs/dbraw/zinc/11/13/45/263111345.db2.gz MFLAODPAZXKJMM-ZWKOTPCHSA-N 1 3 274.452 3.550 20 0 CHADHO C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@H]1CCC[C@H](N)C1 ZINC000414925106 263129715 /nfs/dbraw/zinc/12/97/15/263129715.db2.gz KZWPNQPHAAAKKZ-PVAVHDDUSA-N 1 3 274.452 3.602 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+]CC2CCC(c3ccccc3)CC2)CCN1 ZINC000414947895 263156130 /nfs/dbraw/zinc/15/61/30/263156130.db2.gz LKBRHIMYGVBTMV-JVDULTGUSA-N 1 3 286.463 3.691 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2c2ccc(Cl)cc2)CCN1 ZINC000414953855 263159452 /nfs/dbraw/zinc/15/94/52/263159452.db2.gz RZVZEXFXHYFZNJ-BASLNEPJSA-N 1 3 292.854 3.706 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2)s1 ZINC000414959644 263164820 /nfs/dbraw/zinc/16/48/20/263164820.db2.gz QALNFRAQGAQKHG-CJNGLKHVSA-N 1 3 286.444 3.503 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2CCc2ccccc2)CCN1 ZINC000414960689 263165995 /nfs/dbraw/zinc/16/59/95/263165995.db2.gz YHVXFMAVXMLDIP-LULLPPNCSA-N 1 3 286.463 3.518 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2CCc2ccccc2)CCN1 ZINC000414960692 263166002 /nfs/dbraw/zinc/16/60/02/263166002.db2.gz YHVXFMAVXMLDIP-NXWXRZEISA-N 1 3 286.463 3.518 20 0 CHADHO Cc1ccc(-c2ccc(C[NH2+][C@@H](C)[C@@H](C)N)s2)cc1 ZINC000415002020 263202257 /nfs/dbraw/zinc/20/22/57/263202257.db2.gz DEBRKLJLOOVIGJ-OLZOCXBDSA-N 1 3 274.433 3.549 20 0 CHADHO CC[C@H](Cc1ccc(Cl)cc1Cl)N[C@H](C)[C@H](C)[NH3+] ZINC000415007236 263220627 /nfs/dbraw/zinc/22/06/27/263220627.db2.gz CLPYUDLEGNKJGP-OPQQBVKSSA-N 1 3 289.250 3.640 20 0 CHADHO C[C@H](CCCC[NH3+])NCc1csc(Cl)c1Cl ZINC000415017551 263255707 /nfs/dbraw/zinc/25/57/07/263255707.db2.gz SJNPTUMYGQOMEB-MRVPVSSYSA-N 1 3 281.252 3.662 20 0 CHADHO [NH3+]C[C@@H]1CC[C@@H](NCc2ccc(-c3ccccc3)cc2F)C1 ZINC000415029153 263256388 /nfs/dbraw/zinc/25/63/88/263256388.db2.gz DJCNOHGSFJOPCJ-RDTXWAMCSA-N 1 3 298.405 3.710 20 0 CHADHO Cc1ccsc1CN[C@@H](CCC[NH3+])c1ccccc1 ZINC000415047632 263258254 /nfs/dbraw/zinc/25/82/54/263258254.db2.gz FFLQERYMGDQEPQ-HNNXBMFYSA-N 1 3 274.433 3.626 20 0 CHADHO Cc1ccc(F)cc1CN[C@H](CCC[NH3+])c1ccccc1 ZINC000415055381 263258670 /nfs/dbraw/zinc/25/86/70/263258670.db2.gz OQLBVCJQGPBKQY-GOSISDBHSA-N 1 3 286.394 3.704 20 0 CHADHO Cc1ccc(CN[C@@H](CCC[NH3+])c2ccccc2)cc1C ZINC000415062493 263258719 /nfs/dbraw/zinc/25/87/19/263258719.db2.gz FKGPZOLBYQXZGP-IBGZPJMESA-N 1 3 282.431 3.873 20 0 CHADHO c1ccc(C(C[NH2+][C@H]2CCCNCC2)c2ccccc2)cc1 ZINC000415075452 263263260 /nfs/dbraw/zinc/26/32/60/263263260.db2.gz BKKZCMDPBIRGFP-IBGZPJMESA-N 1 3 294.442 3.550 20 0 CHADHO c1ccc(C(CN[C@H]2CCC[NH2+]CC2)c2ccccc2)cc1 ZINC000415075452 263263262 /nfs/dbraw/zinc/26/32/62/263263262.db2.gz BKKZCMDPBIRGFP-IBGZPJMESA-N 1 3 294.442 3.550 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H](CC)c2cccc(F)c2)C1 ZINC000187818767 263269626 /nfs/dbraw/zinc/26/96/26/263269626.db2.gz QBFSEBPVEQRNBC-YOEHRIQHSA-N 1 3 278.415 3.598 20 0 CHADHO CC[NH+](CC)Cc1cccc(CN[C@@H]2CC[C@H]2SC)c1 ZINC000425359414 264140657 /nfs/dbraw/zinc/14/06/57/264140657.db2.gz PZLJFFSZNSBDDL-IAGOWNOFSA-N 1 3 292.492 3.512 20 0 CHADHO CC[NH+](CC)Cc1ccccc1CN[C@@H]1CC[C@H]1SC ZINC000425359361 264140906 /nfs/dbraw/zinc/14/09/06/264140906.db2.gz PSTROJXOLSFHQS-IAGOWNOFSA-N 1 3 292.492 3.512 20 0 CHADHO CCSc1ccc([C@@H](C)[NH2+]CC2=CCN(C)CC2)cc1 ZINC000344295960 265056093 /nfs/dbraw/zinc/05/60/93/265056093.db2.gz LBDHJVWNTPLXLF-CQSZACIVSA-N 1 3 290.476 3.711 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]CCCN2CCCCC2)cc1F ZINC000094836707 265261335 /nfs/dbraw/zinc/26/13/35/265261335.db2.gz MDHFOICKKQQXTN-OAHLLOKOSA-N 1 3 278.415 3.661 20 0 CHADHO CCN1CC[C@H]([N@H+](C)Cc2ccc(SC)s2)C[C@H]1C ZINC000356130768 266056567 /nfs/dbraw/zinc/05/65/67/266056567.db2.gz DYGTUPBKBGXNRM-OLZOCXBDSA-N 1 3 298.521 3.775 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)Cc2ccc(SC)s2)C[C@H]1C ZINC000356130768 266056570 /nfs/dbraw/zinc/05/65/70/266056570.db2.gz DYGTUPBKBGXNRM-OLZOCXBDSA-N 1 3 298.521 3.775 20 0 CHADHO CC[C@H](NCC1(C)CC[NH+](C)CC1)c1cc(F)ccc1F ZINC000356836182 266184347 /nfs/dbraw/zinc/18/43/47/266184347.db2.gz HCOGFLYKYBLZKV-INIZCTEOSA-N 1 3 296.405 3.737 20 0 CHADHO CC(C)(C)[C@@H]1C[C@H](NC2CC([NH+]3CCCCC3)C2)CS1 ZINC000369671083 267257921 /nfs/dbraw/zinc/25/79/21/267257921.db2.gz ROLSTCNGPMLYRB-GRAKBVBRSA-N 1 3 296.524 3.513 20 0 CHADHO Cc1ccc([C@@H](C)NCc2ccc(C[NH+](C)C)cc2)s1 ZINC000171130346 327645643 /nfs/dbraw/zinc/64/56/43/327645643.db2.gz SWSZMOGJMFLKHC-CQSZACIVSA-N 1 3 288.460 3.969 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](NC2(c3ccc(Cl)cc3)CCC2)C1 ZINC000580095173 327698358 /nfs/dbraw/zinc/69/83/58/327698358.db2.gz KIFMCNMVSCFTJH-HUUCEWRRSA-N 1 3 278.827 3.579 20 0 CHADHO CCN1CC[C@@H]([NH2+]Cc2ccc(-c3ccccc3)o2)[C@@H](C)C1 ZINC000531683890 328020972 /nfs/dbraw/zinc/02/09/72/328020972.db2.gz SEJBQIMSLBZVEA-MAUKXSAKSA-N 1 3 298.430 3.767 20 0 CHADHO C[C@H](CN[C@@H](c1ccccc1)C1CC1)C[NH+]1CCCCC1 ZINC000041075778 328026692 /nfs/dbraw/zinc/02/66/92/328026692.db2.gz VTOQODKQPKJNRK-APWZRJJASA-N 1 3 286.463 3.849 20 0 CHADHO C[C@H](C[NH2+][C@@H](c1ccccc1)C1CC1)CN1CCCCC1 ZINC000041075778 328026694 /nfs/dbraw/zinc/02/66/94/328026694.db2.gz VTOQODKQPKJNRK-APWZRJJASA-N 1 3 286.463 3.849 20 0 CHADHO Cc1ccc(C)c(C[NH2+]C[C@H](C)CN2CCCCC2)c1 ZINC000048327222 328051668 /nfs/dbraw/zinc/05/16/68/328051668.db2.gz CBCIFMHIDMXSOM-INIZCTEOSA-N 1 3 274.452 3.515 20 0 CHADHO C[C@H](N)[C@@H]1CCC[N@@H+]([C@@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000414652032 328208323 /nfs/dbraw/zinc/20/83/23/328208323.db2.gz CWSQRQWRRIAWHF-QFHJOOASSA-N 1 3 286.463 3.556 20 0 CHADHO C[C@H](N)[C@@H]1CCC[N@H+]([C@@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000414652032 328208324 /nfs/dbraw/zinc/20/83/24/328208324.db2.gz CWSQRQWRRIAWHF-QFHJOOASSA-N 1 3 286.463 3.556 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000414794248 328229120 /nfs/dbraw/zinc/22/91/20/328229120.db2.gz FMZNOHHLRNATFA-VJANTYMQSA-N 1 3 286.463 3.505 20 0 CHADHO [NH3+][C@H]1CCC[C@H](NCc2ccc(-c3ccccc3)s2)C1 ZINC000414934575 328274995 /nfs/dbraw/zinc/27/49/95/328274995.db2.gz XWINRXNXEVCOGL-GJZGRUSLSA-N 1 3 286.444 3.775 20 0 CHADHO C[C@H]1C[C@@H]([NH2+]C2CCC(C)(c3ccccc3)CC2)CCN1 ZINC000414955842 328279999 /nfs/dbraw/zinc/27/99/99/328279999.db2.gz UTQTVNYBQYEESI-BARLLCKDSA-N 1 3 286.463 3.617 20 0 CHADHO C[C@@H](N)[C@H](C)[NH2+]Cc1ccc(Sc2ccccc2)cc1 ZINC000415011851 328298848 /nfs/dbraw/zinc/29/88/48/328298848.db2.gz IPBHRSGQBKFVJN-KGLIPLIRSA-N 1 3 286.444 3.663 20 0 CHADHO Cc1cccc([C@@H](N[C@@H]2CCC[NH2+]CC2)C(C)(C)C)c1 ZINC000415082801 328302614 /nfs/dbraw/zinc/30/26/14/328302614.db2.gz OVYWXPYBAFSJFY-IAGOWNOFSA-N 1 3 274.452 3.814 20 0 CHADHO CC(C)CC[C@H]([NH2+][C@@H]1CCCNCC1)C(C)(C)C ZINC000415083527 328302665 /nfs/dbraw/zinc/30/26/65/328302665.db2.gz NOSRDBFHPBFIAS-CABCVRRESA-N 1 3 254.462 3.569 20 0 CHADHO Cc1cc([C@@H](C)[NH2+]CCCN2CCCC2)cc(C)c1F ZINC000531944995 328323946 /nfs/dbraw/zinc/32/39/46/328323946.db2.gz SWMRJTOIAXDQAH-OAHLLOKOSA-N 1 3 278.415 3.579 20 0 CHADHO Clc1cccc2c1CC[C@@H]2[NH2+]CCCN1CCCCC1 ZINC000531945032 328324204 /nfs/dbraw/zinc/32/42/04/328324204.db2.gz BWGUCFZVZKGSBZ-KRWDZBQOSA-N 1 3 292.854 3.793 20 0 CHADHO CC(C)c1ccc([C@@H](C)N[C@@H](C)CC[NH+](C)C)cc1 ZINC000049553479 328371730 /nfs/dbraw/zinc/37/17/30/328371730.db2.gz NWPKQORRRYSYKB-LSDHHAIUSA-N 1 3 262.441 3.801 20 0 CHADHO CCCCN1CCC([NH2+]Cc2cc(C)ccc2C)CC1 ZINC000049670270 328375940 /nfs/dbraw/zinc/37/59/40/328375940.db2.gz BCUOISLEPXBHIV-UHFFFAOYSA-N 1 3 274.452 3.658 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1ccc(Cl)cc1 ZINC000531993598 328385873 /nfs/dbraw/zinc/38/58/73/328385873.db2.gz HSFKBZNHZQEALB-VBNZEHGJSA-N 1 3 280.843 3.863 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](N[C@@H]2CCCc3sc(Cl)cc32)C1 ZINC000576240738 327025868 /nfs/dbraw/zinc/02/58/68/327025868.db2.gz HSLJHDLITUWRSV-CKYFFXLPSA-N 1 3 284.856 3.638 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)[N@@H+]1CC[C@](C)(CN)C1 ZINC000261719422 327028163 /nfs/dbraw/zinc/02/81/63/327028163.db2.gz KBBHSVLPYREGSH-RDTXWAMCSA-N 1 3 268.404 3.572 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)[N@H+]1CC[C@](C)(CN)C1 ZINC000261719422 327028165 /nfs/dbraw/zinc/02/81/65/327028165.db2.gz KBBHSVLPYREGSH-RDTXWAMCSA-N 1 3 268.404 3.572 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)N1CC[C@](C)(C[NH3+])C1 ZINC000261719422 327028167 /nfs/dbraw/zinc/02/81/67/327028167.db2.gz KBBHSVLPYREGSH-RDTXWAMCSA-N 1 3 268.404 3.572 20 0 CHADHO CC(C)OCCCC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000558058383 327051069 /nfs/dbraw/zinc/05/10/69/327051069.db2.gz WSFDWJRWJTUEOY-UHFFFAOYSA-N 1 3 296.499 3.578 20 0 CHADHO C[C@@H]1CCC[C@@H](N2CCC([NH2+][C@H]3CCC3(C)C)CC2)C1 ZINC000554377873 327216851 /nfs/dbraw/zinc/21/68/51/327216851.db2.gz VQLGNIIXIFBRLE-OIISXLGYSA-N 1 3 278.484 3.808 20 0 CHADHO CN1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2cccc3ccccc32)C1 ZINC000559504528 327251391 /nfs/dbraw/zinc/25/13/91/327251391.db2.gz FOECVVVSBUZJJK-UYAOXDASSA-N 1 3 294.442 3.756 20 0 CHADHO CN1CC[C@@H]2[C@H](CCC[N@H+]2Cc2cccc3ccccc32)C1 ZINC000559504528 327251393 /nfs/dbraw/zinc/25/13/93/327251393.db2.gz FOECVVVSBUZJJK-UYAOXDASSA-N 1 3 294.442 3.756 20 0 CHADHO CC(C)(C)C1CC([NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000559877792 327267204 /nfs/dbraw/zinc/26/72/04/327267204.db2.gz HKURMGIKBNUEMB-UHFFFAOYSA-N 1 3 278.484 3.808 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+]C[C@H]2CCCC(C)(C)C2)C1 ZINC000583408937 327348968 /nfs/dbraw/zinc/34/89/68/327348968.db2.gz SYOAMYHDEZWDRB-HOTGVXAUSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]C[C@@H]2CCCC(C)(C)C2)C1 ZINC000583408938 327348974 /nfs/dbraw/zinc/34/89/74/327348974.db2.gz SYOAMYHDEZWDRB-HZPDHXFCSA-N 1 3 266.473 3.523 20 0 CHADHO C/C(=C\c1ccccc1)CN1CCC[C@@H]2C[N@H+](C)CC[C@@H]21 ZINC000377840542 329031573 /nfs/dbraw/zinc/03/15/73/329031573.db2.gz SRZNORCJZLTQSJ-JZUGBHPOSA-N 1 3 284.447 3.506 20 0 CHADHO C/C(=C\c1ccccc1)CN1CCC[C@@H]2C[N@@H+](C)CC[C@@H]21 ZINC000377840542 329031574 /nfs/dbraw/zinc/03/15/74/329031574.db2.gz SRZNORCJZLTQSJ-JZUGBHPOSA-N 1 3 284.447 3.506 20 0 CHADHO C/C(=C\c1ccccc1)C[N@H+]1CCC[C@@H]2CN(C)CC[C@@H]21 ZINC000377840542 329031575 /nfs/dbraw/zinc/03/15/75/329031575.db2.gz SRZNORCJZLTQSJ-JZUGBHPOSA-N 1 3 284.447 3.506 20 0 CHADHO C/C(=C\c1ccccc1)C[N@@H+]1CCC[C@@H]2CN(C)CC[C@@H]21 ZINC000377840542 329031576 /nfs/dbraw/zinc/03/15/76/329031576.db2.gz SRZNORCJZLTQSJ-JZUGBHPOSA-N 1 3 284.447 3.506 20 0 CHADHO Cc1c2ccccc2oc1C[NH2+][C@@H]1CCN(C)[C@@H]2CCC[C@@H]21 ZINC000583709257 329093337 /nfs/dbraw/zinc/09/33/37/329093337.db2.gz SNPMIYVZCOHQNF-BRWVUGGUSA-N 1 3 298.430 3.704 20 0 CHADHO CN(C)Cc1cccc(C[NH2+][C@@H]2CC[C@H]2C(C)(C)C)c1 ZINC000514684460 329540986 /nfs/dbraw/zinc/54/09/86/329540986.db2.gz UFDZNYAZSUBQTN-IAGOWNOFSA-N 1 3 274.452 3.663 20 0 CHADHO C[C@H](NCCC1CC[NH2+]CC1)c1c(F)cccc1Cl ZINC000420394792 329763512 /nfs/dbraw/zinc/76/35/12/329763512.db2.gz CRZYRVTYRNHCGY-NSHDSACASA-N 1 3 284.806 3.519 20 0 CHADHO CCC1CCC(C[NH2+][C@@H](C)c2ccc(CN)nc2C)CC1 ZINC000422722457 330152162 /nfs/dbraw/zinc/15/21/62/330152162.db2.gz XXFNWXSMJHGZOU-JEYLPNPQSA-N 1 3 289.467 3.716 20 0 CHADHO Cc1[nH]c2ccc(C[NH2+][C@H]3CCCCC[C@H]3N)cc2c1C ZINC000422724779 330152532 /nfs/dbraw/zinc/15/25/32/330152532.db2.gz WOIPYZHCVJLRAH-AEFFLSMTSA-N 1 3 285.435 3.534 20 0 CHADHO C[C@@H](N)C[C@@H](C)[NH2+]CCC(c1ccccc1)c1ccccc1 ZINC000422734687 330152852 /nfs/dbraw/zinc/15/28/52/330152852.db2.gz STZILEMZZHEERK-IAGOWNOFSA-N 1 3 296.458 3.924 20 0 CHADHO [NH3+]C[C@H]1CCCC[C@@H]1NCCSc1ccc(Cl)cc1 ZINC000422765208 330154013 /nfs/dbraw/zinc/15/40/13/330154013.db2.gz KRBBWUSQBGOLHN-DOMZBBRYSA-N 1 3 298.883 3.539 20 0 CHADHO NC[C@H]1CCCC[C@@H]1[NH2+]CCSc1ccc(Cl)cc1 ZINC000422765208 330154014 /nfs/dbraw/zinc/15/40/14/330154014.db2.gz KRBBWUSQBGOLHN-DOMZBBRYSA-N 1 3 298.883 3.539 20 0 CHADHO Cc1ccc(SCC[NH2+][C@H]2C[C@@H](N)c3ccccc32)cc1 ZINC000422764720 330154071 /nfs/dbraw/zinc/15/40/71/330154071.db2.gz KIPRGALDXYYATQ-MSOLQXFVSA-N 1 3 298.455 3.822 20 0 CHADHO CCC[C@H](N[C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccccc1 ZINC000422771580 330154285 /nfs/dbraw/zinc/15/42/85/330154285.db2.gz WCQOUTBUKKGUEL-UAGQMJEPSA-N 1 3 260.425 3.506 20 0 CHADHO CCC[C@H]([NH2+][C@@H](C)[C@@H]1CCCNC1)c1ccccc1 ZINC000422771580 330154286 /nfs/dbraw/zinc/15/42/86/330154286.db2.gz WCQOUTBUKKGUEL-UAGQMJEPSA-N 1 3 260.425 3.506 20 0 CHADHO Cc1ccc([C@H](C)CN[C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000422766838 330154376 /nfs/dbraw/zinc/15/43/76/330154376.db2.gz QIGIIYADWWVGEE-QXCFHYIPSA-N 1 3 286.463 3.609 20 0 CHADHO C[C@H](N[C@@H](C)[C@H]1CCC[NH2+]C1)c1cccc2ccccc21 ZINC000422769033 330154402 /nfs/dbraw/zinc/15/44/02/330154402.db2.gz UHKDRIYIZCVQJV-ZOBUZTSGSA-N 1 3 282.431 3.879 20 0 CHADHO C[C@H]([NH2+][C@@H](C)[C@H]1CCCNC1)c1cccc2ccccc21 ZINC000422769033 330154403 /nfs/dbraw/zinc/15/44/03/330154403.db2.gz UHKDRIYIZCVQJV-ZOBUZTSGSA-N 1 3 282.431 3.879 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](c1ccccc1)C1CCCC1 ZINC000422777755 330154498 /nfs/dbraw/zinc/15/44/98/330154498.db2.gz GLVISXKGVXGUEP-ZQIUZPCESA-N 1 3 260.425 3.633 20 0 CHADHO COc1cccc(-c2ccc(CN[C@@H](C)C[C@H](C)[NH3+])cc2)c1 ZINC000422796646 330155672 /nfs/dbraw/zinc/15/56/72/330155672.db2.gz YVFJFRHVALDPIL-GJZGRUSLSA-N 1 3 298.430 3.578 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H](C)[C@H](C)c1ccccc1 ZINC000422817711 330156293 /nfs/dbraw/zinc/15/62/93/330156293.db2.gz DUTJQQCPEDKKSW-KKUMJFAQSA-N 1 3 297.446 3.692 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H](c1cccc(F)c1)C(C)(C)C ZINC000422840441 330157107 /nfs/dbraw/zinc/15/71/07/330157107.db2.gz SYCIOPBGPDRYJK-YWPYICTPSA-N 1 3 266.404 3.628 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]C[C@@H](Cc1ccccc1)c1ccccc1 ZINC000422839986 330157215 /nfs/dbraw/zinc/15/72/15/330157215.db2.gz RTLQRGXJSUUSSQ-SQGPQFPESA-N 1 3 296.458 3.728 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H](c1ccc(F)cc1)C1CCCC1 ZINC000422789585 330157513 /nfs/dbraw/zinc/15/75/13/330157513.db2.gz UIZNLZHECHVKLH-AHIWAGSCSA-N 1 3 278.415 3.772 20 0 CHADHO CC(C)(C[NH2+][C@@H]1CCC[C@@H]1CN)Cc1cccc(Cl)c1 ZINC000422872561 330158471 /nfs/dbraw/zinc/15/84/71/330158471.db2.gz HOWQBFQYVOKHBA-GDBMZVCRSA-N 1 3 294.870 3.626 20 0 CHADHO [NH3+][C@@H]1CCC[C@H]1NCC1(c2ccc(Cl)cc2)CCCC1 ZINC000422882327 330158798 /nfs/dbraw/zinc/15/87/98/330158798.db2.gz RXAHXCGQXWQJNK-HZPDHXFCSA-N 1 3 292.854 3.621 20 0 CHADHO NC[C@H]1CCC[C@@H]1[NH2+]CCc1cccc(-c2ccccc2)c1 ZINC000422887938 330159129 /nfs/dbraw/zinc/15/91/29/330159129.db2.gz LSRAMLLUBDQCPU-UXHICEINSA-N 1 3 294.442 3.613 20 0 CHADHO C[C@H](CCCC[NH3+])N[C@@H](C)c1c(F)cccc1Cl ZINC000422923473 330160487 /nfs/dbraw/zinc/16/04/87/330160487.db2.gz WHJRBZGVQDIKSX-MNOVXSKESA-N 1 3 272.795 3.647 20 0 CHADHO CC[C@H](N[C@@H](C)CCCC[NH3+])c1cc(F)ccc1F ZINC000422923639 330160580 /nfs/dbraw/zinc/16/05/80/330160580.db2.gz SEOIBZPXVWYSKK-NHYWBVRUSA-N 1 3 270.367 3.523 20 0 CHADHO c1ccc([C@@H](NC2CC[NH2+]CC2)C2CCCCC2)cc1 ZINC000422945848 330161961 /nfs/dbraw/zinc/16/19/61/330161961.db2.gz VLOWZTXMIFUORJ-GOSISDBHSA-N 1 3 272.436 3.650 20 0 CHADHO c1ccc([C@@H]([NH2+]C2CCNCC2)C2CCCCC2)cc1 ZINC000422945848 330161963 /nfs/dbraw/zinc/16/19/63/330161963.db2.gz VLOWZTXMIFUORJ-GOSISDBHSA-N 1 3 272.436 3.650 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](Cc1ccccc1)c1cccs1 ZINC000422979819 330162548 /nfs/dbraw/zinc/16/25/48/330162548.db2.gz KKPAOUIQKXRBTB-LZWOXQAQSA-N 1 3 288.460 3.747 20 0 CHADHO [NH3+][C@H]1C[C@@H](NCC2(Cc3ccccc3)CC2)c2ccccc21 ZINC000422996448 330163489 /nfs/dbraw/zinc/16/34/89/330163489.db2.gz MDFMBAPNBFNUNB-RBUKOAKNSA-N 1 3 292.426 3.744 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC1CCC(C)(C)CC1 ZINC000423018582 330165403 /nfs/dbraw/zinc/16/54/03/330165403.db2.gz ZIKNQMINEYUUBE-ZDUSSCGKSA-N 1 3 289.467 3.716 20 0 CHADHO CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H]1C[C@H](N)c2ccccc21 ZINC000423054265 330166273 /nfs/dbraw/zinc/16/62/73/330166273.db2.gz BOGZQRJGEIKHHS-MJBXVCDLSA-N 1 3 286.341 3.698 20 0 CHADHO Cc1oc2ccccc2c1CCN[C@H]1CCCCC[C@H]1[NH3+] ZINC000423052944 330167467 /nfs/dbraw/zinc/16/74/67/330167467.db2.gz RMGRLLFKPBLXQR-SJORKVTESA-N 1 3 286.419 3.533 20 0 CHADHO NC[C@H]1CCC[C@@H]1[NH2+]C1CCC2(CCCCC2)CC1 ZINC000423066512 330168288 /nfs/dbraw/zinc/16/82/88/330168288.db2.gz DXLOJGFJAFRUDQ-ZBFHGGJFSA-N 1 3 264.457 3.597 20 0 CHADHO C[C@H](CCCC[NH3+])NCc1ccc(-c2ccco2)cc1F ZINC000423083607 330168731 /nfs/dbraw/zinc/16/87/31/330168731.db2.gz GCNQDBWRAGEFHI-CYBMUJFWSA-N 1 3 290.382 3.693 20 0 CHADHO C[C@@H]1CCNCC[C@@H]1[NH2+]C1CC(c2cccc(Cl)c2)C1 ZINC000423112986 330170849 /nfs/dbraw/zinc/17/08/49/330170849.db2.gz XXJBAOGUNAWYPG-SGTUBPSTSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@@H]1CC[NH2+]CC[C@@H]1NC1CC(c2cccc(Cl)c2)C1 ZINC000423112986 330170851 /nfs/dbraw/zinc/17/08/51/330170851.db2.gz XXJBAOGUNAWYPG-SGTUBPSTSA-N 1 3 292.854 3.564 20 0 CHADHO N[C@@H]1CCCCC[C@@H]1[NH2+]Cc1ccc2sccc2c1 ZINC000423130034 330171555 /nfs/dbraw/zinc/17/15/55/330171555.db2.gz XXFQIHHLNRMFKF-CABCVRRESA-N 1 3 274.433 3.651 20 0 CHADHO [NH3+][C@@H]1C[C@H](NC[C@@H]2C[C@H]2c2ccccc2)c2ccccc21 ZINC000423127989 330171659 /nfs/dbraw/zinc/17/16/59/330171659.db2.gz CTGYCMXSMAKNAX-FZDIXFNVSA-N 1 3 278.399 3.525 20 0 CHADHO C[C@@]1(CN[C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)C[C@H]1c1ccccc1 ZINC000423133879 330172160 /nfs/dbraw/zinc/17/21/60/330172160.db2.gz LFQYVFVNRLJPIX-OMZCGLGVSA-N 1 3 298.474 3.691 20 0 CHADHO C[C@@]1(CN[C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)C[C@H]1c1ccccc1 ZINC000423133878 330172191 /nfs/dbraw/zinc/17/21/91/330172191.db2.gz LFQYVFVNRLJPIX-IVDHNXQLSA-N 1 3 298.474 3.691 20 0 CHADHO NC[C@@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423142551 330172479 /nfs/dbraw/zinc/17/24/79/330172479.db2.gz ANEQGSREAJBTEL-AYMQEEERSA-N 1 3 292.854 3.693 20 0 CHADHO c1ccc([C@H]2CCCC[C@@H]2CNC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000423153591 330173082 /nfs/dbraw/zinc/17/30/82/330173082.db2.gz HZNODBMRWLHLGL-LXKKFAQKSA-N 1 3 298.474 3.833 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]C[C@@H]1CCCC[C@H]1c1ccccc1 ZINC000423153558 330173166 /nfs/dbraw/zinc/17/31/66/330173166.db2.gz HTGBOIGNPVQZLI-LAQRGFTBSA-N 1 3 274.452 3.676 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[C@@H](C)C1 ZINC000423164394 330173900 /nfs/dbraw/zinc/17/39/00/330173900.db2.gz OKWDFDBSCIUSIT-ORIJERBGSA-N 1 3 289.467 3.714 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[C@@H](C)C1 ZINC000423164393 330173969 /nfs/dbraw/zinc/17/39/69/330173969.db2.gz OKWDFDBSCIUSIT-HOSILWTGSA-N 1 3 289.467 3.714 20 0 CHADHO Cc1ccccc1COc1ccc([C@H](C)NCCC[NH3+])cc1 ZINC000423174513 330174791 /nfs/dbraw/zinc/17/47/91/330174791.db2.gz AWVCASKLQQVHCF-INIZCTEOSA-N 1 3 298.430 3.573 20 0 CHADHO C[C@H](N[C@@H]1CC[C@H](c2ccc(Cl)cc2)C1)[C@@H]1CC[NH2+]C1 ZINC000423175853 330174851 /nfs/dbraw/zinc/17/48/51/330174851.db2.gz FKVHMTXMFYOIRR-MKVSYHDVSA-N 1 3 292.854 3.564 20 0 CHADHO CC[C@H](CSc1ccc(Cl)cc1)NC1CC[NH2+]CC1 ZINC000423179530 330175156 /nfs/dbraw/zinc/17/51/56/330175156.db2.gz HIPFVAUWGSMSHF-CYBMUJFWSA-N 1 3 298.883 3.552 20 0 CHADHO CC[C@H](CSc1ccc(Cl)cc1)[NH2+]C1CCNCC1 ZINC000423179530 330175158 /nfs/dbraw/zinc/17/51/58/330175158.db2.gz HIPFVAUWGSMSHF-CYBMUJFWSA-N 1 3 298.883 3.552 20 0 CHADHO NC1(C[NH2+][C@@H]2CCCc3c4ccccc4[nH]c32)CCCCC1 ZINC000423184489 330175798 /nfs/dbraw/zinc/17/57/98/330175798.db2.gz UASRKYNMGKZBQD-QGZVFWFLSA-N 1 3 297.446 3.797 20 0 CHADHO C[C@@H]([NH2+]C1CCNCC1)c1ccc(-c2ccccc2)s1 ZINC000423193026 330175937 /nfs/dbraw/zinc/17/59/37/330175937.db2.gz WGFAWUQORFEKOB-CYBMUJFWSA-N 1 3 286.444 3.818 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H]1CCC[C@H]1C(C)(C)C ZINC000423194618 330176317 /nfs/dbraw/zinc/17/63/17/330176317.db2.gz WYLYRVOYKCLFFM-IAOVAPTHSA-N 1 3 289.467 3.714 20 0 CHADHO CNCCC[NH2+][C@H]1CCC[C@H](c2cccc(Cl)c2)C1 ZINC000423199165 330176598 /nfs/dbraw/zinc/17/65/98/330176598.db2.gz JJHWMORVIRBPTL-HOCLYGCPSA-N 1 3 280.843 3.565 20 0 CHADHO C[NH2+]CCCN[C@H]1CCC[C@H](c2cccc(Cl)c2)C1 ZINC000423199165 330176600 /nfs/dbraw/zinc/17/66/00/330176600.db2.gz JJHWMORVIRBPTL-HOCLYGCPSA-N 1 3 280.843 3.565 20 0 CHADHO CC(C)[C@@H]1C[C@H](N[C@H](C)[C@@H]2CCC[NH2+]C2)c2ccccc21 ZINC000423206297 330177403 /nfs/dbraw/zinc/17/74/03/330177403.db2.gz BRWQXPMFISCLDO-LTDCPUDJSA-N 1 3 286.463 3.849 20 0 CHADHO C[C@H](N[C@@H]1CCCc2c(Cl)cccc21)[C@H]1CCC[NH2+]C1 ZINC000423215682 330178799 /nfs/dbraw/zinc/17/87/99/330178799.db2.gz NJNHLWDHNSBFBE-GDZNZVCISA-N 1 3 292.854 3.695 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)[C@H]1CCCNC1)[C@H](C)c1ccc(Cl)cc1 ZINC000423219591 330179177 /nfs/dbraw/zinc/17/91/77/330179177.db2.gz UJZHWWZFJKJFNG-FQLMCAECSA-N 1 3 294.870 3.810 20 0 CHADHO CCCc1ccc([C@H](C)N[C@@H](C)[C@@H]2CCC[NH2+]C2)cc1 ZINC000423217828 330179196 /nfs/dbraw/zinc/17/91/96/330179196.db2.gz QOLZODTYEFCQNU-RLFYNMQTSA-N 1 3 274.452 3.678 20 0 CHADHO C[C@@H]([NH3+])CCN[C@@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000423227985 330180295 /nfs/dbraw/zinc/18/02/95/330180295.db2.gz XUKXRDLJNGQSKP-DOMZBBRYSA-N 1 3 266.404 3.630 20 0 CHADHO C[C@H]([NH3+])CCN[C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000423228878 330180330 /nfs/dbraw/zinc/18/03/30/330180330.db2.gz FRFBZEBRLLZSMS-GJZGRUSLSA-N 1 3 268.404 3.742 20 0 CHADHO Fc1ccc([C@@H](NCC[C@@H]2CC[NH2+]C2)c2ccccc2)cc1 ZINC000423243022 330182002 /nfs/dbraw/zinc/18/20/02/330182002.db2.gz GBDLMWUVMAFVJI-KXBFYZLASA-N 1 3 298.405 3.504 20 0 CHADHO Clc1cc2c(c(Cl)c1)[C@@H](NCC[C@@H]1CC[NH2+]C1)CC2 ZINC000423251688 330182945 /nfs/dbraw/zinc/18/29/45/330182945.db2.gz SKSLNICWIABMGA-HZMBPMFUSA-N 1 3 299.245 3.570 20 0 CHADHO C[C@@H](NCC[C@H]1CC[NH2+]C1)c1cc(Cl)sc1Cl ZINC000423254510 330183171 /nfs/dbraw/zinc/18/31/71/330183171.db2.gz YGWOSMNXERRBQN-RKDXNWHRSA-N 1 3 293.263 3.705 20 0 CHADHO CSc1ccc([C@H](C)N[C@@H]2CCCC[C@@H]2C[NH3+])cc1F ZINC000423274149 330184754 /nfs/dbraw/zinc/18/47/54/330184754.db2.gz KCZMRJKCPDZCER-NJZAAPMLSA-N 1 3 296.455 3.716 20 0 CHADHO CC(C)[C@H]([NH3+])CN[C@@H](C)C(c1ccccc1)c1ccccc1 ZINC000423285889 330185653 /nfs/dbraw/zinc/18/56/53/330185653.db2.gz ZSOHQNWUGMJLNG-QFBILLFUSA-N 1 3 296.458 3.780 20 0 CHADHO CCC[C@H]([NH2+]CC(C)(C)N)c1cccc(C(F)(F)F)c1 ZINC000423282600 330185707 /nfs/dbraw/zinc/18/57/07/330185707.db2.gz CVKVHGKLRJQUCX-ZDUSSCGKSA-N 1 3 288.357 3.874 20 0 CHADHO CC[C@@H]([NH2+]CC(C)(C)N)c1ccc(Cl)c(Cl)c1 ZINC000423286450 330186000 /nfs/dbraw/zinc/18/60/00/330186000.db2.gz HJJFEMNNNHVQJP-GFCCVEGCSA-N 1 3 275.223 3.771 20 0 CHADHO CCC(N)(CC)C[NH2+][C@@H](C)c1cccc(-c2ccncc2)c1 ZINC000423287226 330186068 /nfs/dbraw/zinc/18/60/68/330186068.db2.gz KYPYXPZHNKYHIB-HNNXBMFYSA-N 1 3 297.446 3.917 20 0 CHADHO C[C@@H]([NH2+]CC(C)(C)N)c1ccc(-c2ccccc2)s1 ZINC000423287416 330186248 /nfs/dbraw/zinc/18/62/48/330186248.db2.gz MDSLAUXVSCGJER-GFCCVEGCSA-N 1 3 274.433 3.803 20 0 CHADHO Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]CC(C)(C)N ZINC000423287104 330186288 /nfs/dbraw/zinc/18/62/88/330186288.db2.gz KHUSVIPJQBDLNI-HNNXBMFYSA-N 1 3 288.460 3.667 20 0 CHADHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccccc1N(C)C ZINC000423290081 330186776 /nfs/dbraw/zinc/18/67/76/330186776.db2.gz CHYFIWZBLVBVQS-LSDHHAIUSA-N 1 3 297.446 3.623 20 0 CHADHO Cc1cccc2c1CC[C@@H]2NCc1ccc([C@@H](C)[NH3+])cc1 ZINC000423290104 330186840 /nfs/dbraw/zinc/18/68/40/330186840.db2.gz CKGHPSOATYRGDY-KUHUBIRLSA-N 1 3 280.415 3.792 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H]2CCc3cc(F)ccc32)cc1 ZINC000423291843 330187420 /nfs/dbraw/zinc/18/74/20/330187420.db2.gz KBEUHXZISQGVCM-XIKOKIGWSA-N 1 3 284.378 3.623 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H]2CCc3cc(F)ccc32)cc1 ZINC000423291841 330187427 /nfs/dbraw/zinc/18/74/27/330187427.db2.gz KBEUHXZISQGVCM-KZULUSFZSA-N 1 3 284.378 3.623 20 0 CHADHO Cc1ccc2c(c1)[C@H](NCc1ccc([C@H](C)[NH3+])cc1)CC2 ZINC000423292861 330187702 /nfs/dbraw/zinc/18/77/02/330187702.db2.gz ORVGPTWPWBWQSB-IFXJQAMLSA-N 1 3 280.415 3.792 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](c2cccnc2)C2CCC2)cc1 ZINC000423292891 330187827 /nfs/dbraw/zinc/18/78/27/330187827.db2.gz OVUROUXQXHHLLH-AUUYWEPGSA-N 1 3 295.430 3.732 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2ccc3c(c2)COC3)cc1 ZINC000423293865 330188025 /nfs/dbraw/zinc/18/80/25/330188025.db2.gz SGAQDBJDYREXML-ZIAGYGMSSA-N 1 3 296.414 3.587 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H]2CCCc3ccccc32)cc1 ZINC000423294968 330188374 /nfs/dbraw/zinc/18/83/74/330188374.db2.gz VXDSSQFYGOLOOJ-AUUYWEPGSA-N 1 3 280.415 3.874 20 0 CHADHO Cc1ccc([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000423296587 330188567 /nfs/dbraw/zinc/18/85/67/330188567.db2.gz ZLZVMQFBOMZFHU-LSDHHAIUSA-N 1 3 268.404 3.866 20 0 CHADHO C[C@@H](C[NH3+])CN[C@@H](C)c1ccc(-c2ccc(F)cc2)s1 ZINC000423304371 330189279 /nfs/dbraw/zinc/18/92/79/330189279.db2.gz YLSSJAATZJJAAR-RYUDHWBXSA-N 1 3 292.423 3.800 20 0 CHADHO N[C@H](C[NH2+][C@H](CC1CC1)c1ccc(Cl)cc1)C1CC1 ZINC000423313547 330189806 /nfs/dbraw/zinc/18/98/06/330189806.db2.gz FULRGNUZMGMNSP-HZPDHXFCSA-N 1 3 278.827 3.508 20 0 CHADHO CC(C)C[C@H](NC[C@@]1(C)CCC[NH2+]C1)c1cccs1 ZINC000423318675 330190131 /nfs/dbraw/zinc/19/01/31/330190131.db2.gz CVXCLISFZMBJBV-HOCLYGCPSA-N 1 3 280.481 3.815 20 0 CHADHO CC(C)C[C@H]([NH2+]C[C@@]1(C)CCCNC1)c1cccs1 ZINC000423318675 330190133 /nfs/dbraw/zinc/19/01/33/330190133.db2.gz CVXCLISFZMBJBV-HOCLYGCPSA-N 1 3 280.481 3.815 20 0 CHADHO CCC[C@@H](NC[C@]1(C)CCC[NH2+]C1)c1ccccc1 ZINC000423316974 330190153 /nfs/dbraw/zinc/19/01/53/330190153.db2.gz AZLSMDNPNMODST-IAGOWNOFSA-N 1 3 260.425 3.507 20 0 CHADHO CCC[C@@H]([NH2+]C[C@]1(C)CCCNC1)c1ccccc1 ZINC000423316974 330190155 /nfs/dbraw/zinc/19/01/55/330190155.db2.gz AZLSMDNPNMODST-IAGOWNOFSA-N 1 3 260.425 3.507 20 0 CHADHO CC(C)Oc1ccc([C@@H](C)[NH2+]CC2(N)CCC2)cc1Cl ZINC000423327955 330190928 /nfs/dbraw/zinc/19/09/28/330190928.db2.gz NKQIMGPSOGAEQY-GFCCVEGCSA-N 1 3 296.842 3.659 20 0 CHADHO C[C@@H]([NH2+]C[C@@H](N)C1CC1)c1cccc(-c2ccccc2)c1 ZINC000423329655 330191141 /nfs/dbraw/zinc/19/11/41/330191141.db2.gz TVXKNCLCSNHFHP-AUUYWEPGSA-N 1 3 280.415 3.742 20 0 CHADHO C[C@H]([NH2+]C[C@H](N)C1CC1)c1cccc(-c2ccccc2)c1 ZINC000423330083 330191193 /nfs/dbraw/zinc/19/11/93/330191193.db2.gz TVXKNCLCSNHFHP-LIRRHRJNSA-N 1 3 280.415 3.742 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]C[C@]1(C)CCCNC1 ZINC000423329842 330191331 /nfs/dbraw/zinc/19/13/31/330191331.db2.gz FLAIEPPSYCDFSL-QGPMSJSTSA-N 1 3 272.436 3.523 20 0 CHADHO N[C@H](C[NH2+][C@@H](c1ccc(Cl)cc1)C1CCC1)C1CC1 ZINC000423333189 330191353 /nfs/dbraw/zinc/19/13/53/330191353.db2.gz VNLLJGSAIWVCAM-HZPDHXFCSA-N 1 3 278.827 3.508 20 0 CHADHO C[C@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CNC3)CC(C)(C)C1 ZINC000423354839 330193192 /nfs/dbraw/zinc/19/31/92/330193192.db2.gz HDMNZDGLKTUBLH-SUMWQHHRSA-N 1 3 272.436 3.594 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H](c3cccc(Cl)c3)C2)C1 ZINC000423359983 330193763 /nfs/dbraw/zinc/19/37/63/330193763.db2.gz DYEVKUBHCYKCIX-PQEBFOHHSA-N 1 3 292.854 3.836 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@@H](N)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423359204 330193798 /nfs/dbraw/zinc/19/37/98/330193798.db2.gz CWBHFNBXLSMOKR-FPYNETTCSA-N 1 3 298.883 3.753 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@@H]([NH3+])C1)c1cc2ccccc2s1 ZINC000423363449 330193899 /nfs/dbraw/zinc/19/38/99/330193899.db2.gz IYWMPFQPMKCWNH-IACUBPJLSA-N 1 3 274.433 3.822 20 0 CHADHO C[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)c1cc2ccccc2s1 ZINC000423363451 330193950 /nfs/dbraw/zinc/19/39/50/330193950.db2.gz IYWMPFQPMKCWNH-YUTCNCBUSA-N 1 3 274.433 3.822 20 0 CHADHO C[C@@H](NCC[C@H]1CCC[NH2+]1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423364497 330194371 /nfs/dbraw/zinc/19/43/71/330194371.db2.gz OPZPOFNFZBENBH-FVCCEPFGSA-N 1 3 298.883 3.625 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@@H](Cc2ccccc2)c2ccccc2)CCN1 ZINC000423366378 330194721 /nfs/dbraw/zinc/19/47/21/330194721.db2.gz COLPQIUCRSKXOC-UXPWSPDFSA-N 1 3 294.442 3.701 20 0 CHADHO Cc1cc([C@@H](C)NCc2ccc3c(c2)C[NH2+]C3)cc(C)c1F ZINC000423370187 330195092 /nfs/dbraw/zinc/19/50/92/330195092.db2.gz FHLARLGTGOGQHK-CQSZACIVSA-N 1 3 298.405 3.897 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@@H]1CCN[C@@H](C)C1 ZINC000423371409 330195244 /nfs/dbraw/zinc/19/52/44/330195244.db2.gz FLUWRUMQWXQEBX-IYOUNJFTSA-N 1 3 297.446 3.584 20 0 CHADHO CC(C)Cc1ccc([C@H](C)[NH2+][C@@H]2CCN[C@@H](C)C2)cc1 ZINC000423399349 330196019 /nfs/dbraw/zinc/19/60/19/330196019.db2.gz VTNVWUOSJKTIML-RLFYNMQTSA-N 1 3 274.452 3.676 20 0 CHADHO C[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1cc2c(s1)CCCC2 ZINC000423402989 330196186 /nfs/dbraw/zinc/19/61/86/330196186.db2.gz WWSJCJJYOIPZPQ-UBHSHLNASA-N 1 3 278.465 3.547 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423403891 330196475 /nfs/dbraw/zinc/19/64/75/330196475.db2.gz SHQLBOMZYTWZEO-DQYPLSBCSA-N 1 3 292.854 3.769 20 0 CHADHO Cc1ccc([C@H](N[C@@H]2CCC[C@@H]([NH3+])C2)C2CCCC2)o1 ZINC000423404680 330196566 /nfs/dbraw/zinc/19/65/66/330196566.db2.gz XOOYUNITADJUGF-BFYDXBDKSA-N 1 3 276.424 3.679 20 0 CHADHO CC(C)Sc1ccc([C@H](C)[NH2+][C@H]2CCNC[C@@H]2C)cc1 ZINC000423406141 330196858 /nfs/dbraw/zinc/19/68/58/330196858.db2.gz UJMACRNPQSLPMS-ZQIUZPCESA-N 1 3 292.492 3.836 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000423409987 330197283 /nfs/dbraw/zinc/19/72/83/330197283.db2.gz ZHYGMLYCGAJGNP-QCPWZWHMSA-N 1 3 292.854 3.564 20 0 CHADHO CCSc1ccccc1[C@H](C)N[C@H]1CCC[C@H]([NH3+])C1 ZINC000423383633 330199215 /nfs/dbraw/zinc/19/92/15/330199215.db2.gz KMKAHIKNSSCYBY-IHRRRGAJSA-N 1 3 278.465 3.719 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@H]2NCc1ccc2c(c1)C[NH2+]C2 ZINC000423382971 330199289 /nfs/dbraw/zinc/19/92/89/330199289.db2.gz KCVRQOJSWSVQAN-AUUYWEPGSA-N 1 3 292.426 3.936 20 0 CHADHO C[C@@H]([NH2+]Cc1ccc2c(c1)CNC2)[C@H]1CCCC[C@H]1C ZINC000423382909 330199364 /nfs/dbraw/zinc/19/93/64/330199364.db2.gz KAWWQNYOKDURPX-LBTNJELSSA-N 1 3 272.436 3.594 20 0 CHADHO CSc1ccccc1[C@@H](C)NCc1ccc2c(c1)C[NH2+]C2 ZINC000423383032 330199438 /nfs/dbraw/zinc/19/94/38/330199438.db2.gz KFSLQPIVYNLQAY-CYBMUJFWSA-N 1 3 298.455 3.863 20 0 CHADHO CC(C)CC[C@@H]([NH2+]Cc1ccc2c(c1)CNC2)C1CC1 ZINC000423384305 330199571 /nfs/dbraw/zinc/19/95/71/330199571.db2.gz KTRCAJAVHQMOBY-GOSISDBHSA-N 1 3 272.436 3.594 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](N[C@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000423388973 330199952 /nfs/dbraw/zinc/19/99/52/330199952.db2.gz NUVWEDFOJOTVEV-PMPSAXMXSA-N 1 3 278.827 3.651 20 0 CHADHO C[C@@H](CN)[NH2+][C@@H](Cc1ccccc1Cl)c1ccsc1 ZINC000423388319 330200025 /nfs/dbraw/zinc/20/00/25/330200025.db2.gz IOAWLYYXRGAHNK-NHYWBVRUSA-N 1 3 294.851 3.622 20 0 CHADHO C[C@@H]([NH2+][C@H](c1ccc(Cl)c(Cl)c1)C1CC1)[C@H](C)N ZINC000423437089 330201371 /nfs/dbraw/zinc/20/13/71/330201371.db2.gz FWELDSOYEOEGOY-QIBSRJKCSA-N 1 3 287.234 3.770 20 0 CHADHO CC(C)Sc1ccc([C@H](C)[NH2+][C@@H](C)[C@H](C)N)cc1 ZINC000423447412 330202395 /nfs/dbraw/zinc/20/23/95/330202395.db2.gz OXNKEEAASZKYHD-AVGNSLFASA-N 1 3 266.454 3.573 20 0 CHADHO C[C@H](NC[C@H]1CCC[C@@H]([NH3+])C1)c1ccc(F)cc1Cl ZINC000423455114 330203355 /nfs/dbraw/zinc/20/33/55/330203355.db2.gz DRFFPNCEEMFYJP-GMXVVIOVSA-N 1 3 284.806 3.647 20 0 CHADHO CC[C@@H](N)C[NH2+][C@@H](C)c1ccc(-c2ccccc2)s1 ZINC000423456975 330203595 /nfs/dbraw/zinc/20/35/95/330203595.db2.gz FCHYRJGZBTVZBH-GXTWGEPZSA-N 1 3 274.433 3.803 20 0 CHADHO CC[C@@H](N)C[NH2+][C@H](C)c1sc(-c2ccccc2)nc1C ZINC000423461081 330203998 /nfs/dbraw/zinc/20/39/98/330203998.db2.gz JHQSEJHIKBIDFD-BXUZGUMPSA-N 1 3 289.448 3.506 20 0 CHADHO CCC[C@H]([NH2+]C[C@@H](N)CC)c1ccc(Cl)cc1 ZINC000423486001 330206753 /nfs/dbraw/zinc/20/67/53/330206753.db2.gz ZJBMOBAWOMNXRT-KBPBESRZSA-N 1 3 254.805 3.508 20 0 CHADHO C[C@@H](N[C@@H](CCC[NH3+])c1ccccc1)c1ccccc1 ZINC000423504675 330208810 /nfs/dbraw/zinc/20/88/10/330208810.db2.gz NRQSPBZDPFOIFK-QAPCUYQASA-N 1 3 268.404 3.817 20 0 CHADHO CCc1ccc([C@H](C)N[C@H](CCC[NH3+])c2ccccc2)o1 ZINC000423506719 330208828 /nfs/dbraw/zinc/20/88/28/330208828.db2.gz PGCVVRHZHXNYOK-WMLDXEAASA-N 1 3 286.419 3.973 20 0 CHADHO c1csc([C@H](NCCC[NH2+]C2CC2)C2CCCC2)c1 ZINC000423531631 330210330 /nfs/dbraw/zinc/21/03/30/330210330.db2.gz SZLFYZLWGMAJDF-MRXNPFEDSA-N 1 3 278.465 3.711 20 0 CHADHO c1csc([C@H]([NH2+]CCCNC2CC2)C2CCCC2)c1 ZINC000423531631 330210332 /nfs/dbraw/zinc/21/03/32/330210332.db2.gz SZLFYZLWGMAJDF-MRXNPFEDSA-N 1 3 278.465 3.711 20 0 CHADHO CC(C)C[C@@H](C)[NH2+][C@H](C)c1cccc(OCCN(C)C)c1 ZINC000536839118 330232336 /nfs/dbraw/zinc/23/23/36/330232336.db2.gz NGPISJWKRVFYHW-HZPDHXFCSA-N 1 3 292.467 3.712 20 0 CHADHO CC[NH+](CC)Cc1ccc(CNCc2ccnc(C)c2)cc1 ZINC000527632954 330267103 /nfs/dbraw/zinc/26/71/03/330267103.db2.gz QGISYKBJUYFILH-UHFFFAOYSA-N 1 3 297.446 3.522 20 0 CHADHO CC[NH+](CC)Cc1cccc(CNCc2ccnc(C)c2)c1 ZINC000527640342 330268404 /nfs/dbraw/zinc/26/84/04/330268404.db2.gz JBMIQVSELVOHQG-UHFFFAOYSA-N 1 3 297.446 3.522 20 0 CHADHO C([NH2+]C1CCN(C2CCCCC2)CC1)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000527732629 330278406 /nfs/dbraw/zinc/27/84/06/330278406.db2.gz CTOBBVLOUFUACI-ZACQAIPSSA-N 1 3 290.495 3.809 20 0 CHADHO CC[C@H](CCc1ccccc1)[NH2+][C@H]1CCN2CCC[C@@H]2C1 ZINC000527763935 330281620 /nfs/dbraw/zinc/28/16/20/330281620.db2.gz NEKCUBAMPQZCCM-CEXWTWQISA-N 1 3 286.463 3.614 20 0 CHADHO CC[C@H](CCc1ccccc1)N[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000527763935 330281621 /nfs/dbraw/zinc/28/16/21/330281621.db2.gz NEKCUBAMPQZCCM-CEXWTWQISA-N 1 3 286.463 3.614 20 0 CHADHO CC[C@H](CCc1ccccc1)N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000527763935 330281622 /nfs/dbraw/zinc/28/16/22/330281622.db2.gz NEKCUBAMPQZCCM-CEXWTWQISA-N 1 3 286.463 3.614 20 0 CHADHO Cc1cccc([C@H](N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C(C)C)c1 ZINC000527810208 330284737 /nfs/dbraw/zinc/28/47/37/330284737.db2.gz OVVYPMPEYRFMJV-GUDVDZBRSA-N 1 3 286.463 3.909 20 0 CHADHO Cc1cccc([C@H](N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)C(C)C)c1 ZINC000527810208 330284738 /nfs/dbraw/zinc/28/47/38/330284738.db2.gz OVVYPMPEYRFMJV-GUDVDZBRSA-N 1 3 286.463 3.909 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H](CC)CCc2ccccc2)C1 ZINC000527855325 330288855 /nfs/dbraw/zinc/28/88/55/330288855.db2.gz WAYUZHBNFUUNNI-OALUTQOASA-N 1 3 288.479 3.719 20 0 CHADHO CC[NH+](CC)CCCNC1CC(c2ccccc2Cl)C1 ZINC000036842385 330292586 /nfs/dbraw/zinc/29/25/86/330292586.db2.gz VBORHKYBWPQHFY-UHFFFAOYSA-N 1 3 294.870 3.908 20 0 CHADHO CCN(CC)CCC[NH2+]C1CC(c2ccccc2Cl)C1 ZINC000036842385 330292587 /nfs/dbraw/zinc/29/25/87/330292587.db2.gz VBORHKYBWPQHFY-UHFFFAOYSA-N 1 3 294.870 3.908 20 0 CHADHO C([NH2+]C1CCN(C2CCCCC2)CC1)[C@@H]1C[C@H]1C1CCC1 ZINC000424178544 330318260 /nfs/dbraw/zinc/31/82/60/330318260.db2.gz WLGYCOLBIXKJSN-LPHOPBHVSA-N 1 3 290.495 3.809 20 0 CHADHO CCN(C)C[C@H]1CC[N@@H+]([C@H](C)c2c(C)cc(C)cc2C)C1 ZINC000533011142 330324151 /nfs/dbraw/zinc/32/41/51/330324151.db2.gz TWAFCQHHZPFREM-QZTJIDSGSA-N 1 3 288.479 3.946 20 0 CHADHO CCN(C)C[C@H]1CC[N@H+]([C@H](C)c2c(C)cc(C)cc2C)C1 ZINC000533011142 330324152 /nfs/dbraw/zinc/32/41/52/330324152.db2.gz TWAFCQHHZPFREM-QZTJIDSGSA-N 1 3 288.479 3.946 20 0 CHADHO CC[N@H+](C)C[C@H]1CCN([C@H](C)c2c(C)cc(C)cc2C)C1 ZINC000533011142 330324153 /nfs/dbraw/zinc/32/41/53/330324153.db2.gz TWAFCQHHZPFREM-QZTJIDSGSA-N 1 3 288.479 3.946 20 0 CHADHO CC[N@@H+](C)C[C@H]1CCN([C@H](C)c2c(C)cc(C)cc2C)C1 ZINC000533011142 330324154 /nfs/dbraw/zinc/32/41/54/330324154.db2.gz TWAFCQHHZPFREM-QZTJIDSGSA-N 1 3 288.479 3.946 20 0 CHADHO C[C@H](NC[C@H]1CCC[N@H+](C)C1)c1ccc2c(c1)CCCC2 ZINC000044534233 330329825 /nfs/dbraw/zinc/32/98/25/330329825.db2.gz FBYWFVDSHKSONJ-JKSUJKDBSA-N 1 3 286.463 3.558 20 0 CHADHO C[C@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccc2c(c1)CCCC2 ZINC000044534233 330329826 /nfs/dbraw/zinc/32/98/26/330329826.db2.gz FBYWFVDSHKSONJ-JKSUJKDBSA-N 1 3 286.463 3.558 20 0 CHADHO C[C@@H](NC[C@H]1CCC[N@H+](C)C1)c1ccc(C(C)(C)C)cc1 ZINC000044534628 330329959 /nfs/dbraw/zinc/32/99/59/330329959.db2.gz BXEKIBGWIVEABJ-HZPDHXFCSA-N 1 3 288.479 3.977 20 0 CHADHO C[C@@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccc(C(C)(C)C)cc1 ZINC000044534628 330329960 /nfs/dbraw/zinc/32/99/60/330329960.db2.gz BXEKIBGWIVEABJ-HZPDHXFCSA-N 1 3 288.479 3.977 20 0 CHADHO C1CC([C@@H]([NH2+][C@H]2CCN3CCC[C@@H]3C2)C2CCCCC2)C1 ZINC000424273273 330333268 /nfs/dbraw/zinc/33/32/68/330333268.db2.gz WGACJLHUNYJCMQ-OTWHNJEPSA-N 1 3 290.495 3.952 20 0 CHADHO CC[C@@H]([NH2+][C@@H]1CCCC[C@H]1N)c1cccc(Cl)c1 ZINC000424370584 330348240 /nfs/dbraw/zinc/34/82/40/330348240.db2.gz DRNNTEZPEZLREG-RBSFLKMASA-N 1 3 266.816 3.651 20 0 CHADHO [NH3+][C@@H]1C[C@H](N[C@@H]2CCC[C@H](C3CC3)C2)c2ccccc21 ZINC000424385627 330349497 /nfs/dbraw/zinc/34/94/97/330349497.db2.gz WNQDNXVLNCLWDP-JFTQMJAMSA-N 1 3 270.420 3.690 20 0 CHADHO CC(C)CN1CCC([NH2+][C@@H](c2ccccc2)C2CC2)CC1 ZINC000120366661 330387214 /nfs/dbraw/zinc/38/72/14/330387214.db2.gz SQUYDURMQSBYAS-IBGZPJMESA-N 1 3 286.463 3.848 20 0 CHADHO CC(C)C[NH+]1CCC(N[C@@H](c2ccccc2)C2CC2)CC1 ZINC000120366661 330387215 /nfs/dbraw/zinc/38/72/15/330387215.db2.gz SQUYDURMQSBYAS-IBGZPJMESA-N 1 3 286.463 3.848 20 0 CHADHO CN(C)[C@@H]1CCC[N@H+](CC/C=C/c2ccccc2)CC1 ZINC000450853326 331003016 /nfs/dbraw/zinc/00/30/16/331003016.db2.gz HKXRDUDUPGMSON-PMQIGOLDSA-N 1 3 272.436 3.506 20 0 CHADHO CN(C)[C@@H]1CCC[N@@H+](CC/C=C/c2ccccc2)CC1 ZINC000450853326 331003017 /nfs/dbraw/zinc/00/30/17/331003017.db2.gz HKXRDUDUPGMSON-PMQIGOLDSA-N 1 3 272.436 3.506 20 0 CHADHO C[NH+](C)[C@@H]1CCCN(CC/C=C/c2ccccc2)CC1 ZINC000450853326 331003018 /nfs/dbraw/zinc/00/30/18/331003018.db2.gz HKXRDUDUPGMSON-PMQIGOLDSA-N 1 3 272.436 3.506 20 0 CHADHO C[C@@H]1CC[C@H](N[C@@H]2CC[N@@H+]3CCCC[C@@H]23)c2sccc21 ZINC000453070133 331086405 /nfs/dbraw/zinc/08/64/05/331086405.db2.gz ZZEMZJHAGNGXOS-OJLVUWQFSA-N 1 3 290.476 3.903 20 0 CHADHO C[C@@H]1CC[C@H](N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c2sccc21 ZINC000453070133 331086406 /nfs/dbraw/zinc/08/64/06/331086406.db2.gz ZZEMZJHAGNGXOS-OJLVUWQFSA-N 1 3 290.476 3.903 20 0 CHADHO CCC[C@@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)C1CCC1 ZINC000453107624 331089829 /nfs/dbraw/zinc/08/98/29/331089829.db2.gz LQPBUZGAQHNSKV-NVXWUHKLSA-N 1 3 266.473 3.665 20 0 CHADHO C1CC1[C@@H]([NH2+]C1CCN(C2CCCCC2)CC1)C1CCC1 ZINC000453147620 331094291 /nfs/dbraw/zinc/09/42/91/331094291.db2.gz XYMNSWMJVLAEGF-IBGZPJMESA-N 1 3 290.495 3.952 20 0 CHADHO C[NH+]1CCC(CNC(c2ccccc2)c2ccccc2)CC1 ZINC000194987395 331108695 /nfs/dbraw/zinc/10/86/95/331108695.db2.gz UAJDBYMPQSCKIC-UHFFFAOYSA-N 1 3 294.442 3.707 20 0 CHADHO CCCC[NH+]1CCC(NCCc2ccc(Cl)cc2)CC1 ZINC000459400713 331279977 /nfs/dbraw/zinc/27/99/77/331279977.db2.gz WMAYPVLVKWYKIV-UHFFFAOYSA-N 1 3 294.870 3.737 20 0 CHADHO C[C@H]([NH2+]C1CC2(CCC2)C1)[C@H]1CCCN(C2CCC2)C1 ZINC000459472704 331283534 /nfs/dbraw/zinc/28/35/34/331283534.db2.gz WDGAOJPEIDTPCU-GJZGRUSLSA-N 1 3 276.468 3.562 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@@H]1C[C@@H](c2ccccc2)C1(C)C ZINC000463538155 331349268 /nfs/dbraw/zinc/34/92/68/331349268.db2.gz AAWJMBDVOPZSIN-ZWKOTPCHSA-N 1 3 288.479 3.889 20 0 CHADHO CC(C)[N@H+](C)CCCN[C@@H]1C[C@@H](c2ccccc2)C1(C)C ZINC000463538155 331349269 /nfs/dbraw/zinc/34/92/69/331349269.db2.gz AAWJMBDVOPZSIN-ZWKOTPCHSA-N 1 3 288.479 3.889 20 0 CHADHO CC(C)[N@@H+](C)CCCN[C@@H]1C[C@@H](c2ccccc2)C1(C)C ZINC000463538155 331349270 /nfs/dbraw/zinc/34/92/70/331349270.db2.gz AAWJMBDVOPZSIN-ZWKOTPCHSA-N 1 3 288.479 3.889 20 0 CHADHO C[C@@H](CCCC(F)(F)F)[NH2+]CC(C)(C)CN1CCCC1 ZINC000477934650 331694907 /nfs/dbraw/zinc/69/49/07/331694907.db2.gz VHSSCYJVKWNZIN-ZDUSSCGKSA-N 1 3 294.405 3.819 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1C[NH2+]C1CCN(CC(C)C)CC1 ZINC000479547325 331736358 /nfs/dbraw/zinc/73/63/58/331736358.db2.gz WUZCMHFMKJAOKZ-FUHWJXTLSA-N 1 3 278.484 3.689 20 0 CHADHO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1cccc(CN(C)C)c1 ZINC000480260748 331764860 /nfs/dbraw/zinc/76/48/60/331764860.db2.gz UIBZNZHOIHYYFU-HWWDLCQESA-N 1 3 274.452 3.663 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)N1CCC(C[NH+](C)C)CC1 ZINC000481022398 331794700 /nfs/dbraw/zinc/79/47/00/331794700.db2.gz WCHMDRYTVQDTME-CYBMUJFWSA-N 1 3 280.843 3.675 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CS[C@H](C(C)(C)C)C1)CN1CCCCC1 ZINC000488413780 332005484 /nfs/dbraw/zinc/00/54/84/332005484.db2.gz ZVVYUAJUTLXOQR-PMPSAXMXSA-N 1 3 298.540 3.618 20 0 CHADHO C[C@H](CN[C@@H]1CS[C@H](C(C)(C)C)C1)C[NH+]1CCCCC1 ZINC000488413780 332005485 /nfs/dbraw/zinc/00/54/85/332005485.db2.gz ZVVYUAJUTLXOQR-PMPSAXMXSA-N 1 3 298.540 3.618 20 0 CHADHO CN(C[C@@H]1CCC[N@H+](C)C1)[C@H]1CCc2c1cccc2Cl ZINC000489839738 332069813 /nfs/dbraw/zinc/06/98/13/332069813.db2.gz UWZBWUQRUGSDPK-DYVFJYSZSA-N 1 3 292.854 3.601 20 0 CHADHO CN(C[C@@H]1CCC[N@@H+](C)C1)[C@H]1CCc2c1cccc2Cl ZINC000489839738 332069814 /nfs/dbraw/zinc/06/98/14/332069814.db2.gz UWZBWUQRUGSDPK-DYVFJYSZSA-N 1 3 292.854 3.601 20 0 CHADHO Cc1cc(C)c(CN[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@H]32)c(C)c1 ZINC000513652797 333029376 /nfs/dbraw/zinc/02/93/76/333029376.db2.gz BWAYTYXBLXGLJF-QXAKKESOSA-N 1 3 286.463 3.574 20 0 CHADHO Cc1cc(C)c(CN[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@H]32)c(C)c1 ZINC000513652797 333029377 /nfs/dbraw/zinc/02/93/77/333029377.db2.gz BWAYTYXBLXGLJF-QXAKKESOSA-N 1 3 286.463 3.574 20 0 CHADHO CCN(CC)CCC[N@@H+]1CCC[C@H]1c1ccccc1C ZINC000514079643 333065241 /nfs/dbraw/zinc/06/52/41/333065241.db2.gz HOTXKIWQEPPMFX-SFHVURJKSA-N 1 3 274.452 3.864 20 0 CHADHO CCN(CC)CCC[N@H+]1CCC[C@H]1c1ccccc1C ZINC000514079643 333065242 /nfs/dbraw/zinc/06/52/42/333065242.db2.gz HOTXKIWQEPPMFX-SFHVURJKSA-N 1 3 274.452 3.864 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+]C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000516815501 333083176 /nfs/dbraw/zinc/08/31/76/333083176.db2.gz UGDVLMUQSIOQTL-CABCVRRESA-N 1 3 294.870 3.763 20 0 CHADHO CCCc1ccc([C@H](C)NCc2ccc(C[NH3+])cc2)cc1 ZINC000517236801 333095445 /nfs/dbraw/zinc/09/54/45/333095445.db2.gz OPZDJCMEQNGPPM-HNNXBMFYSA-N 1 3 282.431 3.949 20 0 CHADHO CC(C)C[C@H](C[NH2+][C@@H](C)C[C@@H](C)N)c1ccccc1 ZINC000517371884 333098179 /nfs/dbraw/zinc/09/81/79/333098179.db2.gz JWZYDMXITKDJRG-HLLBOEOZSA-N 1 3 262.441 3.532 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000226918426 333272171 /nfs/dbraw/zinc/27/21/71/333272171.db2.gz IVXJPYJDGXAGGP-GUYCJALGSA-N 1 3 292.854 3.723 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000226918426 333272172 /nfs/dbraw/zinc/27/21/72/333272172.db2.gz IVXJPYJDGXAGGP-GUYCJALGSA-N 1 3 292.854 3.723 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000226918426 333272174 /nfs/dbraw/zinc/27/21/74/333272174.db2.gz IVXJPYJDGXAGGP-GUYCJALGSA-N 1 3 292.854 3.723 20 0 CHADHO C[C@@H](NCC1(C)CC[NH+](C)CC1)c1ccccc1Cl ZINC000227496957 333283687 /nfs/dbraw/zinc/28/36/87/333283687.db2.gz MQSRDCMZTFNPHV-CYBMUJFWSA-N 1 3 280.843 3.723 20 0 CHADHO Cc1cc(C)c(C[N@@H+]2CC[C@@H](CN3CCCC3)C2)c(C)c1 ZINC000523556643 333332940 /nfs/dbraw/zinc/33/29/40/333332940.db2.gz GUYZODYYEQSFRV-SFHVURJKSA-N 1 3 286.463 3.530 20 0 CHADHO Cc1cc(C)c(C[N@H+]2CC[C@@H](CN3CCCC3)C2)c(C)c1 ZINC000523556643 333332941 /nfs/dbraw/zinc/33/29/41/333332941.db2.gz GUYZODYYEQSFRV-SFHVURJKSA-N 1 3 286.463 3.530 20 0 CHADHO CCN(CC)C[C@H]1CC[N@H+](Cc2c(C)cc(C)cc2C)C1 ZINC000524766771 333387436 /nfs/dbraw/zinc/38/74/36/333387436.db2.gz BHNCKHNDSJETJZ-GOSISDBHSA-N 1 3 288.479 3.776 20 0 CHADHO CCN(CC)C[C@H]1CC[N@@H+](Cc2c(C)cc(C)cc2C)C1 ZINC000524766771 333387438 /nfs/dbraw/zinc/38/74/38/333387438.db2.gz BHNCKHNDSJETJZ-GOSISDBHSA-N 1 3 288.479 3.776 20 0 CHADHO CCC[C@@H](CC)[NH2+][C@@H](C)c1ccc(OCCN(C)C)cc1 ZINC000537989713 333569473 /nfs/dbraw/zinc/56/94/73/333569473.db2.gz CMHFBZQTNQOWPF-DOTOQJQBSA-N 1 3 292.467 3.856 20 0 CHADHO Cc1ccsc1[C@H](C)NCC1(C[NH+](C)C)CCCC1 ZINC000546932500 334055651 /nfs/dbraw/zinc/05/56/51/334055651.db2.gz LCSDVFKPDDZQQT-AWEZNQCLSA-N 1 3 280.481 3.829 20 0 CHADHO C[C@@H]1CC[N@H+](CCCN2CCCCC2)[C@H]2CCCC[C@H]12 ZINC000547737600 334113312 /nfs/dbraw/zinc/11/33/12/334113312.db2.gz ZZKPMJSVJIYBRL-KURKYZTESA-N 1 3 278.484 3.763 20 0 CHADHO C[C@@H]1CC[N@@H+](CCCN2CCCCC2)[C@H]2CCCC[C@H]12 ZINC000547737600 334113313 /nfs/dbraw/zinc/11/33/13/334113313.db2.gz ZZKPMJSVJIYBRL-KURKYZTESA-N 1 3 278.484 3.763 20 0 CHADHO C[C@@H](NCCC1CC[NH+](C)CC1)c1ccccc1Cl ZINC000135733090 334137372 /nfs/dbraw/zinc/13/73/72/334137372.db2.gz OBGOGUPMNLWQKK-CYBMUJFWSA-N 1 3 280.843 3.723 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@H]2NC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000245508008 334198568 /nfs/dbraw/zinc/19/85/68/334198568.db2.gz QZTORFPEBDFYCF-IIDMSEBBSA-N 1 3 284.447 3.617 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@H]2NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000245508008 334198569 /nfs/dbraw/zinc/19/85/69/334198569.db2.gz QZTORFPEBDFYCF-IIDMSEBBSA-N 1 3 284.447 3.617 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H](c2ccc(C)cc2)C2CC2)C1 ZINC000245939249 334224893 /nfs/dbraw/zinc/22/48/93/334224893.db2.gz ANOQLZNYPUDACM-VQIMIIECSA-N 1 3 286.463 3.768 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H](c2ccc(C)cc2)C2CC2)C1 ZINC000245939249 334224894 /nfs/dbraw/zinc/22/48/94/334224894.db2.gz ANOQLZNYPUDACM-VQIMIIECSA-N 1 3 286.463 3.768 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](c2ccc(C)cc2)C2CC2)C1 ZINC000245939249 334224895 /nfs/dbraw/zinc/22/48/95/334224895.db2.gz ANOQLZNYPUDACM-VQIMIIECSA-N 1 3 286.463 3.768 20 0 CHADHO CC1=CC[C@@H]([NH2+]CCCN(C)C2CCCCC2)CC1 ZINC000550884993 334231760 /nfs/dbraw/zinc/23/17/60/334231760.db2.gz APIHUBQBSXHWGQ-MRXNPFEDSA-N 1 3 264.457 3.729 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H]2CC[C@@H](C)c3ccccc32)C1 ZINC000246860088 334270852 /nfs/dbraw/zinc/27/08/52/334270852.db2.gz CZHKJGQBPMDUEL-RKVPGOIHSA-N 1 3 272.436 3.556 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H]2CC[C@@H](C)c3ccccc32)C1 ZINC000246860088 334270853 /nfs/dbraw/zinc/27/08/53/334270853.db2.gz CZHKJGQBPMDUEL-RKVPGOIHSA-N 1 3 272.436 3.556 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H]2CC[C@@H](C)c3ccccc32)C1 ZINC000246860088 334270854 /nfs/dbraw/zinc/27/08/54/334270854.db2.gz CZHKJGQBPMDUEL-RKVPGOIHSA-N 1 3 272.436 3.556 20 0 CHADHO CC[C@H](c1ccccc1)[N@@H+]1CC[C@@H]2[C@@H](CCCN2C)C1 ZINC000247975894 334292768 /nfs/dbraw/zinc/29/27/68/334292768.db2.gz HUYHVOSHDQWKSS-RCCFBDPRSA-N 1 3 272.436 3.554 20 0 CHADHO CC[C@H](c1ccccc1)[N@H+]1CC[C@@H]2[C@@H](CCCN2C)C1 ZINC000247975894 334292770 /nfs/dbraw/zinc/29/27/70/334292770.db2.gz HUYHVOSHDQWKSS-RCCFBDPRSA-N 1 3 272.436 3.554 20 0 CHADHO C[C@@H]1CC[C@H](NC[C@H]2CCC[N@H+](C)C2)c2ccccc21 ZINC000248168579 334296371 /nfs/dbraw/zinc/29/63/71/334296371.db2.gz UGEAZMBLOCARSM-RKVPGOIHSA-N 1 3 272.436 3.556 20 0 CHADHO C[C@@H]1CC[C@H](NC[C@H]2CCC[N@@H+](C)C2)c2ccccc21 ZINC000248168579 334296372 /nfs/dbraw/zinc/29/63/72/334296372.db2.gz UGEAZMBLOCARSM-RKVPGOIHSA-N 1 3 272.436 3.556 20 0 CHADHO C[C@@H]1CC[C@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc21 ZINC000249059463 334326156 /nfs/dbraw/zinc/32/61/56/334326156.db2.gz ZQCLAHPYVPZRTG-RPZWUGTHSA-N 1 3 284.447 3.840 20 0 CHADHO C[C@@H]1CC[C@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc21 ZINC000249059463 334326158 /nfs/dbraw/zinc/32/61/58/334326158.db2.gz ZQCLAHPYVPZRTG-RPZWUGTHSA-N 1 3 284.447 3.840 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](C)c2ccc3ccccc3c2)C1 ZINC000249382730 334332923 /nfs/dbraw/zinc/33/29/23/334332923.db2.gz UIGCVVUXCZETGX-CVEARBPZSA-N 1 3 282.431 3.832 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](C)c2ccc3ccccc3c2)C1 ZINC000249382730 334332924 /nfs/dbraw/zinc/33/29/24/334332924.db2.gz UIGCVVUXCZETGX-CVEARBPZSA-N 1 3 282.431 3.832 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](C)c2ccc3ccccc3c2)C1 ZINC000249382730 334332925 /nfs/dbraw/zinc/33/29/25/334332925.db2.gz UIGCVVUXCZETGX-CVEARBPZSA-N 1 3 282.431 3.832 20 0 CHADHO CC(C)[C@H](N[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000251268338 334359170 /nfs/dbraw/zinc/35/91/70/334359170.db2.gz BGPAQWZNTRRHPU-SQNIBIBYSA-N 1 3 272.436 3.600 20 0 CHADHO CC(C)[C@H](N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000251268338 334359174 /nfs/dbraw/zinc/35/91/74/334359174.db2.gz BGPAQWZNTRRHPU-SQNIBIBYSA-N 1 3 272.436 3.600 20 0 CHADHO CC[C@@H]1CCC[C@@H]([NH2+]C[C@H](C)CN2CCCCC2)C1 ZINC000251591448 334365075 /nfs/dbraw/zinc/36/50/75/334365075.db2.gz CRDZSNLARXSBRT-GVDBMIGSSA-N 1 3 266.473 3.667 20 0 CHADHO CC[C@@H]1CCC[C@H]([NH2+]CCCN2CCCC[C@H]2C)C1 ZINC000251631852 334365877 /nfs/dbraw/zinc/36/58/77/334365877.db2.gz FMXDZQUFTILFQK-ZACQAIPSSA-N 1 3 266.473 3.809 20 0 CHADHO C[NH+](C)Cc1cccc(CN[C@@H](c2ccccc2)C2CC2)c1 ZINC000091281248 334374983 /nfs/dbraw/zinc/37/49/83/334374983.db2.gz SUDKCSFAJYFWMV-FQEVSTJZSA-N 1 3 294.442 3.989 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H](c2ccccc2)C(C)C)C1 ZINC000091305979 334376054 /nfs/dbraw/zinc/37/60/54/334376054.db2.gz KOWXAGZKQLBOGK-SJLPKXTDSA-N 1 3 274.452 3.705 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H](c2ccccc2)C(C)C)C1 ZINC000091305979 334376056 /nfs/dbraw/zinc/37/60/56/334376056.db2.gz KOWXAGZKQLBOGK-SJLPKXTDSA-N 1 3 274.452 3.705 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H](c2ccccc2)C(C)C)C1 ZINC000091305979 334376058 /nfs/dbraw/zinc/37/60/58/334376058.db2.gz KOWXAGZKQLBOGK-SJLPKXTDSA-N 1 3 274.452 3.705 20 0 CHADHO C[C@H](Cc1cccs1)N[C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000252658073 334384316 /nfs/dbraw/zinc/38/43/16/334384316.db2.gz RSZITHBBFVYVFR-RRFJBIMHSA-N 1 3 280.481 3.580 20 0 CHADHO CC(C)SCCNC1CC[NH+]([C@@H]2CCCC[C@@H]2C)CC1 ZINC000554371289 334425384 /nfs/dbraw/zinc/42/53/84/334425384.db2.gz KPZALWSNXNXCQM-DOTOQJQBSA-N 1 3 298.540 3.761 20 0 CHADHO [NH3+]Cc1ccc(CN[C@@H]2CCc3c2cccc3Cl)cc1 ZINC000564988658 334532850 /nfs/dbraw/zinc/53/28/50/334532850.db2.gz MPTSMLSBWDLGLZ-QGZVFWFLSA-N 1 3 286.806 3.576 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000576907764 335262794 /nfs/dbraw/zinc/26/27/94/335262794.db2.gz PMDLPKKTKMKIQQ-BHIYHBOVSA-N 1 3 286.463 3.643 20 0 CHADHO CC(C)(CN[C@H]1CCC[C@@H]([NH3+])C1)c1c(F)cccc1Cl ZINC000577509563 335362487 /nfs/dbraw/zinc/36/24/87/335362487.db2.gz DWFUQINGENTZJR-NEPJUHHUSA-N 1 3 298.833 3.616 20 0 CHADHO CCC[C@H](CC)[NH2+][C@@H](C)c1cccc(OCCN(C)C)c1 ZINC000581268169 336034934 /nfs/dbraw/zinc/03/49/34/336034934.db2.gz SZZVLNWGEQFYRX-RDJZCZTQSA-N 1 3 292.467 3.856 20 0 CHADHO Cc1cc([C@@H](C)[NH2+]C[C@@H](C)CN2CCCCC2)cs1 ZINC000381358969 336060145 /nfs/dbraw/zinc/06/01/45/336060145.db2.gz JVQQHNWSMZDFAK-UKRRQHHQSA-N 1 3 280.481 3.829 20 0 CHADHO CC(C)Oc1ccc([C@H](C)N[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000130123133 519781945 /nfs/dbraw/zinc/78/19/45/519781945.db2.gz MIIDCWDURZPSBY-ZOBUZTSGSA-N 1 3 290.451 3.607 20 0 CHADHO CC(C)Oc1ccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000130123133 519781946 /nfs/dbraw/zinc/78/19/46/519781946.db2.gz MIIDCWDURZPSBY-ZOBUZTSGSA-N 1 3 290.451 3.607 20 0 CHADHO CC(C)Oc1cccc([C@H](C)N[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC000130111670 519783766 /nfs/dbraw/zinc/78/37/66/519783766.db2.gz KNMSIVAUNCBAMG-ZOBUZTSGSA-N 1 3 290.451 3.607 20 0 CHADHO CC(C)Oc1cccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC000130111670 519783767 /nfs/dbraw/zinc/78/37/67/519783767.db2.gz KNMSIVAUNCBAMG-ZOBUZTSGSA-N 1 3 290.451 3.607 20 0 CHADHO CCSc1cccc(CN(C)[C@@H]2CC[N@H+](C)C[C@@H]2C)c1 ZINC000290354471 521758054 /nfs/dbraw/zinc/75/80/54/521758054.db2.gz GIAODDJZMFAWTG-WMLDXEAASA-N 1 3 292.492 3.571 20 0 CHADHO CCSc1cccc(CN(C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)c1 ZINC000290354471 521758064 /nfs/dbraw/zinc/75/80/64/521758064.db2.gz GIAODDJZMFAWTG-WMLDXEAASA-N 1 3 292.492 3.571 20 0 CHADHO CC[C@@H]1CCCC[C@H]1[NH2+]C1CCN(c2ccncc2)CC1 ZINC000037031395 523222004 /nfs/dbraw/zinc/22/20/04/523222004.db2.gz YJGGPEJQJPMQCQ-CRAIPNDOSA-N 1 3 287.451 3.609 20 0 CHADHO Cc1ccccc1[C@H](C)[NH2+]C1CCN(c2ccncc2)CC1 ZINC000298515465 525414337 /nfs/dbraw/zinc/41/43/37/525414337.db2.gz REBOTWVOLXBINB-INIZCTEOSA-N 1 3 295.430 3.710 20 0 CHADHO N[C@@H]1C[C@H]([NH2+]CCSc2ccccc2)c2ccccc21 ZINC000157409386 527377413 /nfs/dbraw/zinc/37/74/13/527377413.db2.gz HZWZQBFQCFIVST-SJORKVTESA-N 1 3 284.428 3.513 20 0 CHADHO N[C@H]1C[C@H]([NH2+]CCSc2ccccc2)c2ccccc21 ZINC000157409103 527418919 /nfs/dbraw/zinc/41/89/19/527418919.db2.gz HZWZQBFQCFIVST-IRXDYDNUSA-N 1 3 284.428 3.513 20 0 CHADHO [NH3+][C@H]1C[C@H](NC2CCC(C(F)(F)F)CC2)c2ccccc21 ZINC000157357305 527419351 /nfs/dbraw/zinc/41/93/51/527419351.db2.gz WWXYPTORGMWHKU-HBGGEXNNSA-N 1 3 298.352 3.842 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@H](CC)c2cccc(C)c2)C1 ZINC000353525333 528254306 /nfs/dbraw/zinc/25/43/06/528254306.db2.gz YINCEHORGCMJOV-FUHWJXTLSA-N 1 3 274.452 3.768 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@H](CC)c2cccc(C)c2)C1 ZINC000353525333 528254310 /nfs/dbraw/zinc/25/43/10/528254310.db2.gz YINCEHORGCMJOV-FUHWJXTLSA-N 1 3 274.452 3.768 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](CC)c2cccc(C)c2)C1 ZINC000353525333 528254312 /nfs/dbraw/zinc/25/43/12/528254312.db2.gz YINCEHORGCMJOV-FUHWJXTLSA-N 1 3 274.452 3.768 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000685455661 1119611075 /nfs/dbraw/zinc/61/10/75/1119611075.db2.gz DYEPLTZXKGRUAL-YESZJQIVSA-N 1 3 268.489 3.767 20 0 CHADHO FC(F)(F)CCCCN1CCC(C[NH+]2CCCC2)CC1 ZINC000132365062 1125501746 /nfs/dbraw/zinc/50/17/46/1125501746.db2.gz RUUMZAOQZOUMIL-UHFFFAOYSA-N 1 3 292.389 3.527 20 0 CHADHO C[C@H]([NH2+]CCCN1CCCC[C@H]1C)C(C)(C)C(F)F ZINC000657824546 1120533240 /nfs/dbraw/zinc/53/32/40/1120533240.db2.gz UOCTXSGOHRWBDX-OLZOCXBDSA-N 1 3 276.415 3.520 20 0 CHADHO CCN(CC)C[C@H]1CC[N@H+](C[C@H]2CCCC(C)(C)C2)C1 ZINC001180058434 1121944070 /nfs/dbraw/zinc/94/40/70/1121944070.db2.gz RACNMFAEOHRJDP-DLBZAZTESA-N 1 3 280.500 3.867 20 0 CHADHO CCN(CC)C[C@H]1CC[N@@H+](C[C@H]2CCCC(C)(C)C2)C1 ZINC001180058434 1121944076 /nfs/dbraw/zinc/94/40/76/1121944076.db2.gz RACNMFAEOHRJDP-DLBZAZTESA-N 1 3 280.500 3.867 20 0 CHADHO C[C@H]1C[C@H]([NH3+])CCN1CCCSc1ccccc1Cl ZINC000516659731 1122618933 /nfs/dbraw/zinc/61/89/33/1122618933.db2.gz CJCANLLJGJSKOZ-QWHCGFSZSA-N 1 3 298.883 3.634 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](C)C2CCC(F)(F)CC2)C1 ZINC000474085265 1123423827 /nfs/dbraw/zinc/42/38/27/1123423827.db2.gz WTRABZBSVGHHEQ-KGLIPLIRSA-N 1 3 288.426 3.522 20 0 CHADHO Cc1ccc(CC[NH2+]C2CC(C)(C)N(C)C(C)(C)C2)s1 ZINC001171619062 1132065716 /nfs/dbraw/zinc/06/57/16/1132065716.db2.gz GFMVYECPPLMHPN-UHFFFAOYSA-N 1 3 294.508 3.840 20 0 CHADHO CC[C@@H](CC(C)C)[NH+]1C(C)(C)CC(N)CC1(C)C ZINC001172390366 1132215263 /nfs/dbraw/zinc/21/52/63/1132215263.db2.gz UYNFVAXNEQLLAO-AWEZNQCLSA-N 1 3 254.462 3.791 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+](C[C@@H]2CCCC(C)(C)C2)C1 ZINC001204161893 1133411764 /nfs/dbraw/zinc/41/17/64/1133411764.db2.gz HNAMINCQACIZNO-SJORKVTESA-N 1 3 280.500 3.867 20 0 CHADHO CSc1cc(C)ccc1C[NH2+][C@H]1C[C@@H](C)N(C)C[C@@H]1C ZINC000119274557 1125530992 /nfs/dbraw/zinc/53/09/92/1125530992.db2.gz LLDZLMIAFUHIBP-LZWOXQAQSA-N 1 3 292.492 3.535 20 0 CHADHO Cc1ccncc1[C@@H](C)N[C@H](C)c1cccc(C[NH+](C)C)c1 ZINC000925292105 1125614969 /nfs/dbraw/zinc/61/49/69/1125614969.db2.gz FBKMQIBLFAYVRA-HZPDHXFCSA-N 1 3 297.446 3.863 20 0 CHADHO Cc1ccc([C@H](C)NCCCC[N@@H+]2CCC[C@@H](C)C2)o1 ZINC000246893776 1125649827 /nfs/dbraw/zinc/64/98/27/1125649827.db2.gz FMYMWMCDGNEQMZ-ZBFHGGJFSA-N 1 3 278.440 3.751 20 0 CHADHO Cc1ccc([C@H](C)NCCCC[N@H+]2CCC[C@@H](C)C2)o1 ZINC000246893776 1125649833 /nfs/dbraw/zinc/64/98/33/1125649833.db2.gz FMYMWMCDGNEQMZ-ZBFHGGJFSA-N 1 3 278.440 3.751 20 0 CHADHO CCN(CCCCCC[NH3+])Cc1ccccc1Cl ZINC000138542676 1125702977 /nfs/dbraw/zinc/70/29/77/1125702977.db2.gz UGVILZOVNCHOAM-UHFFFAOYSA-N 1 3 268.832 3.681 20 0 CHADHO CCc1ccc([C@H](N[C@H]2CC[NH2+]C[C@@H]2C)C(C)C)cc1 ZINC000261734476 1125741236 /nfs/dbraw/zinc/74/12/36/1125741236.db2.gz LKSXSNNRUOBIRR-JCGIZDLHSA-N 1 3 274.452 3.534 20 0 CHADHO CCc1ccc([C@H]([NH2+][C@H]2CCNC[C@@H]2C)C(C)C)cc1 ZINC000261734476 1125741240 /nfs/dbraw/zinc/74/12/40/1125741240.db2.gz LKSXSNNRUOBIRR-JCGIZDLHSA-N 1 3 274.452 3.534 20 0 CHADHO CCSc1ccc([C@@H](C)[NH2+]C[C@H]2CCN(CC)C2)cc1 ZINC000533785289 1125781735 /nfs/dbraw/zinc/78/17/35/1125781735.db2.gz RBHPTSYPZMIXRX-HUUCEWRRSA-N 1 3 292.492 3.791 20 0 CHADHO C[C@H](N[C@H]1CC12CC[NH2+]CC2)c1cccc(Cl)c1Cl ZINC000643533725 1129444666 /nfs/dbraw/zinc/44/46/66/1129444666.db2.gz CHCQZFIMSJLCCC-GWCFXTLKSA-N 1 3 299.245 3.786 20 0 CHADHO CC(C)C[C@H](Cc1ccccc1)[N@H+](CCCN)C(C)C ZINC001169049950 1129692174 /nfs/dbraw/zinc/69/21/74/1129692174.db2.gz MFGIHVGOBWEVHK-GOSISDBHSA-N 1 3 276.468 3.703 20 0 CHADHO CC(C)C[C@H](Cc1ccccc1)[N@@H+](CCCN)C(C)C ZINC001169049950 1129692177 /nfs/dbraw/zinc/69/21/77/1129692177.db2.gz MFGIHVGOBWEVHK-GOSISDBHSA-N 1 3 276.468 3.703 20 0 CHADHO Cc1cc2[nH]c(C[N@@H+](C)C[C@@H]3CCCN(C)C3)cc2c(C)c1 ZINC000481905876 1126733405 /nfs/dbraw/zinc/73/34/05/1126733405.db2.gz BFIQJZRYJFCSOT-MRXNPFEDSA-N 1 3 299.462 3.558 20 0 CHADHO Cc1cc2[nH]c(C[N@H+](C)C[C@@H]3CCCN(C)C3)cc2c(C)c1 ZINC000481905876 1126733410 /nfs/dbraw/zinc/73/34/10/1126733410.db2.gz BFIQJZRYJFCSOT-MRXNPFEDSA-N 1 3 299.462 3.558 20 0 CHADHO Cc1ccccc1[C@H](C)N1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000483222078 1126773414 /nfs/dbraw/zinc/77/34/14/1126773414.db2.gz SRAAAHIHCBFWPP-WMZOPIPTSA-N 1 3 286.463 3.720 20 0 CHADHO Cc1ccccc1[C@H](C)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000483222078 1126773417 /nfs/dbraw/zinc/77/34/17/1126773417.db2.gz SRAAAHIHCBFWPP-WMZOPIPTSA-N 1 3 286.463 3.720 20 0 CHADHO C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000484480420 1126821327 /nfs/dbraw/zinc/82/13/27/1126821327.db2.gz NPVIXUSVKAXUCB-HALQFCHDSA-N 1 3 290.426 3.521 20 0 CHADHO CCc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H](N(C)C)C2)s1 ZINC000484473660 1126820191 /nfs/dbraw/zinc/82/01/91/1126820191.db2.gz MVJFKIRBPXWDJB-MELADBBJSA-N 1 3 280.481 3.834 20 0 CHADHO CCc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H](N(C)C)C2)s1 ZINC000484473662 1126820402 /nfs/dbraw/zinc/82/04/02/1126820402.db2.gz MVJFKIRBPXWDJB-MJBXVCDLSA-N 1 3 280.481 3.834 20 0 CHADHO C[C@H]([NH2+]C1CCN(CC2CC2)CC1)c1ccc(Cl)cc1 ZINC000268734997 1127021559 /nfs/dbraw/zinc/02/15/59/1127021559.db2.gz VMPSEMPRVUDKBW-ZDUSSCGKSA-N 1 3 292.854 3.865 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@@H]2N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000349806004 1127161561 /nfs/dbraw/zinc/16/15/61/1127161561.db2.gz XINAOCNJDDSVBN-LMMKCTJWSA-N 1 3 298.474 3.897 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@@H]2N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000349806004 1127161565 /nfs/dbraw/zinc/16/15/65/1127161565.db2.gz XINAOCNJDDSVBN-LMMKCTJWSA-N 1 3 298.474 3.897 20 0 CHADHO C[C@H]1CC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000571629150 1127162919 /nfs/dbraw/zinc/16/29/19/1127162919.db2.gz HRBWURZRRWEPIW-WKILWMFISA-N 1 3 278.484 3.952 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+](C)C(C)C)cc21 ZINC001237881798 1131148568 /nfs/dbraw/zinc/14/85/68/1131148568.db2.gz VJIULLDOAGWNII-UHFFFAOYSA-N 1 3 258.409 3.528 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+](C)C(C)C)cc21 ZINC001237881798 1131148570 /nfs/dbraw/zinc/14/85/70/1131148570.db2.gz VJIULLDOAGWNII-UHFFFAOYSA-N 1 3 258.409 3.528 20 0 CHADHO CN1CCC[C@H]1CC[N@@H+]1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000646117954 1127301996 /nfs/dbraw/zinc/30/19/96/1127301996.db2.gz BUEOROLNWVHFFY-OALUTQOASA-N 1 3 296.458 3.864 20 0 CHADHO CN1CCC[C@H]1CC[N@H+]1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000646117954 1127301999 /nfs/dbraw/zinc/30/19/99/1127301999.db2.gz BUEOROLNWVHFFY-OALUTQOASA-N 1 3 296.458 3.864 20 0 CHADHO CCCN1CCC([N@H+](C)Cc2ccccc2SC)CC1 ZINC000358042054 1127398360 /nfs/dbraw/zinc/39/83/60/1127398360.db2.gz YOMQQHJBXCDEKE-UHFFFAOYSA-N 1 3 292.492 3.715 20 0 CHADHO CCCN1CCC([N@@H+](C)Cc2ccccc2SC)CC1 ZINC000358042054 1127398364 /nfs/dbraw/zinc/39/83/64/1127398364.db2.gz YOMQQHJBXCDEKE-UHFFFAOYSA-N 1 3 292.492 3.715 20 0 CHADHO C[C@H](c1ccc(F)c(Cl)c1)N1CCC2(C1)CC[NH2+]CC2 ZINC000358517959 1127425370 /nfs/dbraw/zinc/42/53/70/1127425370.db2.gz QOUMHVLGCYLKIY-GFCCVEGCSA-N 1 3 296.817 3.616 20 0 CHADHO C[C@H]([NH2+]CCC(C)(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000295584909 1127646956 /nfs/dbraw/zinc/64/69/56/1127646956.db2.gz BQONSQKKPWLTJH-GOEBONIOSA-N 1 3 296.405 3.532 20 0 CHADHO Cc1ccccc1C1CC(NC2CC([NH+]3CCCCC3)C2)C1 ZINC000373468791 1127845246 /nfs/dbraw/zinc/84/52/46/1127845246.db2.gz WNHPCEUWRXRCNF-UHFFFAOYSA-N 1 3 298.474 3.848 20 0 CHADHO CC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCCN(CC(C)C)C1 ZINC000540147245 1127963428 /nfs/dbraw/zinc/96/34/28/1127963428.db2.gz HUZCLOZOELOZCM-ZACQAIPSSA-N 1 3 266.473 3.523 20 0 CHADHO CCc1ccc([C@@H]([NH2+]C[C@@H]2CCN(CC)C2)C(C)C)cc1 ZINC000540259193 1127971869 /nfs/dbraw/zinc/97/18/69/1127971869.db2.gz ONPUGBHIWUKNPA-HKUYNNGSSA-N 1 3 288.479 3.878 20 0 CHADHO C[C@@H](CCN(C)CCC[NH+]1CCCC1)c1ccccc1 ZINC000467517045 1127972416 /nfs/dbraw/zinc/97/24/16/1127972416.db2.gz RJVFGOHFCJHJBT-KRWDZBQOSA-N 1 3 274.452 3.598 20 0 CHADHO CC(C)[C@H]([NH2+]CC1=CCN(C)CC1)c1cc2ccccc2o1 ZINC000540656454 1127988123 /nfs/dbraw/zinc/98/81/23/1127988123.db2.gz NZJPPQMFARSXCB-IBGZPJMESA-N 1 3 298.430 3.981 20 0 CHADHO CCC[NH+]1CCC(N[C@@H](C)c2c(C)cccc2C)CC1 ZINC000545519713 1128018268 /nfs/dbraw/zinc/01/82/68/1128018268.db2.gz MCAPEGOBFMHIER-INIZCTEOSA-N 1 3 274.452 3.828 20 0 CHADHO CC(C)c1ccc(CCN(C)C[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000468950550 1128029334 /nfs/dbraw/zinc/02/93/34/1128029334.db2.gz KAKFWOSEBWMMGD-GOSISDBHSA-N 1 3 288.479 3.626 20 0 CHADHO CC(C)c1ccc(CCN(C)C[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000468950550 1128029338 /nfs/dbraw/zinc/02/93/38/1128029338.db2.gz KAKFWOSEBWMMGD-GOSISDBHSA-N 1 3 288.479 3.626 20 0 CHADHO Cc1ccccc1[C@H](C(C)C)[N@H+](C)C[C@H]1CCCNC1 ZINC000469972478 1128060699 /nfs/dbraw/zinc/06/06/99/1128060699.db2.gz LKHPRDWKOCQIHE-WMZOPIPTSA-N 1 3 274.452 3.624 20 0 CHADHO Cc1ccccc1[C@H](C(C)C)[N@@H+](C)C[C@H]1CCCNC1 ZINC000469972478 1128060701 /nfs/dbraw/zinc/06/07/01/1128060701.db2.gz LKHPRDWKOCQIHE-WMZOPIPTSA-N 1 3 274.452 3.624 20 0 CHADHO Cc1ccccc1-c1cccc(CN2CC[C@@H]([NH3+])[C@H](C)C2)c1 ZINC000469991652 1128061862 /nfs/dbraw/zinc/06/18/62/1128061862.db2.gz NCGPMTWWBNVFAO-OXQOHEQNSA-N 1 3 294.442 3.831 20 0 CHADHO CC(C)c1ccc(CCN[C@@H]2CC[N@@H+]3CCCC[C@H]23)cc1 ZINC000470103641 1128063184 /nfs/dbraw/zinc/06/31/84/1128063184.db2.gz GXGBBELPGMIIQX-RTBURBONSA-N 1 3 286.463 3.569 20 0 CHADHO CC(C)c1ccc(CCN[C@@H]2CC[N@H+]3CCCC[C@H]23)cc1 ZINC000470103641 1128063187 /nfs/dbraw/zinc/06/31/87/1128063187.db2.gz GXGBBELPGMIIQX-RTBURBONSA-N 1 3 286.463 3.569 20 0 CHADHO CCCC[C@H](CC)CC[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000557097211 1128091276 /nfs/dbraw/zinc/09/12/76/1128091276.db2.gz JERUDVZUEWCMNY-DLBZAZTESA-N 1 3 268.489 3.913 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)c2csc3ccccc23)C1 ZINC000924707956 1128110738 /nfs/dbraw/zinc/11/07/38/1128110738.db2.gz WJJYADZWNDWKRL-UONOGXRCSA-N 1 3 288.460 3.894 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H](C)c2csc3ccccc23)C1 ZINC000924707956 1128110743 /nfs/dbraw/zinc/11/07/43/1128110743.db2.gz WJJYADZWNDWKRL-UONOGXRCSA-N 1 3 288.460 3.894 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H](C)c2csc3ccccc23)C1 ZINC000924707956 1128110745 /nfs/dbraw/zinc/11/07/45/1128110745.db2.gz WJJYADZWNDWKRL-UONOGXRCSA-N 1 3 288.460 3.894 20 0 CHADHO CC[C@@H]([NH2+]C1CCN(CCC(C)C)CC1)c1ccncc1 ZINC000925130017 1128122674 /nfs/dbraw/zinc/12/26/74/1128122674.db2.gz LQARZHYYUVSYOV-GOSISDBHSA-N 1 3 289.467 3.633 20 0 CHADHO COc1cc(C)ccc1CN[C@@H](CCC[NH3+])c1ccccc1 ZINC000925551911 1128131749 /nfs/dbraw/zinc/13/17/49/1128131749.db2.gz HXVFBYLWACMJPR-SFHVURJKSA-N 1 3 298.430 3.573 20 0 CHADHO CC(C)CCN1CCC([NH2+]CC(C)(C)C(F)(F)F)CC1 ZINC000926366990 1128169369 /nfs/dbraw/zinc/16/93/69/1128169369.db2.gz JKEOEUAQVSUVIN-UHFFFAOYSA-N 1 3 294.405 3.675 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1coc2ccccc12 ZINC000926753215 1128192234 /nfs/dbraw/zinc/19/22/34/1128192234.db2.gz LUYRHVYDJOSSHX-GJZGRUSLSA-N 1 3 286.419 3.815 20 0 CHADHO CC(C)c1ccc(C[C@H](C)C[N@@H+]2C[C@H](C)[C@H](CN)C2)cc1 ZINC001205131137 1128264577 /nfs/dbraw/zinc/26/45/77/1128264577.db2.gz RASJEDXCUZAZKJ-TXPKVOOTSA-N 1 3 288.479 3.515 20 0 CHADHO CC(C)c1ccc(C[C@H](C)C[N@H+]2C[C@H](C)[C@H](CN)C2)cc1 ZINC001205131137 1128264581 /nfs/dbraw/zinc/26/45/81/1128264581.db2.gz RASJEDXCUZAZKJ-TXPKVOOTSA-N 1 3 288.479 3.515 20 0 CHADHO CCC[C@H](C)[NH2+]C1CCN(C[C@H]2CC=CCC2)CC1 ZINC001257314675 1128232181 /nfs/dbraw/zinc/23/21/81/1128232181.db2.gz OJSQUJXYPYGUBS-HOTGVXAUSA-N 1 3 264.457 3.585 20 0 CHADHO C[C@H]1C[C@H](C)CN(CCC[NH2+]C2CCCCCC2)C1 ZINC000559870895 1128238737 /nfs/dbraw/zinc/23/87/37/1128238737.db2.gz PBUDEJHUWUSNGQ-HOTGVXAUSA-N 1 3 266.473 3.667 20 0 CHADHO CN(C[C@H]1CCC[N@H+](C)C1)[C@@H]1CCc2cc(Cl)ccc21 ZINC000777783646 1128274320 /nfs/dbraw/zinc/27/43/20/1128274320.db2.gz CUHYLOYFMZSWRV-SUMWQHHRSA-N 1 3 292.854 3.601 20 0 CHADHO CN(C[C@H]1CCC[N@@H+](C)C1)[C@@H]1CCc2cc(Cl)ccc21 ZINC000777783646 1128274322 /nfs/dbraw/zinc/27/43/22/1128274322.db2.gz CUHYLOYFMZSWRV-SUMWQHHRSA-N 1 3 292.854 3.601 20 0 CHADHO C[C@H](Cc1cccc(Cl)c1)[NH2+][C@H]1CCC[C@@H](N(C)C)C1 ZINC000715276147 1128360343 /nfs/dbraw/zinc/36/03/43/1128360343.db2.gz JNFCANDPLGOWJO-XOKHGSTOSA-N 1 3 294.870 3.733 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]C[C@@H]2CCCC[C@H]2C)C1 ZINC001649175992 1128404565 /nfs/dbraw/zinc/40/45/65/1128404565.db2.gz SYKFQDQYBBGOPE-ZACQAIPSSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@@H](CC[N@@H+]1CCC[C@H](N(C)C)CC1)c1ccccc1 ZINC000562580091 1128411756 /nfs/dbraw/zinc/41/17/56/1128411756.db2.gz TWMMKOBAVNNLQG-WMZOPIPTSA-N 1 3 274.452 3.596 20 0 CHADHO C[C@@H](CC[N@H+]1CCC[C@H](N(C)C)CC1)c1ccccc1 ZINC000562580091 1128411759 /nfs/dbraw/zinc/41/17/59/1128411759.db2.gz TWMMKOBAVNNLQG-WMZOPIPTSA-N 1 3 274.452 3.596 20 0 CHADHO Cc1ccc([C@H](NC2CC[NH+](C(C)C)CC2)C2CC2)cc1 ZINC000037236727 1128425310 /nfs/dbraw/zinc/42/53/10/1128425310.db2.gz AAUUAXDSSNLEKX-IBGZPJMESA-N 1 3 286.463 3.909 20 0 CHADHO C[C@@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccc2c(c1)CCCC2 ZINC000124359339 1128443827 /nfs/dbraw/zinc/44/38/27/1128443827.db2.gz FZQQOLQUSGVXGG-HZPDHXFCSA-N 1 3 298.474 3.700 20 0 CHADHO C[C@@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc2c(c1)CCCC2 ZINC000124359339 1128443830 /nfs/dbraw/zinc/44/38/30/1128443830.db2.gz FZQQOLQUSGVXGG-HZPDHXFCSA-N 1 3 298.474 3.700 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H](C)c2ccc(C(C)(C)C)cc2)C1 ZINC000037644115 1128433478 /nfs/dbraw/zinc/43/34/78/1128433478.db2.gz RENKKHDIGMNJHX-JKSUJKDBSA-N 1 3 288.479 3.977 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H](C)c2ccc(C(C)(C)C)cc2)C1 ZINC000037644115 1128433479 /nfs/dbraw/zinc/43/34/79/1128433479.db2.gz RENKKHDIGMNJHX-JKSUJKDBSA-N 1 3 288.479 3.977 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)c2ccc(C(C)(C)C)cc2)C1 ZINC000037644115 1128433482 /nfs/dbraw/zinc/43/34/82/1128433482.db2.gz RENKKHDIGMNJHX-JKSUJKDBSA-N 1 3 288.479 3.977 20 0 CHADHO Cc1ccc([C@@H](C)NC[C@H](C)C[NH+]2CCCC2)c(C)c1 ZINC000062077946 1128436104 /nfs/dbraw/zinc/43/61/04/1128436104.db2.gz JQDRJODACDCIPH-DOTOQJQBSA-N 1 3 274.452 3.686 20 0 CHADHO CC(C)[C@@H](NC[C@H](C)C[NH+]1CCCC1)c1ccccc1 ZINC000062078839 1128437496 /nfs/dbraw/zinc/43/74/96/1128437496.db2.gz NZARNNYHUSSJMF-FUHWJXTLSA-N 1 3 274.452 3.705 20 0 CHADHO CC(C)[C@@H]([NH2+]C[C@H](C)CN1CCCC1)c1ccccc1 ZINC000062078839 1128437498 /nfs/dbraw/zinc/43/74/98/1128437498.db2.gz NZARNNYHUSSJMF-FUHWJXTLSA-N 1 3 274.452 3.705 20 0 CHADHO Cc1cccc([C@@H](C)[NH2+]C[C@H]2CCCN(C(C)C)C2)c1 ZINC000125983249 1128459503 /nfs/dbraw/zinc/45/95/03/1128459503.db2.gz MASLQLBBWFPUHC-IAGOWNOFSA-N 1 3 274.452 3.766 20 0 CHADHO CCN1CC[C@@H](C[NH2+]Cc2ccccc2-c2ccccc2)C1 ZINC000917395365 1128497337 /nfs/dbraw/zinc/49/73/37/1128497337.db2.gz JGZTYVHKGQOJOZ-KRWDZBQOSA-N 1 3 294.442 3.785 20 0 CHADHO CC[N@@H+]1CC[C@@H](CNCc2ccccc2-c2ccccc2)C1 ZINC000917395365 1128497339 /nfs/dbraw/zinc/49/73/39/1128497339.db2.gz JGZTYVHKGQOJOZ-KRWDZBQOSA-N 1 3 294.442 3.785 20 0 CHADHO CC[N@H+]1CC[C@@H](CNCc2ccccc2-c2ccccc2)C1 ZINC000917395365 1128497341 /nfs/dbraw/zinc/49/73/41/1128497341.db2.gz JGZTYVHKGQOJOZ-KRWDZBQOSA-N 1 3 294.442 3.785 20 0 CHADHO Cc1cc([C@@H](C)[NH2+]C2CCN(CC3CC3)CC2)ccc1F ZINC000556173068 1128559810 /nfs/dbraw/zinc/55/98/10/1128559810.db2.gz DRBNRWMSRIWMOI-CQSZACIVSA-N 1 3 290.426 3.659 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCc2cc(F)ccc21)CN1CCCCC1 ZINC000129198889 1128534003 /nfs/dbraw/zinc/53/40/03/1128534003.db2.gz YNOWLPNZNQNLSS-KDOFPFPSSA-N 1 3 290.426 3.525 20 0 CHADHO C[C@H](N[C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000129775400 1128556603 /nfs/dbraw/zinc/55/66/03/1128556603.db2.gz HMAVMKMHARSIKG-YZVOILCLSA-N 1 3 286.463 3.699 20 0 CHADHO C[C@H](N[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000129775400 1128556606 /nfs/dbraw/zinc/55/66/06/1128556606.db2.gz HMAVMKMHARSIKG-YZVOILCLSA-N 1 3 286.463 3.699 20 0 CHADHO CC[N@H+](CCCN(C)C)Cc1cc2c(ccc(C)c2C)[nH]1 ZINC000568566416 1128587483 /nfs/dbraw/zinc/58/74/83/1128587483.db2.gz UHWOMOQRQZXLKF-UHFFFAOYSA-N 1 3 287.451 3.558 20 0 CHADHO CC[N@@H+](CCCN(C)C)Cc1cc2c(ccc(C)c2C)[nH]1 ZINC000568566416 1128587486 /nfs/dbraw/zinc/58/74/86/1128587486.db2.gz UHWOMOQRQZXLKF-UHFFFAOYSA-N 1 3 287.451 3.558 20 0 CHADHO CC1=CC[C@H]([NH2+][C@@H](C)[C@@H]2CCCN(C3CCC3)C2)CC1 ZINC000556833705 1128628394 /nfs/dbraw/zinc/62/83/94/1128628394.db2.gz JRNOJEPRZFYQFA-BBWFWOEESA-N 1 3 276.468 3.728 20 0 CHADHO CC(C)c1cccc(CN[C@@H]2CC[N@H+](C)[C@H]3CCC[C@@H]32)c1 ZINC000556889247 1128636275 /nfs/dbraw/zinc/63/62/75/1128636275.db2.gz AZCLFFAKYGIDNB-QRVBRYPASA-N 1 3 286.463 3.772 20 0 CHADHO CC(C)c1cccc(CN[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@@H]32)c1 ZINC000556889247 1128636276 /nfs/dbraw/zinc/63/62/76/1128636276.db2.gz AZCLFFAKYGIDNB-QRVBRYPASA-N 1 3 286.463 3.772 20 0 CHADHO CC(C)OC1CCC([NH2+]CCCN2CCCC[C@@H]2C)CC1 ZINC001257871787 1128659262 /nfs/dbraw/zinc/65/92/62/1128659262.db2.gz GDMPNAYSFHRPMV-AOCRQIFASA-N 1 3 296.499 3.577 20 0 CHADHO CC1=C[C@H](C)C[C@H](C[NH2+]C[C@@H]2CCCN(C(C)C)C2)C1 ZINC000578513867 1128720639 /nfs/dbraw/zinc/72/06/39/1128720639.db2.gz POSDZQTZSVWRDY-SZMVWBNQSA-N 1 3 278.484 3.689 20 0 CHADHO Cc1cccc(C[C@H]([NH2+][C@@H]2CCNC3(CCC3)C2)C2CC2)c1 ZINC000643546028 1117792907 /nfs/dbraw/zinc/79/29/07/1117792907.db2.gz HFMBKHICEVFQEO-MOPGFXCFSA-N 1 3 298.474 3.580 20 0 CHADHO CC1(C)[C@H]([NH2+][C@H]2CCNC3(CCC3)C2)C[C@@H]1c1ccccc1 ZINC000643547213 1117797274 /nfs/dbraw/zinc/79/72/74/1117797274.db2.gz BIBLCJNFWUCJID-RCCFBDPRSA-N 1 3 298.474 3.833 20 0 CHADHO C[C@@H](Cc1coc2ccccc12)[NH2+][C@@H]1CCNC2(CCC2)C1 ZINC000643548128 1117798375 /nfs/dbraw/zinc/79/83/75/1117798375.db2.gz MVDOYRHRNPNIOH-GOEBONIOSA-N 1 3 298.430 3.628 20 0 CHADHO C[C@@H](Cc1coc2ccccc12)N[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643548128 1117798377 /nfs/dbraw/zinc/79/83/77/1117798377.db2.gz MVDOYRHRNPNIOH-GOEBONIOSA-N 1 3 298.430 3.628 20 0 CHADHO CC[C@@H](N[C@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(C)cc1 ZINC000623337923 1117834816 /nfs/dbraw/zinc/83/48/16/1117834816.db2.gz BMBOSUDKQHVCCZ-DLBZAZTESA-N 1 3 274.452 3.909 20 0 CHADHO CC[C@@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(C)cc1 ZINC000623337923 1117834824 /nfs/dbraw/zinc/83/48/24/1117834824.db2.gz BMBOSUDKQHVCCZ-DLBZAZTESA-N 1 3 274.452 3.909 20 0 CHADHO C[N@@H+]1CC[C@@H](N[C@@H](c2cccs2)C2CC2)CC1(C)C ZINC000623345209 1117836940 /nfs/dbraw/zinc/83/69/40/1117836940.db2.gz WFGYCVLEQSXIGU-UKRRQHHQSA-N 1 3 278.465 3.662 20 0 CHADHO C[N@H+]1CC[C@@H](N[C@@H](c2cccs2)C2CC2)CC1(C)C ZINC000623345209 1117836946 /nfs/dbraw/zinc/83/69/46/1117836946.db2.gz WFGYCVLEQSXIGU-UKRRQHHQSA-N 1 3 278.465 3.662 20 0 CHADHO C[N@@H+]1CC[C@H](N[C@@H](c2cccs2)C2CC2)CC1(C)C ZINC000623345207 1117837632 /nfs/dbraw/zinc/83/76/32/1117837632.db2.gz WFGYCVLEQSXIGU-DZGCQCFKSA-N 1 3 278.465 3.662 20 0 CHADHO C[N@H+]1CC[C@H](N[C@@H](c2cccs2)C2CC2)CC1(C)C ZINC000623345207 1117837637 /nfs/dbraw/zinc/83/76/37/1117837637.db2.gz WFGYCVLEQSXIGU-DZGCQCFKSA-N 1 3 278.465 3.662 20 0 CHADHO Cc1ccc([C@@H](N[C@@H]2CC[N@@H+](C)C(C)(C)C2)C2CC2)cc1 ZINC000623352081 1117839408 /nfs/dbraw/zinc/83/94/08/1117839408.db2.gz ONQLTJKRLCQZEU-QZTJIDSGSA-N 1 3 286.463 3.909 20 0 CHADHO Cc1ccc([C@@H](N[C@@H]2CC[N@H+](C)C(C)(C)C2)C2CC2)cc1 ZINC000623352081 1117839414 /nfs/dbraw/zinc/83/94/14/1117839414.db2.gz ONQLTJKRLCQZEU-QZTJIDSGSA-N 1 3 286.463 3.909 20 0 CHADHO CC[NH+](CC)C1CCN(C[C@@H]2CCC(C)=C[C@H]2C)CC1 ZINC001208179450 1117857655 /nfs/dbraw/zinc/85/76/55/1117857655.db2.gz YHYSMMTUJWSMLF-SJORKVTESA-N 1 3 278.484 3.785 20 0 CHADHO Cc1ccc2c(c1)[C@@H](N[C@H]1CC[N@H+](C)C(C)(C)C1)[C@H](C)C2 ZINC000623571544 1117874692 /nfs/dbraw/zinc/87/46/92/1117874692.db2.gz ZXIOFKWAGGKQRN-HFTRVMKXSA-N 1 3 286.463 3.691 20 0 CHADHO Cc1ccc2c(c1)[C@@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)[C@H](C)C2 ZINC000623571544 1117874697 /nfs/dbraw/zinc/87/46/97/1117874697.db2.gz ZXIOFKWAGGKQRN-HFTRVMKXSA-N 1 3 286.463 3.691 20 0 CHADHO Cc1ccc(CC[C@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)cc1 ZINC000624120853 1117985689 /nfs/dbraw/zinc/98/56/89/1117985689.db2.gz IMCATEHOGOLJDT-HKUYNNGSSA-N 1 3 288.479 3.638 20 0 CHADHO C[C@H](NC[C@@H]1CCCC[N@H+](C)C1)c1cc2c(s1)CCC2 ZINC000624122590 1117985797 /nfs/dbraw/zinc/98/57/97/1117985797.db2.gz WKDLXZQFWUSMBR-KBPBESRZSA-N 1 3 292.492 3.619 20 0 CHADHO C[C@H](NC[C@@H]1CCCC[N@@H+](C)C1)c1cc2c(s1)CCC2 ZINC000624122590 1117985802 /nfs/dbraw/zinc/98/58/02/1117985802.db2.gz WKDLXZQFWUSMBR-KBPBESRZSA-N 1 3 292.492 3.619 20 0 CHADHO CC[C@@H](CCc1ccccc1)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000624124830 1117987258 /nfs/dbraw/zinc/98/72/58/1117987258.db2.gz LYBOPJUAEIFHEC-MOPGFXCFSA-N 1 3 288.479 3.719 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN(CCCc2ccc(C)cc2)C1 ZINC000181943588 1118010316 /nfs/dbraw/zinc/01/03/16/1118010316.db2.gz BNWVCFDFLXFDEN-IBGZPJMESA-N 1 3 288.479 3.591 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN(CCCc2ccc(C)cc2)C1 ZINC000181943588 1118010320 /nfs/dbraw/zinc/01/03/20/1118010320.db2.gz BNWVCFDFLXFDEN-IBGZPJMESA-N 1 3 288.479 3.591 20 0 CHADHO C[C@H]1CCC[C@H]([NH2+]C2CCN(C3CCCC3)CC2)CC1 ZINC000443215390 1118024800 /nfs/dbraw/zinc/02/48/00/1118024800.db2.gz XWOGIHNOROJHFD-HOTGVXAUSA-N 1 3 278.484 3.952 20 0 CHADHO Cc1ccc(C[NH2+]C2CCN(C(C)(C)C)CC2)c(C)c1 ZINC000037786415 1118039683 /nfs/dbraw/zinc/03/96/83/1118039683.db2.gz PQPSOPQOZDZLCO-UHFFFAOYSA-N 1 3 274.452 3.656 20 0 CHADHO C[C@@H](C[NH2+]C[C@@H](C)c1ccccc1)CN1CCCCC1 ZINC000037997573 1118066133 /nfs/dbraw/zinc/06/61/33/1118066133.db2.gz HAKFHFURGFSVKZ-DLBZAZTESA-N 1 3 274.452 3.502 20 0 CHADHO Cc1cc2c(c(C)c1)[C@H](NC1CC[NH+](CC3CC3)CC1)CC2 ZINC000655695173 1118187475 /nfs/dbraw/zinc/18/74/75/1118187475.db2.gz SOBVGBHEEBNIOL-LJQANCHMSA-N 1 3 298.474 3.755 20 0 CHADHO C[C@@H]1C[C@@H](N[C@@H]2CCCc3c(Cl)cccc32)CC[N@@H+]1C ZINC000542662801 1118195010 /nfs/dbraw/zinc/19/50/10/1118195010.db2.gz LLAXWOFCNRUDHE-IIYDPXPESA-N 1 3 292.854 3.790 20 0 CHADHO C[C@@H]1C[C@@H](N[C@@H]2CCCc3c(Cl)cccc32)CC[N@H+]1C ZINC000542662801 1118195015 /nfs/dbraw/zinc/19/50/15/1118195015.db2.gz LLAXWOFCNRUDHE-IIYDPXPESA-N 1 3 292.854 3.790 20 0 CHADHO Cc1ccc([C@H]([NH2+]CC(C)(C)CN(C)C)C2CCC2)o1 ZINC000542670699 1118238050 /nfs/dbraw/zinc/23/80/50/1118238050.db2.gz IYRQFUXNMPTIGO-MRXNPFEDSA-N 1 3 278.440 3.607 20 0 CHADHO C/C(=C/c1ccccc1)CN[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000255297789 1118411844 /nfs/dbraw/zinc/41/18/44/1118411844.db2.gz HDMXZCGSHWDWFU-MTLXSTRDSA-N 1 3 272.436 3.552 20 0 CHADHO C[C@@H]([NH3+])[C@H]1CCCN(Cc2ccc(-c3ccccc3)cc2)C1 ZINC000262001680 1118479295 /nfs/dbraw/zinc/47/92/95/1118479295.db2.gz VFWWKGCVSNQRGP-UZLBHIALSA-N 1 3 294.442 3.913 20 0 CHADHO CC[C@@H]1C[C@H]1CN1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC001167425613 1118485930 /nfs/dbraw/zinc/48/59/30/1118485930.db2.gz RQKFMOSXCYDLIM-TVFCKZIOSA-N 1 3 278.484 3.619 20 0 CHADHO CC[C@@H]1C[C@H]1CN1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC001167425613 1118485931 /nfs/dbraw/zinc/48/59/31/1118485931.db2.gz RQKFMOSXCYDLIM-TVFCKZIOSA-N 1 3 278.484 3.619 20 0 CHADHO CCC[C@H]([NH2+]C[C@H]1CCN(C(C)C)C1)C1CCCC1 ZINC000313413514 1118631546 /nfs/dbraw/zinc/63/15/46/1118631546.db2.gz QQHKJHNNJSATNL-WBVHZDCISA-N 1 3 266.473 3.665 20 0 CHADHO CCC[NH+]1CCC(N(C)Cc2c(C)cc(C)cc2C)CC1 ZINC000510467166 1118703432 /nfs/dbraw/zinc/70/34/32/1118703432.db2.gz HLPKHAWDZSRRPL-UHFFFAOYSA-N 1 3 288.479 3.918 20 0 CHADHO C[C@H]1C[C@@H]([NH3+])CCN1Cc1ccc(-c2ccccc2)cc1 ZINC000129021749 1118752641 /nfs/dbraw/zinc/75/26/41/1118752641.db2.gz ZEXOKJBPLQKHCH-KXBFYZLASA-N 1 3 280.415 3.665 20 0 CHADHO CCC[C@@H]1C[C@H]1[NH2+][C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000430749214 1118766493 /nfs/dbraw/zinc/76/64/93/1118766493.db2.gz INBHRYFWIRPGGD-USYVTKNRSA-N 1 3 298.474 3.675 20 0 CHADHO C1CC([C@H]2CC[C@H]2[NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000510747584 1118806531 /nfs/dbraw/zinc/80/65/31/1118806531.db2.gz GKPDURRZGMWSPY-QZTJIDSGSA-N 1 3 276.468 3.562 20 0 CHADHO C[C@H]([NH2+][C@@H]1CC[C@H]1C1CCC1)[C@H]1CCCN(C2CCC2)C1 ZINC000510947023 1118872170 /nfs/dbraw/zinc/87/21/70/1118872170.db2.gz XKHIRBKSUXYQQZ-OYSPMZIOSA-N 1 3 290.495 3.808 20 0 CHADHO C[C@H]([NH2+][C@@H]1CC[C@@H]1C1CCC1)[C@H]1CCCN(C2CCC2)C1 ZINC000510947013 1118872676 /nfs/dbraw/zinc/87/26/76/1118872676.db2.gz XKHIRBKSUXYQQZ-IAAVTCLWSA-N 1 3 290.495 3.808 20 0 CHADHO Cc1ccc(C(C)(C)C[N@@H+](C)CC[C@@H]2CCCN2C)cc1 ZINC001167504130 1118944354 /nfs/dbraw/zinc/94/43/54/1118944354.db2.gz IFVHUQMSLNNZJA-SFHVURJKSA-N 1 3 288.479 3.689 20 0 CHADHO Cc1ccc(C(C)(C)C[N@H+](C)CC[C@@H]2CCCN2C)cc1 ZINC001167504130 1118944357 /nfs/dbraw/zinc/94/43/57/1118944357.db2.gz IFVHUQMSLNNZJA-SFHVURJKSA-N 1 3 288.479 3.689 20 0 CHADHO Cc1ccoc1C[NH2+]C[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000380910188 1118964822 /nfs/dbraw/zinc/96/48/22/1118964822.db2.gz KVXBPILLPDLELZ-SFHVURJKSA-N 1 3 298.430 3.590 20 0 CHADHO CCC[NH2+][C@@H](C)c1ccc(OC)c(CN2CCCCC2)c1 ZINC000043814580 1119049001 /nfs/dbraw/zinc/04/90/01/1119049001.db2.gz KBOJYOSRLLTWBA-HNNXBMFYSA-N 1 3 290.451 3.742 20 0 CHADHO CCN(C)C[C@@H]1CC[N@H+](CC[C@H]2C[C@H](C)C[C@H](C)C2)C1 ZINC001167575543 1119085565 /nfs/dbraw/zinc/08/55/65/1119085565.db2.gz CSHYGTYEQXZZPG-MLHJIOFPSA-N 1 3 280.500 3.722 20 0 CHADHO CCN(C)C[C@@H]1CC[N@@H+](CC[C@H]2C[C@H](C)C[C@H](C)C2)C1 ZINC001167575543 1119085569 /nfs/dbraw/zinc/08/55/69/1119085569.db2.gz CSHYGTYEQXZZPG-MLHJIOFPSA-N 1 3 280.500 3.722 20 0 CHADHO C[C@H](c1cccs1)N(C)Cc1cc2c(s1)CC[NH2+]C2 ZINC000688008421 1128827737 /nfs/dbraw/zinc/82/77/37/1128827737.db2.gz WMHQPDZXKAPFIF-LLVKDONJSA-N 1 3 292.473 3.648 20 0 CHADHO C[NH2+]Cc1ccccc1CNCc1c(C)oc2ccccc21 ZINC000650719103 1119379155 /nfs/dbraw/zinc/37/91/55/1119379155.db2.gz DGBPCGYGRAOMKZ-UHFFFAOYSA-N 1 3 294.398 3.750 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H](C)C(C)(C)c2ccccc2)C1 ZINC000151098619 1119393918 /nfs/dbraw/zinc/39/39/18/1119393918.db2.gz JXHYHKFVKKVEIZ-DLBZAZTESA-N 1 3 288.479 3.674 20 0 CHADHO [NH3+]Cc1ccc(CN[C@@H]2CCCCc3ccccc32)c(F)c1 ZINC000650753652 1119410866 /nfs/dbraw/zinc/41/08/66/1119410866.db2.gz SCKCRIWEANFEOL-LJQANCHMSA-N 1 3 298.405 3.842 20 0 CHADHO Cc1ccc2c(c1)[C@H](NCc1ccc(C[NH3+])cc1F)[C@@H](C)C2 ZINC000650754437 1119411471 /nfs/dbraw/zinc/41/14/71/1119411471.db2.gz JAPLKQFEGKBLCS-ORAYPTAESA-N 1 3 298.405 3.616 20 0 CHADHO CC(C)c1ccc(C[N@H+](C)[C@@H]2CCCC[C@H]2N)cc1 ZINC000252916159 1119449499 /nfs/dbraw/zinc/44/94/99/1119449499.db2.gz BBPAMZYKLQRATP-IAGOWNOFSA-N 1 3 260.425 3.512 20 0 CHADHO CC(C)c1ccc(C[N@@H+](C)[C@@H]2CCCC[C@H]2N)cc1 ZINC000252916159 1119449501 /nfs/dbraw/zinc/44/95/01/1119449501.db2.gz BBPAMZYKLQRATP-IAGOWNOFSA-N 1 3 260.425 3.512 20 0 CHADHO Clc1sccc1CNCC1CC[NH+](CC2CC2)CC1 ZINC000657812846 1119449523 /nfs/dbraw/zinc/44/95/23/1119449523.db2.gz HHTXOKOPPXTOGR-UHFFFAOYSA-N 1 3 298.883 3.613 20 0 CHADHO CC(C)C[N@H+](Cc1ccc(Cl)cc1)C1CCNCC1 ZINC000167982120 1119519242 /nfs/dbraw/zinc/51/92/42/1119519242.db2.gz KFNIXPYSHGBLMA-UHFFFAOYSA-N 1 3 280.843 3.550 20 0 CHADHO CC(C)C[N@@H+](Cc1ccc(Cl)cc1)C1CCNCC1 ZINC000167982120 1119519243 /nfs/dbraw/zinc/51/92/43/1119519243.db2.gz KFNIXPYSHGBLMA-UHFFFAOYSA-N 1 3 280.843 3.550 20 0 CHADHO C[C@H](NCCCCC[NH+]1CCCCC1)c1ccc(F)cn1 ZINC000092748989 1119566572 /nfs/dbraw/zinc/56/65/72/1119566572.db2.gz XXEYWLYNIZHBKV-HNNXBMFYSA-N 1 3 293.430 3.528 20 0 CHADHO CCN(Cc1ccc(C[NH+](C)C)cc1)[C@@H](C)c1cccnc1 ZINC000685469952 1119612726 /nfs/dbraw/zinc/61/27/26/1119612726.db2.gz XUFBYINMCGMJQP-INIZCTEOSA-N 1 3 297.446 3.726 20 0 CHADHO CC[C@H]([NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1)[C@H]1C[C@@H]1C ZINC000414102894 1119899211 /nfs/dbraw/zinc/89/92/11/1119899211.db2.gz DEVQZGYMPSXXEN-INSJMTBZSA-N 1 3 278.484 3.664 20 0 CHADHO C[C@H](C[NH2+][C@H](C)[C@H]1CC2CCC1CC2)CN1CCCC1 ZINC000381595012 1128882339 /nfs/dbraw/zinc/88/23/39/1128882339.db2.gz FGKGJMKDJRKTJN-BNEJOAPWSA-N 1 3 278.484 3.523 20 0 CHADHO C[C@H]1C[C@H](NC2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)CS1 ZINC000414223170 1119946666 /nfs/dbraw/zinc/94/66/66/1119946666.db2.gz GDNDQSNKEYYJCU-OHFALNGGSA-N 1 3 296.524 3.513 20 0 CHADHO C[C@H]1C[C@H]([NH2+]C2CCN([C@H]3CCC[C@@H](C)C3)CC2)CS1 ZINC000414223170 1119946670 /nfs/dbraw/zinc/94/66/70/1119946670.db2.gz GDNDQSNKEYYJCU-OHFALNGGSA-N 1 3 296.524 3.513 20 0 CHADHO C[C@@H]1C[C@H](NC2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)CS1 ZINC000414230394 1119948217 /nfs/dbraw/zinc/94/82/17/1119948217.db2.gz NWFBFLABTJCDMK-FSDCSDTHSA-N 1 3 296.524 3.513 20 0 CHADHO CC[C@@H]1CCC[C@H](C[N@@H+]2CCCC23CCN(C)CC3)C1 ZINC000472595311 1119997077 /nfs/dbraw/zinc/99/70/77/1119997077.db2.gz FACKCQUKJVYBSA-SJORKVTESA-N 1 3 278.484 3.763 20 0 CHADHO CC[C@@H]1CCC[C@H](C[N@H+]2CCCC23CCN(C)CC3)C1 ZINC000472595311 1119997079 /nfs/dbraw/zinc/99/70/79/1119997079.db2.gz FACKCQUKJVYBSA-SJORKVTESA-N 1 3 278.484 3.763 20 0 CHADHO CCC[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccccc1 ZINC000624119414 1120051423 /nfs/dbraw/zinc/05/14/23/1120051423.db2.gz AWTBKMGPSGUCIL-SJLPKXTDSA-N 1 3 274.452 3.849 20 0 CHADHO CCC[C@@H](NC[C@H]1CCCC[N@H+](C)C1)c1ccccc1 ZINC000624119414 1120051428 /nfs/dbraw/zinc/05/14/28/1120051428.db2.gz AWTBKMGPSGUCIL-SJLPKXTDSA-N 1 3 274.452 3.849 20 0 CHADHO CCC[C@@H](NC[C@H]1CCCC[N@@H+](C)C1)c1ccccc1 ZINC000624119414 1120051432 /nfs/dbraw/zinc/05/14/32/1120051432.db2.gz AWTBKMGPSGUCIL-SJLPKXTDSA-N 1 3 274.452 3.849 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+]CC2CCC(C)(C)CC2)C1 ZINC000715540344 1120081862 /nfs/dbraw/zinc/08/18/62/1120081862.db2.gz BXSGNFPZERMAIQ-JKSUJKDBSA-N 1 3 266.473 3.665 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@@H]2CCC[C@H]2c2ccccc2)C1 ZINC000624122682 1120103876 /nfs/dbraw/zinc/10/38/76/1120103876.db2.gz YOEOFPCFBQMMFC-NZSAHSFTSA-N 1 3 286.463 3.644 20 0 CHADHO CN(C)[C@H]1CCC[C@H]([NH2+]C2CCC3(CCCC3)CC2)C1 ZINC000715578304 1120131523 /nfs/dbraw/zinc/13/15/23/1120131523.db2.gz FCWHCYHALBZGCK-IRXDYDNUSA-N 1 3 278.484 3.952 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+]C2CCC3(CCCC3)CC2)C1 ZINC000715578294 1120131848 /nfs/dbraw/zinc/13/18/48/1120131848.db2.gz FCWHCYHALBZGCK-DLBZAZTESA-N 1 3 278.484 3.952 20 0 CHADHO C[N@@H+](Cc1ccccc1)CC1CCN(C/C=C\Cl)CC1 ZINC000728688758 1120141028 /nfs/dbraw/zinc/14/10/28/1120141028.db2.gz ULRPQKKJPZQOEK-YHYXMXQVSA-N 1 3 292.854 3.583 20 0 CHADHO C[N@H+](Cc1ccccc1)CC1CCN(C/C=C\Cl)CC1 ZINC000728688758 1120141030 /nfs/dbraw/zinc/14/10/30/1120141030.db2.gz ULRPQKKJPZQOEK-YHYXMXQVSA-N 1 3 292.854 3.583 20 0 CHADHO C[C@H](c1ccc(F)cc1)[N@H+](C)CC[C@@H]1CCCCN1C ZINC000472763745 1120164815 /nfs/dbraw/zinc/16/48/15/1120164815.db2.gz NIBZMXJGWWIEQP-PBHICJAKSA-N 1 3 278.415 3.693 20 0 CHADHO C[C@H](c1ccc(F)cc1)[N@@H+](C)CC[C@@H]1CCCCN1C ZINC000472763745 1120164817 /nfs/dbraw/zinc/16/48/17/1120164817.db2.gz NIBZMXJGWWIEQP-PBHICJAKSA-N 1 3 278.415 3.693 20 0 CHADHO CC(C)[NH2+]CC1CCN(Cc2ccccc2Cl)CC1 ZINC000053659764 1120239476 /nfs/dbraw/zinc/23/94/76/1120239476.db2.gz PKDXDZWXLOMZRM-UHFFFAOYSA-N 1 3 280.843 3.550 20 0 CHADHO CCCN(Cc1ccc(Cl)c(C)c1C)C[C@H]1CC[NH2+]C1 ZINC001236842290 1128905034 /nfs/dbraw/zinc/90/50/34/1128905034.db2.gz DOOSYHGGWFARNY-HNNXBMFYSA-N 1 3 294.870 3.778 20 0 CHADHO CCC[C@H](C)CCCN1CC[C@H](C(F)(F)F)[C@H](C[NH3+])C1 ZINC000629564167 1128915577 /nfs/dbraw/zinc/91/55/77/1128915577.db2.gz RTKOLNLZPGCHEJ-MJBXVCDLSA-N 1 3 294.405 3.662 20 0 CHADHO CC[NH+]1CCC(N[C@@H](C)c2ccc(C3CC3)cc2)CC1 ZINC000417354783 1120434095 /nfs/dbraw/zinc/43/40/95/1120434095.db2.gz MQLAWPJRFCPPNC-AWEZNQCLSA-N 1 3 272.436 3.699 20 0 CHADHO CN(C)CC1(C[NH2+][C@@H]2CCc3ccc(F)cc32)CCCC1 ZINC000545520861 1120502819 /nfs/dbraw/zinc/50/28/19/1120502819.db2.gz WMOHNQRTSSYWQQ-QGZVFWFLSA-N 1 3 290.426 3.525 20 0 CHADHO CCC[C@H](C)N1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000500073871 1120504479 /nfs/dbraw/zinc/50/44/79/1120504479.db2.gz JBGPKGFWQSQUMT-YESZJQIVSA-N 1 3 266.473 3.761 20 0 CHADHO CCC[C@H](C)N1CCC[C@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000500073871 1120504481 /nfs/dbraw/zinc/50/44/81/1120504481.db2.gz JBGPKGFWQSQUMT-YESZJQIVSA-N 1 3 266.473 3.761 20 0 CHADHO CC[C@H]1CCC[C@@H](CN2CCC([NH2+]C(C)C)CC2)C1 ZINC000543393965 1120506789 /nfs/dbraw/zinc/50/67/89/1120506789.db2.gz DHRSIUZNLIPAAH-JKSUJKDBSA-N 1 3 266.473 3.665 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)CCSC2CCCCC2)C[C@H]1C ZINC000500093431 1120509258 /nfs/dbraw/zinc/50/92/58/1120509258.db2.gz SGQOYUCSZTYTOO-HZPDHXFCSA-N 1 3 298.540 3.857 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)CCSC2CCCCC2)C[C@H]1C ZINC000500093431 1120509262 /nfs/dbraw/zinc/50/92/62/1120509262.db2.gz SGQOYUCSZTYTOO-HZPDHXFCSA-N 1 3 298.540 3.857 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1csc(Cl)c1 ZINC000191166084 1120515997 /nfs/dbraw/zinc/51/59/97/1120515997.db2.gz YVPKEETZIMREKI-MNOVXSKESA-N 1 3 284.856 3.536 20 0 CHADHO CC[C@@H]([NH2+]CC[C@@H]1CCCN1C)c1ccc(Cl)s1 ZINC000543484579 1120533578 /nfs/dbraw/zinc/53/35/78/1120533578.db2.gz CMUJEKUHXLBRFB-NWDGAFQWSA-N 1 3 286.872 3.927 20 0 CHADHO CC[C@H]([NH2+]CC[C@@H]1CCCN1C)c1ccc(Cl)s1 ZINC000543484581 1120533803 /nfs/dbraw/zinc/53/38/03/1120533803.db2.gz CMUJEKUHXLBRFB-RYUDHWBXSA-N 1 3 286.872 3.927 20 0 CHADHO Cc1c2[nH]cnc2ccc1NCCC[N@H+]1CCCC[C@H]1C ZINC001167752922 1120545656 /nfs/dbraw/zinc/54/56/56/1120545656.db2.gz IYQIOSXOQOASNJ-CYBMUJFWSA-N 1 3 286.423 3.548 20 0 CHADHO Cc1c2[nH]cnc2ccc1NCCC[N@@H+]1CCCC[C@H]1C ZINC001167752922 1120545660 /nfs/dbraw/zinc/54/56/60/1120545660.db2.gz IYQIOSXOQOASNJ-CYBMUJFWSA-N 1 3 286.423 3.548 20 0 CHADHO CC[C@H](c1ccc(F)cc1)[N@H+](C)CCCN1CCCC1 ZINC000499910785 1120550463 /nfs/dbraw/zinc/55/04/63/1120550463.db2.gz CPQJXMAXHUXWTR-QGZVFWFLSA-N 1 3 278.415 3.695 20 0 CHADHO CC[C@H](c1ccc(F)cc1)[N@@H+](C)CCCN1CCCC1 ZINC000499910785 1120550469 /nfs/dbraw/zinc/55/04/69/1120550469.db2.gz CPQJXMAXHUXWTR-QGZVFWFLSA-N 1 3 278.415 3.695 20 0 CHADHO C[C@H](c1cccs1)[N@H+](C)CCCN1CCCCC1 ZINC000193472946 1120571712 /nfs/dbraw/zinc/57/17/12/1120571712.db2.gz PIHBXOAVNGWDFZ-CQSZACIVSA-N 1 3 266.454 3.617 20 0 CHADHO C[C@H](c1cccs1)[N@@H+](C)CCCN1CCCCC1 ZINC000193472946 1120571715 /nfs/dbraw/zinc/57/17/15/1120571715.db2.gz PIHBXOAVNGWDFZ-CQSZACIVSA-N 1 3 266.454 3.617 20 0 CHADHO C[C@H](Cc1ccccc1F)[NH2+]CCCN1CCCC[C@H]1C ZINC000253361705 1128928574 /nfs/dbraw/zinc/92/85/74/1128928574.db2.gz DQIXJTBJPUEBKE-HZPDHXFCSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@H](Cc1ccccc1F)NCCC[N@@H+]1CCCC[C@H]1C ZINC000253361705 1128928576 /nfs/dbraw/zinc/92/85/76/1128928576.db2.gz DQIXJTBJPUEBKE-HZPDHXFCSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@H](Cc1ccccc1F)NCCC[N@H+]1CCCC[C@H]1C ZINC000253361705 1128928577 /nfs/dbraw/zinc/92/85/77/1128928577.db2.gz DQIXJTBJPUEBKE-HZPDHXFCSA-N 1 3 292.442 3.611 20 0 CHADHO c1ccc([C@H]2C[C@@H]2C[NH2+][C@H]2CCNC[C@H]2C2CCCC2)cc1 ZINC000925712315 1120660315 /nfs/dbraw/zinc/66/03/15/1120660315.db2.gz OOIRIOUELURISR-ZRNYENFQSA-N 1 3 298.474 3.548 20 0 CHADHO CCSc1ccc([C@@H](C)NCCC(C)(C)[NH3+])cc1 ZINC000925741743 1120858898 /nfs/dbraw/zinc/85/88/98/1120858898.db2.gz MAMGXNALTROWQW-GFCCVEGCSA-N 1 3 266.454 3.577 20 0 CHADHO CC[C@@H](NCCC[NH+]1CCCC1)c1cccc(C)c1 ZINC000311682086 1120959443 /nfs/dbraw/zinc/95/94/43/1120959443.db2.gz NGMYJMJFENAMDL-QGZVFWFLSA-N 1 3 260.425 3.522 20 0 CHADHO CC[C@@H]([NH2+]CCCN1CCCC1)c1cccc(C)c1 ZINC000311682086 1120959448 /nfs/dbraw/zinc/95/94/48/1120959448.db2.gz NGMYJMJFENAMDL-QGZVFWFLSA-N 1 3 260.425 3.522 20 0 CHADHO CC[C@@H](NC[C@H]1CCC[N@H+](CC2CC2)C1)c1ccccc1 ZINC000663470179 1120984688 /nfs/dbraw/zinc/98/46/88/1120984688.db2.gz SSKHBUYHOKMJMM-IEBWSBKVSA-N 1 3 286.463 3.849 20 0 CHADHO CC[C@@H](NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1 ZINC000663470179 1120984690 /nfs/dbraw/zinc/98/46/90/1120984690.db2.gz SSKHBUYHOKMJMM-IEBWSBKVSA-N 1 3 286.463 3.849 20 0 CHADHO CC(C)c1ccc([C@H](C)[NH2+]C[C@@H]2CNCCC2(F)F)cc1 ZINC000925777847 1120986377 /nfs/dbraw/zinc/98/63/77/1120986377.db2.gz HOFQEBWWDJNZIO-BBRMVZONSA-N 1 3 296.405 3.705 20 0 CHADHO CCCc1ccc([C@H](C)[NH2+]C[C@H]2CNCCC2(F)F)cc1 ZINC000925781732 1120995017 /nfs/dbraw/zinc/99/50/17/1120995017.db2.gz ZXOUCLSEKKVGAO-XJKSGUPXSA-N 1 3 296.405 3.535 20 0 CHADHO Cc1cccc(COc2ccc([C@H](C)[NH2+]C[C@H](C)N)cc2)c1 ZINC000643528804 1121008562 /nfs/dbraw/zinc/00/85/62/1121008562.db2.gz PCSCUHINTHOPBX-HOTGVXAUSA-N 1 3 298.430 3.572 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N1CCc2c(F)cccc2C1 ZINC001167842473 1121065436 /nfs/dbraw/zinc/06/54/36/1121065436.db2.gz XWLZITYDZAUOQK-OAHLLOKOSA-N 1 3 292.442 3.694 20 0 CHADHO CC[NH+]1CCC(N[C@H](c2ccc(Cl)cc2)C2CC2)CC1 ZINC000037977310 1121095749 /nfs/dbraw/zinc/09/57/49/1121095749.db2.gz YNYPXWOLCOJKLK-KRWDZBQOSA-N 1 3 292.854 3.865 20 0 CHADHO CCCC[C@H](CC)[NH2+]CCCN1CCCC[C@H]1C ZINC000251276607 1121108377 /nfs/dbraw/zinc/10/83/77/1121108377.db2.gz DPBFWCIVVJGBBV-CVEARBPZSA-N 1 3 254.462 3.809 20 0 CHADHO c1ccc(C[N@@H+]2CC[C@@]3(CCN([C@@H]4C=CCCC4)C3)C2)cc1 ZINC000512245953 1121224114 /nfs/dbraw/zinc/22/41/14/1121224114.db2.gz UDSZPGWSHSKQRB-WOJBJXKFSA-N 1 3 296.458 3.693 20 0 CHADHO c1ccc(C[N@H+]2CC[C@@]3(CCN([C@@H]4C=CCCC4)C3)C2)cc1 ZINC000512245953 1121224124 /nfs/dbraw/zinc/22/41/24/1121224124.db2.gz UDSZPGWSHSKQRB-WOJBJXKFSA-N 1 3 296.458 3.693 20 0 CHADHO C[C@H](CCc1ccccc1)C[N@@H+]1CCC[C@@H](N(C)C)CC1 ZINC000432801633 1121366467 /nfs/dbraw/zinc/36/64/67/1121366467.db2.gz XHHUTUPTCRNYSN-IEBWSBKVSA-N 1 3 288.479 3.671 20 0 CHADHO C[C@H](CCc1ccccc1)C[N@H+]1CCC[C@@H](N(C)C)CC1 ZINC000432801633 1121366474 /nfs/dbraw/zinc/36/64/74/1121366474.db2.gz XHHUTUPTCRNYSN-IEBWSBKVSA-N 1 3 288.479 3.671 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21)C1CC1 ZINC000512615256 1121493996 /nfs/dbraw/zinc/49/39/96/1121493996.db2.gz YWUKVMIOUHKGTD-MVJPYGJCSA-N 1 3 298.474 3.675 20 0 CHADHO CC[NH+]1CCC(N[C@H]2CCCc3c(Cl)cccc32)CC1 ZINC000543600410 1121508726 /nfs/dbraw/zinc/50/87/26/1121508726.db2.gz FPHZZIPTUZSXRM-KRWDZBQOSA-N 1 3 292.854 3.791 20 0 CHADHO CCC1(N2CCC2)CC[NH+](CCCC2CCCC2)CC1 ZINC001176244437 1121585030 /nfs/dbraw/zinc/58/50/30/1121585030.db2.gz XZHCSDHDHXGYTE-UHFFFAOYSA-N 1 3 278.484 3.907 20 0 CHADHO CCN1CC[C@@H](C[NH2+]CC[C@H](C)CCC=C(C)C)C1 ZINC000512844343 1121622384 /nfs/dbraw/zinc/62/23/84/1121622384.db2.gz HHHLLOMNYVCMRX-SJORKVTESA-N 1 3 266.473 3.690 20 0 CHADHO c1ccc(CN2C[C@@H]3CCC[C@H]([NH2+]CCC4CC4)[C@H]3C2)cc1 ZINC000512666419 1121673866 /nfs/dbraw/zinc/67/38/66/1121673866.db2.gz KKANHFVWWBYJRN-UFYCRDLUSA-N 1 3 298.474 3.677 20 0 CHADHO CCCCN1CCC([NH2+]Cc2cnc3ccccc3c2)CC1 ZINC000727469277 1121720235 /nfs/dbraw/zinc/72/02/35/1121720235.db2.gz RYYOCTMDYHNJEG-UHFFFAOYSA-N 1 3 297.446 3.589 20 0 CHADHO CC(C)(CCN[C@@H]1C[C@H]([NH3+])c2ccccc21)C1CC1 ZINC000262128314 1129014373 /nfs/dbraw/zinc/01/43/73/1129014373.db2.gz CVIJAVPBHPCWIH-JKSUJKDBSA-N 1 3 258.409 3.547 20 0 CHADHO C[NH+](C)CCCN[C@H](CC1CC1)c1ccc(Cl)cc1 ZINC000345696385 1121905693 /nfs/dbraw/zinc/90/56/93/1121905693.db2.gz VZWMYCHEDVWDRV-MRXNPFEDSA-N 1 3 280.843 3.723 20 0 CHADHO CC(C)C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H]3CN(C)C[C@H]32)C1 ZINC001179816790 1121912880 /nfs/dbraw/zinc/91/28/80/1121912880.db2.gz NTFCEMJDPIULLY-NNPSNHGLSA-N 1 3 278.484 3.521 20 0 CHADHO CC1(C)CCC[C@H](C[N@@H+]2CC[C@@H](CN3CCCC3)C2)C1 ZINC001179873173 1121922775 /nfs/dbraw/zinc/92/27/75/1121922775.db2.gz FANLFAHEOHCCFK-IRXDYDNUSA-N 1 3 278.484 3.621 20 0 CHADHO CC1(C)CCC[C@H](C[N@H+]2CC[C@@H](CN3CCCC3)C2)C1 ZINC001179873173 1121922782 /nfs/dbraw/zinc/92/27/82/1121922782.db2.gz FANLFAHEOHCCFK-IRXDYDNUSA-N 1 3 278.484 3.621 20 0 CHADHO CC[C@@H]([NH2+]C1CCC(C(C)(C)CC)CC1)C1CNC1 ZINC000716147486 1121997193 /nfs/dbraw/zinc/99/71/93/1121997193.db2.gz RDWKKUGHMSWYSQ-UYSNPLJNSA-N 1 3 266.473 3.569 20 0 CHADHO C[C@H](NCC[C@@H]1CCC[NH2+]C1)c1c(F)cccc1Cl ZINC000420404240 1122005311 /nfs/dbraw/zinc/00/53/11/1122005311.db2.gz MAYLUMCVZCLTOX-RYUDHWBXSA-N 1 3 284.806 3.519 20 0 CHADHO FC(F)(F)C[C@H]1CCC[N@@H+](CCCN2CCCCC2)C1 ZINC000420944995 1122047380 /nfs/dbraw/zinc/04/73/80/1122047380.db2.gz JXVSOMWNMXYCDD-CQSZACIVSA-N 1 3 292.389 3.527 20 0 CHADHO FC(F)(F)C[C@H]1CCC[N@H+](CCCN2CCCCC2)C1 ZINC000420944995 1122047372 /nfs/dbraw/zinc/04/73/72/1122047372.db2.gz JXVSOMWNMXYCDD-CQSZACIVSA-N 1 3 292.389 3.527 20 0 CHADHO CCSCCCNC1CC[NH+]([C@@H]2CCCC[C@H]2C)CC1 ZINC000502346944 1122076863 /nfs/dbraw/zinc/07/68/63/1122076863.db2.gz RMZAHFCVERGYFX-NVXWUHKLSA-N 1 3 298.540 3.762 20 0 CHADHO Cc1cc([C@H](C)[NH2+][C@H](CCN(C)C)C(C)(C)C)oc1C ZINC000502724719 1122144627 /nfs/dbraw/zinc/14/46/27/1122144627.db2.gz FWEIBLAWPPSVOO-XJKSGUPXSA-N 1 3 280.456 3.913 20 0 CHADHO CCC[C@H](Cc1ccccc1)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC001182903020 1122194458 /nfs/dbraw/zinc/19/44/58/1122194458.db2.gz VRFKTEINQBLWCH-RBUKOAKNSA-N 1 3 288.479 3.719 20 0 CHADHO CCCCc1ccc(CN2CCC[C@](C)([NH3+])CC2)s1 ZINC001205264279 1122215657 /nfs/dbraw/zinc/21/56/57/1122215657.db2.gz IUPSKWNORXIVIK-INIZCTEOSA-N 1 3 280.481 3.794 20 0 CHADHO C[C@@]1([NH3+])CCCN(Cc2cccc3[nH]cc(Cl)c32)CC1 ZINC001205265157 1122221193 /nfs/dbraw/zinc/22/11/93/1122221193.db2.gz NYYBSERXTXXRRW-MRXNPFEDSA-N 1 3 291.826 3.525 20 0 CHADHO CCCCc1ccc(CN2CCC[C@](C)([NH3+])CC2)cc1 ZINC001205281117 1122237790 /nfs/dbraw/zinc/23/77/90/1122237790.db2.gz PUPKZIMDIHEQRV-SFHVURJKSA-N 1 3 274.452 3.733 20 0 CHADHO C[C@@H]1C[C@@]1([NH2+]CC[C@@H]1CCCN1C)c1ccc(Cl)cc1 ZINC000503368531 1122256967 /nfs/dbraw/zinc/25/69/67/1122256967.db2.gz DMQUJXWIUMRZDG-COXVUDFISA-N 1 3 292.854 3.649 20 0 CHADHO CC1(C)CCC(CN2CCC([NH2+]C3CCC3)CC2)CC1 ZINC001184197383 1122259662 /nfs/dbraw/zinc/25/96/62/1122259662.db2.gz OCUSTFZXKDEZHB-UHFFFAOYSA-N 1 3 278.484 3.809 20 0 CHADHO CCN(CC)Cc1cc([C@H](C)[NH2+]CC(C)C)ccc1OC ZINC000775362996 1122528233 /nfs/dbraw/zinc/52/82/33/1122528233.db2.gz OBZBUQXOYNDCMV-HNNXBMFYSA-N 1 3 292.467 3.844 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+](C[C@H](C)C2CCCCC2)C1 ZINC001191367583 1122596488 /nfs/dbraw/zinc/59/64/88/1122596488.db2.gz QHRMMJRKIVJTAW-DLBZAZTESA-N 1 3 280.500 3.867 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+](C[C@H](C)C2CCCCC2)C1 ZINC001191367583 1122596491 /nfs/dbraw/zinc/59/64/91/1122596491.db2.gz QHRMMJRKIVJTAW-DLBZAZTESA-N 1 3 280.500 3.867 20 0 CHADHO C[C@@H]1CCC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C1 ZINC001167962030 1122631563 /nfs/dbraw/zinc/63/15/63/1122631563.db2.gz SNWVWBVTEMCMAT-CGCLCEIZSA-N 1 3 276.468 3.560 20 0 CHADHO C[C@@]1(c2ccccc2)CC[C@@H]([NH2+]CCCN2CCCC2)C1 ZINC000437776273 1122655848 /nfs/dbraw/zinc/65/58/48/1122655848.db2.gz OYFUNVWVKMMFHO-RTBURBONSA-N 1 3 286.463 3.572 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1)CN(C)C ZINC000425947214 1122675569 /nfs/dbraw/zinc/67/55/69/1122675569.db2.gz RQTWKKWQFBPTSW-QWRGUYRKSA-N 1 3 289.250 3.842 20 0 CHADHO CC1(C)CCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167969800 1122861128 /nfs/dbraw/zinc/86/11/28/1122861128.db2.gz DTXSSDDMJHYAOL-HMQMGEFJSA-N 1 3 276.468 3.560 20 0 CHADHO Cc1cccc([C@H](C)[N@@H+]2CCCN(c3ccncc3)CC2)c1 ZINC001195535339 1122874849 /nfs/dbraw/zinc/87/48/49/1122874849.db2.gz IPFHYFWNFQZUAK-KRWDZBQOSA-N 1 3 295.430 3.663 20 0 CHADHO Cc1cccc([C@H](C)[N@H+]2CCCN(c3ccncc3)CC2)c1 ZINC001195535339 1122874856 /nfs/dbraw/zinc/87/48/56/1122874856.db2.gz IPFHYFWNFQZUAK-KRWDZBQOSA-N 1 3 295.430 3.663 20 0 CHADHO CCCCC[N@H+](C)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167982150 1122900361 /nfs/dbraw/zinc/90/03/61/1122900361.db2.gz YKXACGRYFIRNAN-SJPCQFCGSA-N 1 3 264.457 3.514 20 0 CHADHO CCCCC[N@@H+](C)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167982150 1122900365 /nfs/dbraw/zinc/90/03/65/1122900365.db2.gz YKXACGRYFIRNAN-SJPCQFCGSA-N 1 3 264.457 3.514 20 0 CHADHO Cc1cccc([C@@H]([NH2+]CC[C@@H]2CCCN2C)C(C)C)c1 ZINC001196781365 1122933835 /nfs/dbraw/zinc/93/38/35/1122933835.db2.gz ACNYZZOUBNKQSP-ROUUACIJSA-N 1 3 274.452 3.766 20 0 CHADHO Cc1cccc([C@@H](NCC[C@@H]2CCC[N@@H+]2C)C(C)C)c1 ZINC001196781365 1122933838 /nfs/dbraw/zinc/93/38/38/1122933838.db2.gz ACNYZZOUBNKQSP-ROUUACIJSA-N 1 3 274.452 3.766 20 0 CHADHO Cc1cccc([C@@H](NCC[C@@H]2CCC[N@H+]2C)C(C)C)c1 ZINC001196781365 1122933842 /nfs/dbraw/zinc/93/38/42/1122933842.db2.gz ACNYZZOUBNKQSP-ROUUACIJSA-N 1 3 274.452 3.766 20 0 CHADHO CC1([NH+]2CCC2)CCN(CC[C@@H]2CCc3ccccc32)CC1 ZINC001197263820 1122950295 /nfs/dbraw/zinc/95/02/95/1122950295.db2.gz CQVNLAVVTHQLMC-SFHVURJKSA-N 1 3 298.474 3.667 20 0 CHADHO CN1CCCC[C@H]1CC[N@H+](C)CCc1ccccc1Cl ZINC000441372172 1123082739 /nfs/dbraw/zinc/08/27/39/1123082739.db2.gz BNRRBIRBZBRMHK-INIZCTEOSA-N 1 3 294.870 3.689 20 0 CHADHO CN1CCCC[C@H]1CC[N@@H+](C)CCc1ccccc1Cl ZINC000441372172 1123082741 /nfs/dbraw/zinc/08/27/41/1123082741.db2.gz BNRRBIRBZBRMHK-INIZCTEOSA-N 1 3 294.870 3.689 20 0 CHADHO C[N@H+](CC1CCCCC1)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167994304 1123104000 /nfs/dbraw/zinc/10/40/00/1123104000.db2.gz BKFQOZPXOXOVHR-DFNIBXOVSA-N 1 3 290.495 3.904 20 0 CHADHO C[N@@H+](CC1CCCCC1)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167994304 1123104002 /nfs/dbraw/zinc/10/40/02/1123104002.db2.gz BKFQOZPXOXOVHR-DFNIBXOVSA-N 1 3 290.495 3.904 20 0 CHADHO CC[C@@H](C)C[NH+]1CCC2(CN(Cc3ccccc3)C2)CC1 ZINC001201513632 1123114082 /nfs/dbraw/zinc/11/40/82/1123114082.db2.gz AGSHKBNMWTZSIQ-QGZVFWFLSA-N 1 3 286.463 3.631 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1)CN(C)C ZINC000380522670 1123123204 /nfs/dbraw/zinc/12/32/04/1123123204.db2.gz CGEJPEMNFFPTLK-RYUDHWBXSA-N 1 3 288.357 3.554 20 0 CHADHO c1ccc(CC[N@H+]2CCCC[C@@H]2CCN2CCCC2)cc1 ZINC001201602902 1123131087 /nfs/dbraw/zinc/13/10/87/1123131087.db2.gz DNEHDMCESDHZDK-LJQANCHMSA-N 1 3 286.463 3.570 20 0 CHADHO c1ccc(CC[N@@H+]2CCCC[C@@H]2CCN2CCCC2)cc1 ZINC001201602902 1123131091 /nfs/dbraw/zinc/13/10/91/1123131091.db2.gz DNEHDMCESDHZDK-LJQANCHMSA-N 1 3 286.463 3.570 20 0 CHADHO c1ccc(CCN2CCCC[C@@H]2CC[NH+]2CCCC2)cc1 ZINC001201602902 1123131092 /nfs/dbraw/zinc/13/10/92/1123131092.db2.gz DNEHDMCESDHZDK-LJQANCHMSA-N 1 3 286.463 3.570 20 0 CHADHO CCCCC[NH+]1CCC2(CN(Cc3ccccc3)C2)CC1 ZINC001201737529 1123143323 /nfs/dbraw/zinc/14/33/23/1123143323.db2.gz SILFMKVMZBJAQS-UHFFFAOYSA-N 1 3 286.463 3.775 20 0 CHADHO CCN1CC[C@H]([N@H+](C)Cc2ccc(Cl)c(C)c2)C[C@H]1C ZINC000507812450 1123218582 /nfs/dbraw/zinc/21/85/82/1123218582.db2.gz HNISFKPZLGWSKH-ZBFHGGJFSA-N 1 3 294.870 3.953 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)Cc2ccc(Cl)c(C)c2)C[C@H]1C ZINC000507812450 1123218585 /nfs/dbraw/zinc/21/85/85/1123218585.db2.gz HNISFKPZLGWSKH-ZBFHGGJFSA-N 1 3 294.870 3.953 20 0 CHADHO [NH3+][C@H]1CCC[C@@H](NCc2ccc(-c3cccs3)cc2)C1 ZINC000665238514 1123241181 /nfs/dbraw/zinc/24/11/81/1123241181.db2.gz ZXEUCOLERXXIMY-JKSUJKDBSA-N 1 3 286.444 3.775 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC1C[C@H](C)C[C@@H](C)C1 ZINC000665239645 1123243732 /nfs/dbraw/zinc/24/37/32/1123243732.db2.gz WHYTXIOQZOKASO-MCIONIFRSA-N 1 3 289.467 3.572 20 0 CHADHO C[C@@H]([NH2+]CC1(N)CCCC1)c1cccc(-c2ccncc2)c1 ZINC000665249529 1123263931 /nfs/dbraw/zinc/26/39/31/1123263931.db2.gz RZULQAOUSIEHDJ-OAHLLOKOSA-N 1 3 295.430 3.671 20 0 CHADHO CCN(C)C[C@H]1CC[N@H+](C[C@H](c2ccccc2)C(C)C)C1 ZINC000474263543 1123496856 /nfs/dbraw/zinc/49/68/56/1123496856.db2.gz CYZJBECDSLDYRY-MJGOQNOKSA-N 1 3 288.479 3.700 20 0 CHADHO CCN(C)C[C@H]1CC[N@@H+](C[C@H](c2ccccc2)C(C)C)C1 ZINC000474263543 1123496859 /nfs/dbraw/zinc/49/68/59/1123496859.db2.gz CYZJBECDSLDYRY-MJGOQNOKSA-N 1 3 288.479 3.700 20 0 CHADHO C[NH+](C)[C@H]1CCCN(CCc2ccc3ccccc3c2)CC1 ZINC000429529985 1123547471 /nfs/dbraw/zinc/54/74/71/1123547471.db2.gz QXTGBPQIYPDVMX-FQEVSTJZSA-N 1 3 296.458 3.798 20 0 CHADHO CN(C)[C@H]1CCC[N@H+](CCc2ccc3ccccc3c2)CC1 ZINC000429529985 1123547475 /nfs/dbraw/zinc/54/74/75/1123547475.db2.gz QXTGBPQIYPDVMX-FQEVSTJZSA-N 1 3 296.458 3.798 20 0 CHADHO CN(C)[C@H]1CCC[N@@H+](CCc2ccc3ccccc3c2)CC1 ZINC000429529985 1123547480 /nfs/dbraw/zinc/54/74/80/1123547480.db2.gz QXTGBPQIYPDVMX-FQEVSTJZSA-N 1 3 296.458 3.798 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H]2CCC[C@H](C(C)C)C2)C1 ZINC000474628595 1123561835 /nfs/dbraw/zinc/56/18/35/1123561835.db2.gz LNTTWJVJZXVJFU-IKGGRYGDSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)[C@H]([NH2+]CC[C@@H](C)N1CCCCC1)c1cccnc1 ZINC000346855161 1123727149 /nfs/dbraw/zinc/72/71/49/1123727149.db2.gz CTCMVWWXABLMTO-AEFFLSMTSA-N 1 3 289.467 3.633 20 0 CHADHO CC[C@@H](NC[C@H]1CCC[N@H+](C)C1)c1ccc(Cl)s1 ZINC000158244338 1129142515 /nfs/dbraw/zinc/14/25/15/1129142515.db2.gz MVMOLLFHIYSQQX-VXGBXAGGSA-N 1 3 286.872 3.784 20 0 CHADHO CC[C@@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccc(Cl)s1 ZINC000158244338 1129142516 /nfs/dbraw/zinc/14/25/16/1129142516.db2.gz MVMOLLFHIYSQQX-VXGBXAGGSA-N 1 3 286.872 3.784 20 0 CHADHO CC1=CCC[C@@H](C)[C@@H]1C[N@@H+]1CCCC12CCN(C)CC2 ZINC000475131407 1123796675 /nfs/dbraw/zinc/79/66/75/1123796675.db2.gz RNSILQGMBSXIDN-IAGOWNOFSA-N 1 3 276.468 3.539 20 0 CHADHO CC1=CCC[C@@H](C)[C@@H]1C[N@H+]1CCCC12CCN(C)CC2 ZINC000475131407 1123796678 /nfs/dbraw/zinc/79/66/78/1123796678.db2.gz RNSILQGMBSXIDN-IAGOWNOFSA-N 1 3 276.468 3.539 20 0 CHADHO CCCc1cccc(C[N@@H+]2CCCC23CCN(C)CC3)c1 ZINC000475139318 1123798787 /nfs/dbraw/zinc/79/87/87/1123798787.db2.gz XDESXUSQRAMXTH-UHFFFAOYSA-N 1 3 286.463 3.699 20 0 CHADHO CCCc1cccc(C[N@H+]2CCCC23CCN(C)CC3)c1 ZINC000475139318 1123798790 /nfs/dbraw/zinc/79/87/90/1123798790.db2.gz XDESXUSQRAMXTH-UHFFFAOYSA-N 1 3 286.463 3.699 20 0 CHADHO Cc1oc2ccccc2c1[C@H](C)N[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000925140173 1123823788 /nfs/dbraw/zinc/82/37/88/1123823788.db2.gz JAUWQMHBHVIGCI-YDHLFZDLSA-N 1 3 286.419 3.875 20 0 CHADHO Cc1oc2ccccc2c1[C@H](C)N[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000925140173 1123823794 /nfs/dbraw/zinc/82/37/94/1123823794.db2.gz JAUWQMHBHVIGCI-YDHLFZDLSA-N 1 3 286.419 3.875 20 0 CHADHO CC(C)[C@@H](C[N@@H+]1CCC[C@H](N(C)C)CC1)c1ccccc1 ZINC000475218631 1123824579 /nfs/dbraw/zinc/82/45/79/1123824579.db2.gz ZERBOVYNGZOLCF-RBUKOAKNSA-N 1 3 288.479 3.842 20 0 CHADHO CC(C)[C@@H](C[N@H+]1CCC[C@H](N(C)C)CC1)c1ccccc1 ZINC000475218631 1123824583 /nfs/dbraw/zinc/82/45/83/1123824583.db2.gz ZERBOVYNGZOLCF-RBUKOAKNSA-N 1 3 288.479 3.842 20 0 CHADHO C[C@H](NCCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccco1 ZINC000158595398 1129148296 /nfs/dbraw/zinc/14/82/96/1129148296.db2.gz GVJLQFNZAACCHF-XHSDSOJGSA-N 1 3 278.440 3.688 20 0 CHADHO C[C@H](NCCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccco1 ZINC000158595398 1129148299 /nfs/dbraw/zinc/14/82/99/1129148299.db2.gz GVJLQFNZAACCHF-XHSDSOJGSA-N 1 3 278.440 3.688 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CNc2ccnc3ccc(C)cc32)C1 ZINC000302151322 1123957426 /nfs/dbraw/zinc/95/74/26/1123957426.db2.gz KNKJELLVTDMXHU-HNNXBMFYSA-N 1 3 283.419 3.687 20 0 CHADHO CCC[N@H+]1CC[C@@H](CNc2ccnc3ccc(C)cc32)C1 ZINC000302151322 1123957430 /nfs/dbraw/zinc/95/74/30/1123957430.db2.gz KNKJELLVTDMXHU-HNNXBMFYSA-N 1 3 283.419 3.687 20 0 CHADHO CC(C)([NH2+]CCCN1CCCCC1)c1cccc(F)c1 ZINC000444609089 1124045204 /nfs/dbraw/zinc/04/52/04/1124045204.db2.gz MRORWFNASKBNOS-UHFFFAOYSA-N 1 3 278.415 3.526 20 0 CHADHO Clc1cccc(C2([NH2+]CCCN3CCCCC3)CC2)c1 ZINC000444608594 1124045546 /nfs/dbraw/zinc/04/55/46/1124045546.db2.gz LMCNIUBVPHMUSQ-UHFFFAOYSA-N 1 3 292.854 3.795 20 0 CHADHO CCC[C@H]([NH2+]C[C@H]1CCCN(CC)C1)c1cc(C)ccn1 ZINC001118991244 1131244529 /nfs/dbraw/zinc/24/45/29/1131244529.db2.gz JPCVFGAOJBWKMY-SJORKVTESA-N 1 3 289.467 3.553 20 0 CHADHO C[C@@H](C[NH2+]CC[C@H](C)N1CCCCC1)c1ccc(F)cc1 ZINC000526116306 1124511915 /nfs/dbraw/zinc/51/19/15/1124511915.db2.gz VBOIHYLIIOKTHY-HOTGVXAUSA-N 1 3 292.442 3.783 20 0 CHADHO C[C@H]([NH2+]CCCC(F)(F)F)[C@H]1CCCN(C2CCC2)C1 ZINC001119931341 1131267496 /nfs/dbraw/zinc/26/74/96/1131267496.db2.gz KXBHLRKSTPMPIX-STQMWFEESA-N 1 3 292.389 3.572 20 0 CHADHO CC(C)[C@H]1C[C@@H](N[C@H]2CC[N@H+](C)[C@H](C)C2)c2ccccc21 ZINC000448026530 1124556049 /nfs/dbraw/zinc/55/60/49/1124556049.db2.gz INWLQYCGDSGEMI-WTLGNFPFSA-N 1 3 286.463 3.943 20 0 CHADHO CC(C)[C@H]1C[C@@H](N[C@H]2CC[N@@H+](C)[C@H](C)C2)c2ccccc21 ZINC000448026530 1124556056 /nfs/dbraw/zinc/55/60/56/1124556056.db2.gz INWLQYCGDSGEMI-WTLGNFPFSA-N 1 3 286.463 3.943 20 0 CHADHO C[C@@H]1CC[C@H](C)[C@H]([NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000449187352 1124668855 /nfs/dbraw/zinc/66/88/55/1124668855.db2.gz QMDYEKUCJVEUJC-RVKKMQEKSA-N 1 3 278.484 3.808 20 0 CHADHO CC(C)(C)N1CCC([NH2+]Cc2cccc3ncccc23)CC1 ZINC000872124484 1124689416 /nfs/dbraw/zinc/68/94/16/1124689416.db2.gz NZQLAQGECMWVDR-UHFFFAOYSA-N 1 3 297.446 3.587 20 0 CHADHO CCCC[C@H]1C[C@H]([NH2+]C2(C)CCCCC2)CCN1 ZINC001246082299 1131294486 /nfs/dbraw/zinc/29/44/86/1131294486.db2.gz QEGITWZHBNFMRD-LSDHHAIUSA-N 1 3 252.446 3.610 20 0 CHADHO CC[C@H]1CC[C@H](C2CCC([NH2+]CC3CNC3)CC2)CC1 ZINC001246092862 1131304006 /nfs/dbraw/zinc/30/40/06/1131304006.db2.gz QFOXSSFCUYVWFA-SVOYEFRLSA-N 1 3 278.484 3.571 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN(CC/C=C/c2ccccc2)C1 ZINC000450463264 1125028892 /nfs/dbraw/zinc/02/88/92/1125028892.db2.gz NMFGZFIUFNKKET-BQHJZSHBSA-N 1 3 286.463 3.754 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN(CC/C=C/c2ccccc2)C1 ZINC000450463264 1125028894 /nfs/dbraw/zinc/02/88/94/1125028894.db2.gz NMFGZFIUFNKKET-BQHJZSHBSA-N 1 3 286.463 3.754 20 0 CHADHO CC[NH+](CC)C[C@H]1CCN(CCC2=CCCCC2)C1 ZINC000450460395 1125029355 /nfs/dbraw/zinc/02/93/55/1125029355.db2.gz NYTGTFXWEGTNIK-QGZVFWFLSA-N 1 3 264.457 3.541 20 0 CHADHO C[C@@H](NCC1=CCCCC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000450728902 1125093881 /nfs/dbraw/zinc/09/38/81/1125093881.db2.gz QKDNWOSFOFTASX-NVXWUHKLSA-N 1 3 276.468 3.729 20 0 CHADHO C[C@@H](NCC1=CCCCC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000450728902 1125093890 /nfs/dbraw/zinc/09/38/90/1125093890.db2.gz QKDNWOSFOFTASX-NVXWUHKLSA-N 1 3 276.468 3.729 20 0 CHADHO C[C@@H]([NH2+]CC1=CCCCC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000450728902 1125093900 /nfs/dbraw/zinc/09/39/00/1125093900.db2.gz QKDNWOSFOFTASX-NVXWUHKLSA-N 1 3 276.468 3.729 20 0 CHADHO C[C@@H](NCC1=CCCCC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000450728904 1125095028 /nfs/dbraw/zinc/09/50/28/1125095028.db2.gz QKDNWOSFOFTASX-WBVHZDCISA-N 1 3 276.468 3.729 20 0 CHADHO C[C@@H](NCC1=CCCCC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000450728904 1125095037 /nfs/dbraw/zinc/09/50/37/1125095037.db2.gz QKDNWOSFOFTASX-WBVHZDCISA-N 1 3 276.468 3.729 20 0 CHADHO C[C@@H]([NH2+]CC1=CCCCC1)[C@H]1CCCN(C2CCC2)C1 ZINC000450728904 1125095047 /nfs/dbraw/zinc/09/50/47/1125095047.db2.gz QKDNWOSFOFTASX-WBVHZDCISA-N 1 3 276.468 3.729 20 0 CHADHO c1ccc(C2CCC([NH2+][C@H]3CCNC34CCC4)CC2)cc1 ZINC000530176112 1125130179 /nfs/dbraw/zinc/13/01/79/1125130179.db2.gz BLZWEXYHQVAQBQ-ABHNRTSZSA-N 1 3 284.447 3.587 20 0 CHADHO Cc1cccc([C@H](NC2C[C@H]3CC[C@@H](C2)[NH2+]3)C(C)C)c1 ZINC000530224857 1125132721 /nfs/dbraw/zinc/13/27/21/1125132721.db2.gz MUZSJIFDJNXUGU-UJJTZGENSA-N 1 3 272.436 3.565 20 0 CHADHO C[NH+](C)[C@@H]1CCC[C@H](N[C@@H](CC2CC2)c2ccccc2)C1 ZINC000532248071 1125243810 /nfs/dbraw/zinc/24/38/10/1125243810.db2.gz DDUROECHIDYVCX-OTWHNJEPSA-N 1 3 286.463 3.990 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@@H](CC2CC2)c2ccccc2)C1 ZINC000532248071 1125243815 /nfs/dbraw/zinc/24/38/15/1125243815.db2.gz DDUROECHIDYVCX-OTWHNJEPSA-N 1 3 286.463 3.990 20 0 CHADHO Cc1csc(CN2CCCC[C@H]2C[C@@H]2CCC[N@H+]2C)c1 ZINC001137158418 1125285793 /nfs/dbraw/zinc/28/57/93/1125285793.db2.gz ROALBQAJUCVCKD-HOTGVXAUSA-N 1 3 292.492 3.895 20 0 CHADHO Cc1csc(CN2CCCC[C@H]2C[C@@H]2CCC[N@@H+]2C)c1 ZINC001137158418 1125285796 /nfs/dbraw/zinc/28/57/96/1125285796.db2.gz ROALBQAJUCVCKD-HOTGVXAUSA-N 1 3 292.492 3.895 20 0 CHADHO Cc1csc(C[N@H+]2CCCC[C@H]2C[C@@H]2CCCN2C)c1 ZINC001137158418 1125285801 /nfs/dbraw/zinc/28/58/01/1125285801.db2.gz ROALBQAJUCVCKD-HOTGVXAUSA-N 1 3 292.492 3.895 20 0 CHADHO Cc1csc(C[N@@H+]2CCCC[C@H]2C[C@@H]2CCCN2C)c1 ZINC001137158418 1125285805 /nfs/dbraw/zinc/28/58/05/1125285805.db2.gz ROALBQAJUCVCKD-HOTGVXAUSA-N 1 3 292.492 3.895 20 0 CHADHO C1CC12CCC[C@H]([NH2+]C1CCN(C3CCCC3)CC1)C2 ZINC000883195548 1125376579 /nfs/dbraw/zinc/37/65/79/1125376579.db2.gz XABBDLJNUNURKI-INIZCTEOSA-N 1 3 276.468 3.706 20 0 CHADHO CC1CCC([NH2+]C2CCN(C[C@@H]3CC=CCC3)CC2)CC1 ZINC001168209637 1125412628 /nfs/dbraw/zinc/41/26/28/1125412628.db2.gz ZQJQSLRRBRYTRV-LXPRWKDFSA-N 1 3 290.495 3.975 20 0 CHADHO CC1CCC(N2CCC(C)([NH+]3CCCC3)CC2)CC1 ZINC001168221820 1125419324 /nfs/dbraw/zinc/41/93/24/1125419324.db2.gz QEPIARMCBXRWQI-UHFFFAOYSA-N 1 3 264.457 3.515 20 0 CHADHO Cc1cc([C@@H](C)[NH2+]C2CCN(C(C)(C)C)CC2)cs1 ZINC000294223943 1129214286 /nfs/dbraw/zinc/21/42/86/1129214286.db2.gz NSDIJUIUGOHJFG-CYBMUJFWSA-N 1 3 280.481 3.970 20 0 CHADHO C[C@@]1(CNC2CC([NH+]3CCCCC3)C2)C[C@H]1c1ccccc1 ZINC000639123529 1129284635 /nfs/dbraw/zinc/28/46/35/1129284635.db2.gz CIUQWAVPZDMCQW-GUMHCPJTSA-N 1 3 298.474 3.787 20 0 CHADHO CCCCC(CCCC)[NH2+]CC[C@H]1CCCN1C ZINC001258381111 1129302444 /nfs/dbraw/zinc/30/24/44/1129302444.db2.gz SLINGTTXLWZWCF-MRXNPFEDSA-N 1 3 254.462 3.809 20 0 CHADHO C/C=C/CN[C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000639353621 1129305484 /nfs/dbraw/zinc/30/54/84/1129305484.db2.gz VNCJJDTZPABANW-FFFWVMEBSA-N 1 3 270.420 3.520 20 0 CHADHO C/C=C/CN[C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000639353621 1129305488 /nfs/dbraw/zinc/30/54/88/1129305488.db2.gz VNCJJDTZPABANW-FFFWVMEBSA-N 1 3 270.420 3.520 20 0 CHADHO CC[C@@H]1C[C@H]([NH2+]C2CCC(C(C)(C)C)CC2)CCN1 ZINC001246169586 1131369313 /nfs/dbraw/zinc/36/93/13/1131369313.db2.gz CXNSNPSKQIEHJV-GYTBAZASSA-N 1 3 266.473 3.712 20 0 CHADHO CCCC[C@@H](N[C@@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000643521936 1129443858 /nfs/dbraw/zinc/44/38/58/1129443858.db2.gz FQQYZKACYAPZMU-IAGOWNOFSA-N 1 3 260.425 3.650 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3N[C@@H]1CCC[NH2+]CC1 ZINC000643522912 1129443941 /nfs/dbraw/zinc/44/39/41/1129443941.db2.gz URIJDFXOEPYHTI-RDTXWAMCSA-N 1 3 297.446 3.585 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCNC[C@H]1C)c1cccc2ccccc21 ZINC000643524553 1129444686 /nfs/dbraw/zinc/44/46/86/1129444686.db2.gz WQQBWXAIYTYKAK-CCKFTAQKSA-N 1 3 282.431 3.879 20 0 CHADHO CC[C@H](N[C@H]1CC[NH2+]C[C@H]1C)c1cccc2ccccc21 ZINC000643524553 1129444690 /nfs/dbraw/zinc/44/46/90/1129444690.db2.gz WQQBWXAIYTYKAK-CCKFTAQKSA-N 1 3 282.431 3.879 20 0 CHADHO C1[C@H]2CC[C@@H]([NH2+]C3CCN(C4CCCCC4)CC3)C[C@@H]12 ZINC000647257520 1129561940 /nfs/dbraw/zinc/56/19/40/1129561940.db2.gz JPJCGEJFIGOXQG-BFYDXBDKSA-N 1 3 276.468 3.562 20 0 CHADHO Clc1cccc([C@H](NC[C@H]2CC[NH2+]C2)C2CCCC2)c1 ZINC000647992101 1129590965 /nfs/dbraw/zinc/59/09/65/1129590965.db2.gz FLBUNXRSRDOKGF-SUMWQHHRSA-N 1 3 292.854 3.770 20 0 CHADHO C[C@@H](NCCCC1CC[NH2+]CC1)c1c(F)cccc1Cl ZINC000647992144 1129591449 /nfs/dbraw/zinc/59/14/49/1129591449.db2.gz JVTPVJDGUPNZHT-GFCCVEGCSA-N 1 3 298.833 3.910 20 0 CHADHO CSC1CCC(CN[C@@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC000720556662 1129657729 /nfs/dbraw/zinc/65/77/29/1129657729.db2.gz JPSZCZFNSUHKDJ-CXMPNGEBSA-N 1 3 290.476 3.643 20 0 CHADHO Cc1cccc([C@@H](C)N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1C ZINC001169119557 1129700297 /nfs/dbraw/zinc/70/02/97/1129700297.db2.gz UJWPYCHASYRCGE-VQHPVUNQSA-N 1 3 272.436 3.579 20 0 CHADHO Cc1cccc([C@@H](C)N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1C ZINC001169119557 1129700300 /nfs/dbraw/zinc/70/03/00/1129700300.db2.gz UJWPYCHASYRCGE-VQHPVUNQSA-N 1 3 272.436 3.579 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@H](N1CCC(c3cccs3)CC1)C2 ZINC001169139257 1129702401 /nfs/dbraw/zinc/70/24/01/1129702401.db2.gz ACGAGXYNTHHLDP-MUJYYYPQSA-N 1 3 290.476 3.553 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](N1CCC(c3cccs3)CC1)C2 ZINC001169139257 1129702403 /nfs/dbraw/zinc/70/24/03/1129702403.db2.gz ACGAGXYNTHHLDP-MUJYYYPQSA-N 1 3 290.476 3.553 20 0 CHADHO CC[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1C ZINC001169107136 1129703766 /nfs/dbraw/zinc/70/37/66/1129703766.db2.gz DVGFSTOZMMQQAH-XLMAVXFVSA-N 1 3 272.436 3.661 20 0 CHADHO CC[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1C ZINC001169107136 1129703768 /nfs/dbraw/zinc/70/37/68/1129703768.db2.gz DVGFSTOZMMQQAH-XLMAVXFVSA-N 1 3 272.436 3.661 20 0 CHADHO CCN(Cc1ccc(Cl)cc1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169145216 1129704246 /nfs/dbraw/zinc/70/42/46/1129704246.db2.gz MAIJKHRSKGBBMH-BJWYYQGGSA-N 1 3 292.854 3.787 20 0 CHADHO CCN(Cc1ccc(Cl)cc1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169145216 1129704247 /nfs/dbraw/zinc/70/42/47/1129704247.db2.gz MAIJKHRSKGBBMH-BJWYYQGGSA-N 1 3 292.854 3.787 20 0 CHADHO CC[NH+]1CCC(N[C@H](CC2CC2)c2ccc(F)cc2)CC1 ZINC001169240435 1129711960 /nfs/dbraw/zinc/71/19/60/1129711960.db2.gz IJTNPLXTABVRKF-GOSISDBHSA-N 1 3 290.426 3.741 20 0 CHADHO CC(C)(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1C[C@H](N)c2ccccc21 ZINC000650741629 1129720597 /nfs/dbraw/zinc/72/05/97/1129720597.db2.gz IFDHTJDAFKAOLY-DANNLKNASA-N 1 3 258.409 3.546 20 0 CHADHO [NH3+][C@H]1C[C@@H](NCCC2CCC(F)(F)CC2)c2ccccc21 ZINC000902456693 1130013101 /nfs/dbraw/zinc/01/31/01/1130013101.db2.gz QPFOOQFAWTWDHT-JKSUJKDBSA-N 1 3 294.389 3.936 20 0 CHADHO C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@H]2C1)[C@@H]1CCCN(C2CCC2)C1 ZINC000902948926 1130089258 /nfs/dbraw/zinc/08/92/58/1130089258.db2.gz YNPBXHZCXUDIMF-AVEIZBFRSA-N 1 3 290.495 3.808 20 0 CHADHO C=Cc1ccc(CCNC2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC2)cc1 ZINC000903175482 1130125052 /nfs/dbraw/zinc/12/50/52/1130125052.db2.gz SUXKQRMREFCAMW-CTXDPNEZSA-N 1 3 296.458 3.620 20 0 CHADHO C=Cc1ccc(CCNC2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)cc1 ZINC000903175482 1130125055 /nfs/dbraw/zinc/12/50/55/1130125055.db2.gz SUXKQRMREFCAMW-CTXDPNEZSA-N 1 3 296.458 3.620 20 0 CHADHO Cc1ccc(CCNC2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC2)cc1C ZINC000903201396 1130129233 /nfs/dbraw/zinc/12/92/33/1130129233.db2.gz ZCVFIVAZNOTQQH-CTXDPNEZSA-N 1 3 298.474 3.593 20 0 CHADHO Cc1ccc(CCNC2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)cc1C ZINC000903201396 1130129234 /nfs/dbraw/zinc/12/92/34/1130129234.db2.gz ZCVFIVAZNOTQQH-CTXDPNEZSA-N 1 3 298.474 3.593 20 0 CHADHO CC[C@]1(C)CCC[C@H]1N[C@H](CC[NH+](C)C)c1cccnc1 ZINC000903378131 1130168403 /nfs/dbraw/zinc/16/84/03/1130168403.db2.gz OSJGJHXTKLSABQ-KZNAEPCWSA-N 1 3 289.467 3.633 20 0 CHADHO C[C@H](N[C@@H](CC[NH+](C)C)c1cccnc1)C1CCCCC1 ZINC000903383580 1130168915 /nfs/dbraw/zinc/16/89/15/1130168915.db2.gz NOBUUAHUYWLOCD-YJBOKZPZSA-N 1 3 289.467 3.633 20 0 CHADHO Cl/C=C\C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000903443173 1130177875 /nfs/dbraw/zinc/17/78/75/1130177875.db2.gz CNUNAFUJOJYTGA-PBTQQURTSA-N 1 3 290.838 3.524 20 0 CHADHO C[C@@H]1CC[C@@H]([NH2+]C2CCN(C[C@@H]3CC=CCC3)CC2)C1 ZINC001170124232 1130285838 /nfs/dbraw/zinc/28/58/38/1130285838.db2.gz FXFGWVXYBMXEJQ-JFIYKMOQSA-N 1 3 276.468 3.585 20 0 CHADHO c1ccc2c(c1)cccc2CCN[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000677237048 1130296199 /nfs/dbraw/zinc/29/61/99/1130296199.db2.gz ZFSMNINRYARVEO-RTBURBONSA-N 1 3 294.442 3.599 20 0 CHADHO c1ccc2c(c1)cccc2CCN[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000677237048 1130296202 /nfs/dbraw/zinc/29/62/02/1130296202.db2.gz ZFSMNINRYARVEO-RTBURBONSA-N 1 3 294.442 3.599 20 0 CHADHO Cc1ccccc1[C@H](N[C@@H]1CC[N@@H+]2CCC[C@H]2C1)C(C)C ZINC000677241700 1130298379 /nfs/dbraw/zinc/29/83/79/1130298379.db2.gz UBCVYNHCWBTWGB-ZIFCJYIRSA-N 1 3 286.463 3.909 20 0 CHADHO Cc1ccccc1[C@H](N[C@@H]1CC[N@H+]2CCC[C@H]2C1)C(C)C ZINC000677241700 1130298384 /nfs/dbraw/zinc/29/83/84/1130298384.db2.gz UBCVYNHCWBTWGB-ZIFCJYIRSA-N 1 3 286.463 3.909 20 0 CHADHO Cc1ccccc1[C@H](N[C@H]1CC[N@@H+]2CCC[C@H]2C1)C1CC1 ZINC000677240277 1130298400 /nfs/dbraw/zinc/29/84/00/1130298400.db2.gz FCTATHUQNBONSY-JENIJYKNSA-N 1 3 284.447 3.663 20 0 CHADHO Cc1ccccc1[C@H](N[C@H]1CC[N@H+]2CCC[C@H]2C1)C1CC1 ZINC000677240277 1130298403 /nfs/dbraw/zinc/29/84/03/1130298403.db2.gz FCTATHUQNBONSY-JENIJYKNSA-N 1 3 284.447 3.663 20 0 CHADHO CN1CCC[C@H]1CC[NH2+][C@H](CC1CC1)c1ccccc1 ZINC000678776499 1130454093 /nfs/dbraw/zinc/45/40/93/1130454093.db2.gz GAJHQLLQWAQNMV-ZWKOTPCHSA-N 1 3 272.436 3.602 20 0 CHADHO C[N@@H+]1CCC[C@H]1CCN[C@H](CC1CC1)c1ccccc1 ZINC000678776499 1130454094 /nfs/dbraw/zinc/45/40/94/1130454094.db2.gz GAJHQLLQWAQNMV-ZWKOTPCHSA-N 1 3 272.436 3.602 20 0 CHADHO C[N@H+]1CCC[C@H]1CCN[C@H](CC1CC1)c1ccccc1 ZINC000678776499 1130454096 /nfs/dbraw/zinc/45/40/96/1130454096.db2.gz GAJHQLLQWAQNMV-ZWKOTPCHSA-N 1 3 272.436 3.602 20 0 CHADHO CC(C)N(Cc1ccc(Cl)cc1)[C@H]1CCC[NH2+]CC1 ZINC001206579900 1130487882 /nfs/dbraw/zinc/48/78/82/1130487882.db2.gz AUCOIJSVSSXBAB-INIZCTEOSA-N 1 3 280.843 3.693 20 0 CHADHO CC1=C[C@H](C)[C@@H](C[N@@H+](C(C)C)[C@@H]2CCCNCC2)CC1 ZINC001206580570 1130538503 /nfs/dbraw/zinc/53/85/03/1130538503.db2.gz FCJDFVADZOZECY-RCCFBDPRSA-N 1 3 278.484 3.831 20 0 CHADHO CC1=C[C@H](C)[C@@H](C[N@H+](C(C)C)[C@@H]2CCCNCC2)CC1 ZINC001206580570 1130538507 /nfs/dbraw/zinc/53/85/07/1130538507.db2.gz FCJDFVADZOZECY-RCCFBDPRSA-N 1 3 278.484 3.831 20 0 CHADHO CCCN1CC[C@H](C[NH2+]CC(CC)(CC)CC)C1 ZINC000679840844 1130560153 /nfs/dbraw/zinc/56/01/53/1130560153.db2.gz NZQBJLSERRUQFD-OAHLLOKOSA-N 1 3 254.462 3.524 20 0 CHADHO C[C@H](CN1CC[C@@]2(CC[NH2+]C2)C1)c1cccc2ccccc21 ZINC001235033274 1130703046 /nfs/dbraw/zinc/70/30/46/1130703046.db2.gz XBJLMLOFNMRNFW-OXQOHEQNSA-N 1 3 294.442 3.629 20 0 CHADHO CC1=C[C@H](C)[C@@H](C[N@@H+]2CCCC[C@@]23CCCNC3)CC1 ZINC001235171268 1130717619 /nfs/dbraw/zinc/71/76/19/1130717619.db2.gz IHKLNJCNUVTFIK-KSZLIROESA-N 1 3 276.468 3.587 20 0 CHADHO CC1=C[C@H](C)[C@@H](C[N@H+]2CCCC[C@@]23CCCNC3)CC1 ZINC001235171268 1130717628 /nfs/dbraw/zinc/71/76/28/1130717628.db2.gz IHKLNJCNUVTFIK-KSZLIROESA-N 1 3 276.468 3.587 20 0 CHADHO c1ccc2cc(C[N@@H+]3CCCCC34CCNCC4)ccc2c1 ZINC001235190971 1130720276 /nfs/dbraw/zinc/72/02/76/1130720276.db2.gz MVCVBLXRANJZIE-UHFFFAOYSA-N 1 3 294.442 3.948 20 0 CHADHO c1ccc2cc(C[N@H+]3CCCCC34CCNCC4)ccc2c1 ZINC001235190971 1130720282 /nfs/dbraw/zinc/72/02/82/1130720282.db2.gz MVCVBLXRANJZIE-UHFFFAOYSA-N 1 3 294.442 3.948 20 0 CHADHO CCCc1ccc(C[N@@H+]2CCCCC23CCNCC3)cc1 ZINC001235189355 1130721563 /nfs/dbraw/zinc/72/15/63/1130721563.db2.gz IWLWTGQZHYIZFF-UHFFFAOYSA-N 1 3 286.463 3.747 20 0 CHADHO CCCc1ccc(C[N@H+]2CCCCC23CCNCC3)cc1 ZINC001235189355 1130721567 /nfs/dbraw/zinc/72/15/67/1130721567.db2.gz IWLWTGQZHYIZFF-UHFFFAOYSA-N 1 3 286.463 3.747 20 0 CHADHO CCCc1ccc(CN2CCCCC23CC[NH2+]CC3)cc1 ZINC001235189355 1130721569 /nfs/dbraw/zinc/72/15/69/1130721569.db2.gz IWLWTGQZHYIZFF-UHFFFAOYSA-N 1 3 286.463 3.747 20 0 CHADHO c1c2ccccc2[nH]c1CN1CCC([C@@H]2CCCC[NH2+]2)CC1 ZINC001235226869 1130725059 /nfs/dbraw/zinc/72/50/59/1130725059.db2.gz BEMXRIKSBZCMQH-SFHVURJKSA-N 1 3 297.446 3.522 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CC[C@@]2(C1)CNCC[C@H]2F ZINC001235410505 1130739972 /nfs/dbraw/zinc/73/99/72/1130739972.db2.gz YILLZPCZUDEQSC-KSZLIROESA-N 1 3 296.474 3.783 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CC[C@@]2(C1)CNCC[C@H]2F ZINC001235410505 1130739976 /nfs/dbraw/zinc/73/99/76/1130739976.db2.gz YILLZPCZUDEQSC-KSZLIROESA-N 1 3 296.474 3.783 20 0 CHADHO Clc1cc(CN2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)cs1 ZINC001235426750 1130741860 /nfs/dbraw/zinc/74/18/60/1130741860.db2.gz LCYSCFOWQQHUJU-UONOGXRCSA-N 1 3 298.883 3.613 20 0 CHADHO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccc2c(c1)CNC2 ZINC001235443386 1130745357 /nfs/dbraw/zinc/74/53/57/1130745357.db2.gz NAROENKMYGANTP-HXUWFJFHSA-N 1 3 292.426 3.935 20 0 CHADHO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1ccc2c(c1)CNC2 ZINC001235443386 1130745365 /nfs/dbraw/zinc/74/53/65/1130745365.db2.gz NAROENKMYGANTP-HXUWFJFHSA-N 1 3 292.426 3.935 20 0 CHADHO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ccc3c(c2)CNC3)cc1 ZINC001235677282 1130766294 /nfs/dbraw/zinc/76/62/94/1130766294.db2.gz GECGZIBYODBFLU-HXUWFJFHSA-N 1 3 292.426 3.935 20 0 CHADHO Cc1ccc([C@H]2CCC[N@H+]2Cc2ccc3c(c2)CNC3)cc1 ZINC001235677282 1130766299 /nfs/dbraw/zinc/76/62/99/1130766299.db2.gz GECGZIBYODBFLU-HXUWFJFHSA-N 1 3 292.426 3.935 20 0 CHADHO CCC(C)(C)c1ccc(CN2CCC[C@H](C[NH3+])C2)cc1 ZINC001235676233 1130766349 /nfs/dbraw/zinc/76/63/49/1130766349.db2.gz PNDNSSIFNSVQQD-MRXNPFEDSA-N 1 3 274.452 3.545 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](C[N@@H+]2CC[C@H](CN)C2)CC1 ZINC001235751232 1130776614 /nfs/dbraw/zinc/77/66/14/1130776614.db2.gz XHZLKCGVLVOYFH-QZTJIDSGSA-N 1 3 276.468 3.740 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](C[N@H+]2CC[C@H](CN)C2)CC1 ZINC001235751232 1130776618 /nfs/dbraw/zinc/77/66/18/1130776618.db2.gz XHZLKCGVLVOYFH-QZTJIDSGSA-N 1 3 276.468 3.740 20 0 CHADHO [NH3+]C[C@@H]1CCN(Cc2ccc(/C=C/c3ccccc3)cc2)C1 ZINC001235749054 1130776691 /nfs/dbraw/zinc/77/66/91/1130776691.db2.gz GDWYNXJGVQNXJA-YJJPMGAVSA-N 1 3 292.426 3.638 20 0 CHADHO C[C@H](CN(C)C[C@@H]1CCC[NH2+]C1)c1cccc2ccccc21 ZINC001235952001 1130815713 /nfs/dbraw/zinc/81/57/13/1130815713.db2.gz WTCGRUOPISKWTD-IAGOWNOFSA-N 1 3 296.458 3.875 20 0 CHADHO C[C@H](C[N@H+](C)C[C@@H]1CCCNC1)c1cccc2ccccc21 ZINC001235952001 1130815719 /nfs/dbraw/zinc/81/57/19/1130815719.db2.gz WTCGRUOPISKWTD-IAGOWNOFSA-N 1 3 296.458 3.875 20 0 CHADHO C[C@H](C[N@@H+](C)C[C@@H]1CCCNC1)c1cccc2ccccc21 ZINC001235952001 1130815723 /nfs/dbraw/zinc/81/57/23/1130815723.db2.gz WTCGRUOPISKWTD-IAGOWNOFSA-N 1 3 296.458 3.875 20 0 CHADHO c1c(CN(Cc2ccccc2)C2CC2)sc2c1CC[NH2+]C2 ZINC001235993809 1130824918 /nfs/dbraw/zinc/82/49/18/1130824918.db2.gz QXJZZUFRZJJVMP-UHFFFAOYSA-N 1 3 298.455 3.558 20 0 CHADHO C[C@@H](CN)C[N@H+](Cc1ccccc1)[C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170731501 1130836901 /nfs/dbraw/zinc/83/69/01/1130836901.db2.gz RAXJLVXHJIHRDK-LEUOFYLZSA-N 1 3 286.463 3.518 20 0 CHADHO C[C@@H](CN)C[N@@H+](Cc1ccccc1)[C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170731501 1130836907 /nfs/dbraw/zinc/83/69/07/1130836907.db2.gz RAXJLVXHJIHRDK-LEUOFYLZSA-N 1 3 286.463 3.518 20 0 CHADHO C[C@H]1C[N@H+](Cc2ccccc2-c2ccccc2)CCCN1 ZINC001236095590 1130859868 /nfs/dbraw/zinc/85/98/68/1130859868.db2.gz WYRZIEQVJRASBD-INIZCTEOSA-N 1 3 280.415 3.537 20 0 CHADHO C[C@H]1C[N@@H+](Cc2ccccc2-c2ccccc2)CCCN1 ZINC001236095590 1130859873 /nfs/dbraw/zinc/85/98/73/1130859873.db2.gz WYRZIEQVJRASBD-INIZCTEOSA-N 1 3 280.415 3.537 20 0 CHADHO CCC[N@H+](Cc1ccc(CC(C)C)cc1)C1CCNCC1 ZINC001236182548 1130881180 /nfs/dbraw/zinc/88/11/80/1130881180.db2.gz QYEYNUQTOMNHEO-UHFFFAOYSA-N 1 3 288.479 3.849 20 0 CHADHO CCC[N@@H+](Cc1ccc(CC(C)C)cc1)C1CCNCC1 ZINC001236182548 1130881186 /nfs/dbraw/zinc/88/11/86/1130881186.db2.gz QYEYNUQTOMNHEO-UHFFFAOYSA-N 1 3 288.479 3.849 20 0 CHADHO CCCN(Cc1ccc(CC(C)C)cc1)C1CC[NH2+]CC1 ZINC001236182548 1130881192 /nfs/dbraw/zinc/88/11/92/1130881192.db2.gz QYEYNUQTOMNHEO-UHFFFAOYSA-N 1 3 288.479 3.849 20 0 CHADHO C[N@H+](Cc1cccc(C(C)(C)C)c1)[C@H]1CCCC[C@@H]1N ZINC001236213883 1130889835 /nfs/dbraw/zinc/88/98/35/1130889835.db2.gz CEIYSXNWISSYGE-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO C[N@@H+](Cc1cccc(C(C)(C)C)c1)[C@H]1CCCC[C@@H]1N ZINC001236213883 1130889840 /nfs/dbraw/zinc/88/98/40/1130889840.db2.gz CEIYSXNWISSYGE-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO C[N@H+](Cc1ccc(F)c2ccccc12)[C@@H]1CCCC[C@H]1N ZINC001236220632 1130892840 /nfs/dbraw/zinc/89/28/40/1130892840.db2.gz ZCCSGZBJBALBQD-QZTJIDSGSA-N 1 3 286.394 3.681 20 0 CHADHO C[N@@H+](Cc1ccc(F)c2ccccc12)[C@@H]1CCCC[C@H]1N ZINC001236220632 1130892848 /nfs/dbraw/zinc/89/28/48/1130892848.db2.gz ZCCSGZBJBALBQD-QZTJIDSGSA-N 1 3 286.394 3.681 20 0 CHADHO c1csc(CC[N@H+](C[C@@H]2CCCNC2)C2CCCC2)c1 ZINC001236371996 1130922648 /nfs/dbraw/zinc/92/26/48/1130922648.db2.gz PHAKDLKSXMLJBE-OAHLLOKOSA-N 1 3 292.492 3.535 20 0 CHADHO c1csc(CC[N@@H+](C[C@@H]2CCCNC2)C2CCCC2)c1 ZINC001236371996 1130922650 /nfs/dbraw/zinc/92/26/50/1130922650.db2.gz PHAKDLKSXMLJBE-OAHLLOKOSA-N 1 3 292.492 3.535 20 0 CHADHO CC(C)(C)CC[N@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236371309 1130922719 /nfs/dbraw/zinc/92/27/19/1130922719.db2.gz KXSOOVNJWSOWPC-HNNXBMFYSA-N 1 3 266.473 3.667 20 0 CHADHO CC(C)(C)CC[N@@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236371309 1130922724 /nfs/dbraw/zinc/92/27/24/1130922724.db2.gz KXSOOVNJWSOWPC-HNNXBMFYSA-N 1 3 266.473 3.667 20 0 CHADHO Fc1cccc(C[N@H+](CC2CCCC2)C2CCNCC2)c1 ZINC001236401286 1130928619 /nfs/dbraw/zinc/92/86/19/1130928619.db2.gz NRQJNVTWIXXSTM-UHFFFAOYSA-N 1 3 290.426 3.570 20 0 CHADHO Fc1cccc(C[N@@H+](CC2CCCC2)C2CCNCC2)c1 ZINC001236401286 1130928621 /nfs/dbraw/zinc/92/86/21/1130928621.db2.gz NRQJNVTWIXXSTM-UHFFFAOYSA-N 1 3 290.426 3.570 20 0 CHADHO Fc1cccc(CN(CC2CCCC2)C2CC[NH2+]CC2)c1 ZINC001236401286 1130928625 /nfs/dbraw/zinc/92/86/25/1130928625.db2.gz NRQJNVTWIXXSTM-UHFFFAOYSA-N 1 3 290.426 3.570 20 0 CHADHO CCN(Cc1c(C)sc2ccccc21)C[C@@H]1CC[NH2+]C1 ZINC001236410326 1130931300 /nfs/dbraw/zinc/93/13/00/1130931300.db2.gz YTZUUCWGUWVGPY-CQSZACIVSA-N 1 3 288.460 3.641 20 0 CHADHO CCN(Cc1ccc(C)c2ccccc12)C[C@@H]1CC[NH2+]C1 ZINC001236408008 1130931684 /nfs/dbraw/zinc/93/16/84/1130931684.db2.gz JIZUAIYUVRSVBN-MRXNPFEDSA-N 1 3 282.431 3.580 20 0 CHADHO Cc1ccc([C@@H](C)CCN(C[C@@H]2CCC[NH2+]C2)C2CC2)o1 ZINC001236584503 1130980640 /nfs/dbraw/zinc/98/06/40/1130980640.db2.gz FUJBVSVJJZDDLJ-GOEBONIOSA-N 1 3 290.451 3.546 20 0 CHADHO c1cc(CN(C[C@H]2CCC[NH2+]C2)C2CC2)c2cccccc1-2 ZINC001236601969 1130982025 /nfs/dbraw/zinc/98/20/25/1130982025.db2.gz RGFKEJOWILDANZ-INIZCTEOSA-N 1 3 294.442 3.755 20 0 CHADHO Cc1cc(F)ccc1[C@@H](C)[NH2+]C1CCN(CC2CC2)CC1 ZINC000815561951 1130999296 /nfs/dbraw/zinc/99/92/96/1130999296.db2.gz TZLPGAVCMFPQOX-CQSZACIVSA-N 1 3 290.426 3.659 20 0 CHADHO CCCCc1ccc(CN(CCC)C[C@@H]2CC[NH2+]C2)cc1 ZINC001236842662 1131020361 /nfs/dbraw/zinc/02/03/61/1131020361.db2.gz GYPCEQJASZRPRL-LJQANCHMSA-N 1 3 288.479 3.851 20 0 CHADHO CCCN(Cc1ccc(C)c(Cl)c1C)C[C@H]1CC[NH2+]C1 ZINC001236843327 1131021121 /nfs/dbraw/zinc/02/11/21/1131021121.db2.gz HNWPLSXHFZKYOM-HNNXBMFYSA-N 1 3 294.870 3.778 20 0 CHADHO CCCN(Cc1ccc2ccsc2c1)C[C@@H]1CC[NH2+]C1 ZINC001236842344 1131021995 /nfs/dbraw/zinc/02/19/95/1131021995.db2.gz FHGFNUCHDNNFPJ-OAHLLOKOSA-N 1 3 288.460 3.723 20 0 CHADHO Cc1sc2ccccc2c1CN1CCC[C@@](C)(C[NH3+])C1 ZINC001237055102 1131044150 /nfs/dbraw/zinc/04/41/50/1131044150.db2.gz ADQCDIQNOXYJGV-KRWDZBQOSA-N 1 3 288.460 3.771 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+](C)C(C)(C)C)cc21 ZINC001237880145 1131146865 /nfs/dbraw/zinc/14/68/65/1131146865.db2.gz FSIOXIBMYGCKQO-UHFFFAOYSA-N 1 3 272.436 3.918 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+](C)C(C)(C)C)cc21 ZINC001237880145 1131146867 /nfs/dbraw/zinc/14/68/67/1131146867.db2.gz FSIOXIBMYGCKQO-UHFFFAOYSA-N 1 3 272.436 3.918 20 0 CHADHO CCC[N@H+](C)Cc1ccc2c(c1)C(C(C)C)=NCC2 ZINC001237881513 1131148928 /nfs/dbraw/zinc/14/89/28/1131148928.db2.gz UXVYNNQTTHVETQ-UHFFFAOYSA-N 1 3 258.409 3.530 20 0 CHADHO CCC[N@@H+](C)Cc1ccc2c(c1)C(C(C)C)=NCC2 ZINC001237881513 1131148932 /nfs/dbraw/zinc/14/89/32/1131148932.db2.gz UXVYNNQTTHVETQ-UHFFFAOYSA-N 1 3 258.409 3.530 20 0 CHADHO C[C@H](NCc1ccc(CC[NH3+])cc1)c1csc(Cl)c1 ZINC000817949398 1131189530 /nfs/dbraw/zinc/18/95/30/1131189530.db2.gz QDDGZOCSHMQWNQ-NSHDSACASA-N 1 3 294.851 3.754 20 0 CHADHO CC1(C)Cc2occc2[C@@H](NCc2ccc(CC[NH3+])cc2)C1 ZINC000817947269 1131189554 /nfs/dbraw/zinc/18/95/54/1131189554.db2.gz AYWXYODTGFXMBB-KRWDZBQOSA-N 1 3 298.430 3.584 20 0 CHADHO CC[C@@H]([NH2+][C@H]1CCNC2(CCC2)C1)C1CCCCC1 ZINC000817987174 1131195710 /nfs/dbraw/zinc/19/57/10/1131195710.db2.gz XIFLMYSOMGVFGA-JKSUJKDBSA-N 1 3 264.457 3.610 20 0 CHADHO C(CC1CCCCCC1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246241382 1131426939 /nfs/dbraw/zinc/42/69/39/1131426939.db2.gz WVLPWKSOAYYSRU-BJWYYQGGSA-N 1 3 264.457 3.610 20 0 CHADHO C(C[N@@H+]1CCCC[C@]12CCCNC2)C1CCCCC1 ZINC000257703050 1131449501 /nfs/dbraw/zinc/44/95/01/1131449501.db2.gz LRSHSBAEWHLKIJ-QGZVFWFLSA-N 1 3 264.457 3.565 20 0 CHADHO C(C[N@H+]1CCCC[C@]12CCCNC2)C1CCCCC1 ZINC000257703050 1131449502 /nfs/dbraw/zinc/44/95/02/1131449502.db2.gz LRSHSBAEWHLKIJ-QGZVFWFLSA-N 1 3 264.457 3.565 20 0 CHADHO CC(C)C[C@H](C)C[C@@H](C)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246332458 1131473082 /nfs/dbraw/zinc/47/30/82/1131473082.db2.gz MEVQNONUQLUQKQ-DMRKSPOLSA-N 1 3 266.473 3.710 20 0 CHADHO CC(C)C1CCC([NH2+][C@H]2CCN[C@H](C(C)(C)C)C2)CC1 ZINC001246335625 1131474173 /nfs/dbraw/zinc/47/41/73/1131474173.db2.gz LEMHADSARFSRRZ-GQGLESIBSA-N 1 3 280.500 3.958 20 0 CHADHO CCC1([NH2+]C2CCC3(CCCC3)CC2)CCNCC1 ZINC001246422242 1131499996 /nfs/dbraw/zinc/49/99/96/1131499996.db2.gz BBFWOWXHCBKGTM-UHFFFAOYSA-N 1 3 264.457 3.611 20 0 CHADHO CCCC(C[NH3+])(CCC)N[C@@H]1CSc2ccccc2C1 ZINC001246504306 1131534350 /nfs/dbraw/zinc/53/43/50/1131534350.db2.gz PKJQGIYWUOXLCE-HNNXBMFYSA-N 1 3 292.492 3.591 20 0 CHADHO CCCCCC1CCC([NH2+][C@H](CC)C2CNC2)CC1 ZINC001246517920 1131544899 /nfs/dbraw/zinc/54/48/99/1131544899.db2.gz NPIUMYPTTSBYQH-BDVYOWHSSA-N 1 3 266.473 3.713 20 0 CHADHO CCC[C@H](C)CC[C@@H](C)[NH2+][C@@H](C1CCC1)C1CNC1 ZINC001246519209 1131545903 /nfs/dbraw/zinc/54/59/03/1131545903.db2.gz QSVLIDOQTYMPMZ-VBQJREDUSA-N 1 3 266.473 3.569 20 0 CHADHO CCCC[C@@H]1C[C@@H]([NH2+][C@H]2CCCC23CCC3)CCN1 ZINC001246522601 1131548163 /nfs/dbraw/zinc/54/81/63/1131548163.db2.gz DWFFNVVBDGTSRO-PMPSAXMXSA-N 1 3 264.457 3.610 20 0 CHADHO CCCC[C@H](CC(C)C)[N@@H+]1CCC(F)(F)[C@@H](CN)C1 ZINC001246555811 1131617327 /nfs/dbraw/zinc/61/73/27/1131617327.db2.gz HUJUTRVSUNMIPV-UONOGXRCSA-N 1 3 276.415 3.507 20 0 CHADHO CCCC[C@H](CC(C)C)[N@H+]1CCC(F)(F)[C@@H](CN)C1 ZINC001246555811 1131617329 /nfs/dbraw/zinc/61/73/29/1131617329.db2.gz HUJUTRVSUNMIPV-UONOGXRCSA-N 1 3 276.415 3.507 20 0 CHADHO C[C@@H]1CCCC[N@@H+]([C@H]2CCNC3(CCCCC3)C2)C1 ZINC001246557873 1131620664 /nfs/dbraw/zinc/62/06/64/1131620664.db2.gz LQLASSOJHNABMA-CVEARBPZSA-N 1 3 264.457 3.563 20 0 CHADHO C[C@@H]1CCCC[N@H+]([C@H]2CCNC3(CCCCC3)C2)C1 ZINC001246557873 1131620666 /nfs/dbraw/zinc/62/06/66/1131620666.db2.gz LQLASSOJHNABMA-CVEARBPZSA-N 1 3 264.457 3.563 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[N@@H+]1CCC[C@H](CN)[C@@H]1C ZINC001246567230 1131634422 /nfs/dbraw/zinc/63/44/22/1131634422.db2.gz WHJDCOWCJYNWRL-YHUYYLMFSA-N 1 3 254.462 3.506 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[N@H+]1CCC[C@H](CN)[C@@H]1C ZINC001246567230 1131634424 /nfs/dbraw/zinc/63/44/24/1131634424.db2.gz WHJDCOWCJYNWRL-YHUYYLMFSA-N 1 3 254.462 3.506 20 0 CHADHO NC[C@@H]1CCCC[N@@H+](C2CCC3(CCCCC3)CC2)C1 ZINC001246583824 1131690488 /nfs/dbraw/zinc/69/04/88/1131690488.db2.gz SDKJOPYMAXMYER-INIZCTEOSA-N 1 3 278.484 3.940 20 0 CHADHO NC[C@@H]1CCCC[N@H+](C2CCC3(CCCCC3)CC2)C1 ZINC001246583824 1131690490 /nfs/dbraw/zinc/69/04/90/1131690490.db2.gz SDKJOPYMAXMYER-INIZCTEOSA-N 1 3 278.484 3.940 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[N@@H+]1C[C@@H](CN)CC[C@@H]1C ZINC001246594374 1131709227 /nfs/dbraw/zinc/70/92/27/1131709227.db2.gz VMYXGTXNUGELRM-YHUYYLMFSA-N 1 3 254.462 3.651 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[N@H+]1C[C@@H](CN)CC[C@@H]1C ZINC001246594374 1131709231 /nfs/dbraw/zinc/70/92/31/1131709231.db2.gz VMYXGTXNUGELRM-YHUYYLMFSA-N 1 3 254.462 3.651 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@H+](C)CC2CCCCC2)CCN1 ZINC001246843473 1131787866 /nfs/dbraw/zinc/78/78/66/1131787866.db2.gz CPGDQZZKGHKDLV-IAGOWNOFSA-N 1 3 266.473 3.809 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@@H+](C)CC2CCCCC2)CCN1 ZINC001246843473 1131787869 /nfs/dbraw/zinc/78/78/69/1131787869.db2.gz CPGDQZZKGHKDLV-IAGOWNOFSA-N 1 3 266.473 3.809 20 0 CHADHO C[C@@H]1CCC[C@@H]([N@H+](C[C@H]2CCCNC2)C2CCCC2)C1 ZINC001246934934 1131822984 /nfs/dbraw/zinc/82/29/84/1131822984.db2.gz DCFDWCAWWIZFLI-SOLBZPMBSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H]1CCC[C@@H]([N@@H+](C[C@H]2CCCNC2)C2CCCC2)C1 ZINC001246934934 1131822989 /nfs/dbraw/zinc/82/29/89/1131822989.db2.gz DCFDWCAWWIZFLI-SOLBZPMBSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H]1[C@H]([NH3+])CCCN1[C@H]1CCCC2(CCCCC2)C1 ZINC001246940567 1131825787 /nfs/dbraw/zinc/82/57/87/1131825787.db2.gz WWFJSSCGCIQVPS-OWCLPIDISA-N 1 3 264.457 3.691 20 0 CHADHO CC1CCC([N@H+](C[C@@H]2CCCNC2)C2CCCC2)CC1 ZINC001246941206 1131826665 /nfs/dbraw/zinc/82/66/65/1131826665.db2.gz YDMLSKAYKFAXRB-UPTPFMHGSA-N 1 3 278.484 3.809 20 0 CHADHO CC1CCC([N@@H+](C[C@@H]2CCCNC2)C2CCCC2)CC1 ZINC001246941206 1131826669 /nfs/dbraw/zinc/82/66/69/1131826669.db2.gz YDMLSKAYKFAXRB-UPTPFMHGSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@H]1CCCC[N@@H+](C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001171631731 1132064376 /nfs/dbraw/zinc/06/43/76/1132064376.db2.gz MNGDHOKUASAJIY-AWEZNQCLSA-N 1 3 266.473 3.760 20 0 CHADHO C[C@H]1CCCC[N@H+](C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001171631731 1132064382 /nfs/dbraw/zinc/06/43/82/1132064382.db2.gz MNGDHOKUASAJIY-AWEZNQCLSA-N 1 3 266.473 3.760 20 0 CHADHO CN1C(C)(C)CC([NH2+]C2CCCCCC2)CC1(C)C ZINC001171617634 1132065371 /nfs/dbraw/zinc/06/53/71/1132065371.db2.gz OVXSAVAGINRINI-UHFFFAOYSA-N 1 3 266.473 3.950 20 0 CHADHO CN1C(C)(C)CC([NH2+]CCCc2ccccc2)CC1(C)C ZINC001171617349 1132065838 /nfs/dbraw/zinc/06/58/38/1132065838.db2.gz KGOPZQBUPDEIIC-UHFFFAOYSA-N 1 3 288.479 3.860 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H](C)CCc1ccc(C)cc1 ZINC001171656104 1132068903 /nfs/dbraw/zinc/06/89/03/1132068903.db2.gz UCVUWLYJFJZSCK-KRWDZBQOSA-N 1 3 276.468 3.638 20 0 CHADHO CCN(C)C1CC[NH+]([C@@H](C)CCc2ccc(C)cc2)CC1 ZINC001171682821 1132079014 /nfs/dbraw/zinc/07/90/14/1132079014.db2.gz XDXMMCMZGLRYKO-KRWDZBQOSA-N 1 3 288.479 3.732 20 0 CHADHO C[C@H]1CCN1[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172070354 1132121495 /nfs/dbraw/zinc/12/14/95/1132121495.db2.gz ZNTOODNQLPJTFK-GDAAHCPNSA-N 1 3 284.447 3.666 20 0 CHADHO C[C@H]1CCN1[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172070354 1132121499 /nfs/dbraw/zinc/12/14/99/1132121499.db2.gz ZNTOODNQLPJTFK-GDAAHCPNSA-N 1 3 284.447 3.666 20 0 CHADHO CC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)N2C)c1ccc(C)o1 ZINC001172112418 1132133458 /nfs/dbraw/zinc/13/34/58/1132133458.db2.gz WDAWGHBRUBQGEU-LVQVYYBASA-N 1 3 276.424 3.644 20 0 CHADHO CCC(CC)N1CCC([NH2+][C@H](C)CCO[C@@H](C)CC)CC1 ZINC001172332342 1132172565 /nfs/dbraw/zinc/17/25/65/1132172565.db2.gz DNLAHDSAYQZDBZ-CVEARBPZSA-N 1 3 298.515 3.823 20 0 CHADHO CC[C@@H](C)OCC[C@H](C)[NH2+]C1CCN(C2CCCC2)CC1 ZINC001172343753 1132178173 /nfs/dbraw/zinc/17/81/73/1132178173.db2.gz RKCLJFXNPNJLNX-JKSUJKDBSA-N 1 3 296.499 3.577 20 0 CHADHO CCCCCC[C@H](CCC)[NH+]1CCC(C)(N)CC1 ZINC001172391715 1132215874 /nfs/dbraw/zinc/21/58/74/1132215874.db2.gz SWUWDTDRDHQPHA-HNNXBMFYSA-N 1 3 254.462 3.939 20 0 CHADHO c1ccc([C@@H]2CCC[C@@H]([NH2+]CCCN3CCCC3)C2)cc1 ZINC001172536457 1132274284 /nfs/dbraw/zinc/27/42/84/1132274284.db2.gz XWRAUUVRLNALQF-RTBURBONSA-N 1 3 286.463 3.788 20 0 CHADHO CCN(Cc1ccc(-c2ccccc2)o1)C1CC[NH+](C)CC1 ZINC001231813168 1132369901 /nfs/dbraw/zinc/36/99/01/1132369901.db2.gz TYEKNWNZOVYANV-UHFFFAOYSA-N 1 3 298.430 3.863 20 0 CHADHO Cc1ccc2ccccc2c1CN1CCC([NH+]2CCC2)CC1 ZINC001142388244 1132380656 /nfs/dbraw/zinc/38/06/56/1132380656.db2.gz RSNKZMIKDKOOHR-UHFFFAOYSA-N 1 3 294.442 3.818 20 0 CHADHO CC[N@H+](Cc1cc2cnccc2[nH]1)C1CCCCC1 ZINC001232010460 1132410357 /nfs/dbraw/zinc/41/03/57/1132410357.db2.gz FLGPWLBNTIPKGE-UHFFFAOYSA-N 1 3 257.381 3.718 20 0 CHADHO CC[N@@H+](Cc1cc2cnccc2[nH]1)C1CCCCC1 ZINC001232010460 1132410359 /nfs/dbraw/zinc/41/03/59/1132410359.db2.gz FLGPWLBNTIPKGE-UHFFFAOYSA-N 1 3 257.381 3.718 20 0 CHADHO Cc1cccc(CC[N@@H+](C)Cc2cc3cnccc3[nH]2)c1 ZINC001232014266 1132410773 /nfs/dbraw/zinc/41/07/73/1132410773.db2.gz MNNFGVAZABFRPV-UHFFFAOYSA-N 1 3 279.387 3.546 20 0 CHADHO Cc1cccc(CC[N@H+](C)Cc2cc3cnccc3[nH]2)c1 ZINC001232014266 1132410778 /nfs/dbraw/zinc/41/07/78/1132410778.db2.gz MNNFGVAZABFRPV-UHFFFAOYSA-N 1 3 279.387 3.546 20 0 CHADHO c1c2c[nH]ccc-2nc1C[N@@H+]1CC[C@@H](c2ccccc2)C1 ZINC001232011471 1132411373 /nfs/dbraw/zinc/41/13/73/1132411373.db2.gz LUEUZXSFCWNWKR-OAHLLOKOSA-N 1 3 277.371 3.552 20 0 CHADHO c1c2c[nH]ccc-2nc1C[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC001232011471 1132411379 /nfs/dbraw/zinc/41/13/79/1132411379.db2.gz LUEUZXSFCWNWKR-OAHLLOKOSA-N 1 3 277.371 3.552 20 0 CHADHO CN(C)Cc1cc(F)cc(C[NH+]2C3CCCC2CCC3)c1 ZINC001232150487 1132427027 /nfs/dbraw/zinc/42/70/27/1132427027.db2.gz WZSHGJALGHZFLQ-UHFFFAOYSA-N 1 3 290.426 3.794 20 0 CHADHO C[C@@H]1CCC[N@H+](Cc2cc(F)cc(CN(C)C)c2)CC1 ZINC001232145271 1132427072 /nfs/dbraw/zinc/42/70/72/1132427072.db2.gz ZXXVSTAAGWNEBW-CQSZACIVSA-N 1 3 278.415 3.509 20 0 CHADHO C[C@@H]1CCC[N@@H+](Cc2cc(F)cc(CN(C)C)c2)CC1 ZINC001232145271 1132427074 /nfs/dbraw/zinc/42/70/74/1132427074.db2.gz ZXXVSTAAGWNEBW-CQSZACIVSA-N 1 3 278.415 3.509 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@@H+]2CCC3(CCCC3)C2)c1 ZINC001232145917 1132428616 /nfs/dbraw/zinc/42/86/16/1132428616.db2.gz DSDDLFVFGBQNCC-UHFFFAOYSA-N 1 3 290.426 3.653 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@H+]2CCC3(CCCC3)C2)c1 ZINC001232145917 1132428619 /nfs/dbraw/zinc/42/86/19/1132428619.db2.gz DSDDLFVFGBQNCC-UHFFFAOYSA-N 1 3 290.426 3.653 20 0 CHADHO CC[C@@H]1CC[C@H]([NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC001173266467 1132433179 /nfs/dbraw/zinc/43/31/79/1132433179.db2.gz FSMKRSAKZKJQPS-ZBFHGGJFSA-N 1 3 264.457 3.562 20 0 CHADHO CCSC[C@@H](C)[NH2+]C1CCN(C[C@@H]2CC=CCC2)CC1 ZINC001173297301 1132445637 /nfs/dbraw/zinc/44/56/37/1132445637.db2.gz CZHQZZIGLBJTHX-HZPDHXFCSA-N 1 3 296.524 3.538 20 0 CHADHO CCSC[C@@H](C)NC1CC[NH+](C[C@@H]2CC=CCC2)CC1 ZINC001173297301 1132445639 /nfs/dbraw/zinc/44/56/39/1132445639.db2.gz CZHQZZIGLBJTHX-HZPDHXFCSA-N 1 3 296.524 3.538 20 0 CHADHO CN1CCC[C@H]1CC[NH2+][C@@H]1CCCC2(CCCCC2)C1 ZINC001173349787 1132474724 /nfs/dbraw/zinc/47/47/24/1132474724.db2.gz UKWXUEAQWNYKAL-SJORKVTESA-N 1 3 278.484 3.953 20 0 CHADHO CCCN(CCC[NH+](C)C)Cc1cc(C)c(C)s1 ZINC001233700479 1132665716 /nfs/dbraw/zinc/66/57/16/1132665716.db2.gz NPMOZUBDDAHZTG-UHFFFAOYSA-N 1 3 268.470 3.529 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+](C[C@@H]2CCCC(C)(C)C2)C1 ZINC001204161893 1133411763 /nfs/dbraw/zinc/41/17/63/1133411763.db2.gz HNAMINCQACIZNO-SJORKVTESA-N 1 3 280.500 3.867 20 0 CHADHO CC1=CCC[C@@H](C)[C@H]1C[NH+]1CCC(N2CCCCC2)CC1 ZINC001205192984 1133544110 /nfs/dbraw/zinc/54/41/10/1133544110.db2.gz GRXNAYUIMDAAJE-MJGOQNOKSA-N 1 3 290.495 3.929 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@H+]1CC[C@@H](N)[C@H]1C ZINC001205190901 1133544520 /nfs/dbraw/zinc/54/45/20/1133544520.db2.gz RUUZCDCVELTKDH-DNVCBOLYSA-N 1 3 280.415 3.584 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@@H+]1CC[C@@H](N)[C@H]1C ZINC001205190901 1133544521 /nfs/dbraw/zinc/54/45/21/1133544521.db2.gz RUUZCDCVELTKDH-DNVCBOLYSA-N 1 3 280.415 3.584 20 0 CHADHO CCCCOc1cccc(CN2CCC[C@@](C)([NH3+])CC2)c1 ZINC001205273248 1133553479 /nfs/dbraw/zinc/55/34/79/1133553479.db2.gz ISZFSNWXOYTZFY-GOSISDBHSA-N 1 3 290.451 3.569 20 0 CHADHO C[C@@H]1CCNCC[N@@H+]1Cc1c2ccccc2[nH]c1C(C)(C)C ZINC001205324708 1133561430 /nfs/dbraw/zinc/56/14/30/1133561430.db2.gz FNAOHHYUVDYHID-CQSZACIVSA-N 1 3 299.462 3.649 20 0 CHADHO C[C@@H]1CCNCC[N@H+]1Cc1c2ccccc2[nH]c1C(C)(C)C ZINC001205324708 1133561432 /nfs/dbraw/zinc/56/14/32/1133561432.db2.gz FNAOHHYUVDYHID-CQSZACIVSA-N 1 3 299.462 3.649 20 0 CHADHO C[C@@H]1CCNCC[N@@H+]1Cc1ccccc1-c1ccccc1 ZINC001205332552 1133563452 /nfs/dbraw/zinc/56/34/52/1133563452.db2.gz RQMBRENQIHZGIK-MRXNPFEDSA-N 1 3 280.415 3.537 20 0 CHADHO C[C@@H]1CCNCC[N@H+]1Cc1ccccc1-c1ccccc1 ZINC001205332552 1133563454 /nfs/dbraw/zinc/56/34/54/1133563454.db2.gz RQMBRENQIHZGIK-MRXNPFEDSA-N 1 3 280.415 3.537 20 0 CHADHO CC[C@@H](C)[C@H](CNC(C)(C)CC[NH+]1CCCCCC1)OC ZINC001205470625 1133580049 /nfs/dbraw/zinc/58/00/49/1133580049.db2.gz AYVKASDWAGAVSL-SJORKVTESA-N 1 3 298.515 3.682 20 0 CHADHO Cc1cc(F)cc(CN2CC[C@@H](C)[C@@H](C[NH3+])CC2)c1Cl ZINC001205654551 1133599292 /nfs/dbraw/zinc/59/92/92/1133599292.db2.gz XFADOIHNWFZTNI-DGCLKSJQSA-N 1 3 298.833 3.594 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CCC[C@H](CN)[C@H]1C ZINC001205902587 1133629109 /nfs/dbraw/zinc/62/91/09/1133629109.db2.gz KSIXHALIWPXQDF-OSNZYPHYSA-N 1 3 266.473 3.962 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CCC[C@H](CN)[C@H]1C ZINC001205902587 1133629112 /nfs/dbraw/zinc/62/91/12/1133629112.db2.gz KSIXHALIWPXQDF-OSNZYPHYSA-N 1 3 266.473 3.962 20 0 CHADHO C[C@@H]1[C@H](CN)CCC[N@@H+]1C[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC001205901713 1133629286 /nfs/dbraw/zinc/62/92/86/1133629286.db2.gz FNHRYOPWCDGUAO-DYWXZXKOSA-N 1 3 292.854 3.503 20 0 CHADHO C[C@@H]1[C@H](CN)CCC[N@H+]1C[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC001205901713 1133629290 /nfs/dbraw/zinc/62/92/90/1133629290.db2.gz FNHRYOPWCDGUAO-DYWXZXKOSA-N 1 3 292.854 3.503 20 0 CHADHO CCC(C)(C)c1ccc(CN2CCC[C@H](C[NH3+])[C@@H]2C)cc1 ZINC001205915622 1133630357 /nfs/dbraw/zinc/63/03/57/1133630357.db2.gz QBHYTVOJOALMKM-DOTOQJQBSA-N 1 3 288.479 3.933 20 0 CHADHO Cc1ccc2ccccc2c1C[N@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001205917428 1133630536 /nfs/dbraw/zinc/63/05/36/1133630536.db2.gz YOSVWKMBDXXAFQ-RDJZCZTQSA-N 1 3 282.431 3.707 20 0 CHADHO Cc1ccc2ccccc2c1C[N@@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001205917428 1133630538 /nfs/dbraw/zinc/63/05/38/1133630538.db2.gz YOSVWKMBDXXAFQ-RDJZCZTQSA-N 1 3 282.431 3.707 20 0 CHADHO Cc1c(C[N@H+]2CCCNC[C@@H]2C)cccc1-c1ccccc1 ZINC001206263242 1133678421 /nfs/dbraw/zinc/67/84/21/1133678421.db2.gz SNUXIDQESIXJGB-INIZCTEOSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1c(C[N@@H+]2CCCNC[C@@H]2C)cccc1-c1ccccc1 ZINC001206263242 1133678425 /nfs/dbraw/zinc/67/84/25/1133678425.db2.gz SNUXIDQESIXJGB-INIZCTEOSA-N 1 3 294.442 3.846 20 0 CHADHO CC(C)N(Cc1cc2ccccc2o1)[C@H]1CCC[NH2+]CC1 ZINC001206589054 1133723167 /nfs/dbraw/zinc/72/31/67/1133723167.db2.gz FKAPGMPDGQAESI-INIZCTEOSA-N 1 3 286.419 3.785 20 0 CHADHO CC(C)N(Cc1cc2ccccc2n1C)[C@@H]1CCC[NH2+]CC1 ZINC001206588945 1133723497 /nfs/dbraw/zinc/72/34/97/1133723497.db2.gz DNTLFXANDMENHH-QGZVFWFLSA-N 1 3 299.462 3.531 20 0 CHADHO CCCCc1ccc(CN2CCCC[C@@H](C[NH3+])C2)s1 ZINC001206615550 1133728040 /nfs/dbraw/zinc/72/80/40/1133728040.db2.gz ILJPZCKVWJLTAY-AWEZNQCLSA-N 1 3 280.481 3.652 20 0 CHADHO C[C@@H]1CC[C@H](CN)C[N@@H+]1C[C@H]1C[C@@H]1c1ccc(Cl)cc1 ZINC001206761155 1133743956 /nfs/dbraw/zinc/74/39/56/1133743956.db2.gz VDYWENKSBOMRBF-GKLJAUDBSA-N 1 3 292.854 3.503 20 0 CHADHO C[C@@H]1CC[C@H](CN)C[N@H+]1C[C@H]1C[C@@H]1c1ccc(Cl)cc1 ZINC001206761155 1133743959 /nfs/dbraw/zinc/74/39/59/1133743959.db2.gz VDYWENKSBOMRBF-GKLJAUDBSA-N 1 3 292.854 3.503 20 0 CHADHO C[C@@H]1CC[C@@H](C[NH3+])CN1Cc1ccc(F)c2ccccc12 ZINC001206767882 1133745799 /nfs/dbraw/zinc/74/57/99/1133745799.db2.gz FVSBECOTBMGAFL-KGLIPLIRSA-N 1 3 286.394 3.538 20 0 CHADHO CC[N@H+](Cc1cccc(Cl)c1)CC(C)(C)CN(C)C ZINC001207288212 1133789328 /nfs/dbraw/zinc/78/93/28/1133789328.db2.gz JYJUMFGPAYDYJU-UHFFFAOYSA-N 1 3 282.859 3.750 20 0 CHADHO CC[N@@H+](Cc1cccc(Cl)c1)CC(C)(C)CN(C)C ZINC001207288212 1133789333 /nfs/dbraw/zinc/78/93/33/1133789333.db2.gz JYJUMFGPAYDYJU-UHFFFAOYSA-N 1 3 282.859 3.750 20 0 CHADHO CC1=C[C@H](C)[C@@H](C[NH+]2CCC(N3CCCCC3)CC2)CC1 ZINC001208160169 1133890668 /nfs/dbraw/zinc/89/06/68/1133890668.db2.gz GBFJEJZIEXSJSU-ZWKOTPCHSA-N 1 3 290.495 3.929 20 0 CHADHO CC1=C[C@H](C)[C@@H](CN2CCC([NH+]3CCCCC3)CC2)CC1 ZINC001208160169 1133890673 /nfs/dbraw/zinc/89/06/73/1133890673.db2.gz GBFJEJZIEXSJSU-ZWKOTPCHSA-N 1 3 290.495 3.929 20 0 CHADHO c1ccc(CN2CCC[C@H](C[N@@H+]3CC4CCC3CC4)C2)cc1 ZINC001208940637 1133968004 /nfs/dbraw/zinc/96/80/04/1133968004.db2.gz UAUYYKSIWPWLFF-GPJFCIFZSA-N 1 3 298.474 3.773 20 0 CHADHO c1ccc(CN2CCC[C@H](C[N@H+]3CC4CCC3CC4)C2)cc1 ZINC001208940637 1133968007 /nfs/dbraw/zinc/96/80/07/1133968007.db2.gz UAUYYKSIWPWLFF-GPJFCIFZSA-N 1 3 298.474 3.773 20 0 CHADHO C[C@@H](c1cccc(O[C@H]2CNCc3ccccc32)c1)[NH+](C)C ZINC001218487975 1135115320 /nfs/dbraw/zinc/11/53/20/1135115320.db2.gz LECCXGKNGLPTRE-LIRRHRJNSA-N 1 3 296.414 3.533 20 0 CHADHO CC(C)(CC[N@@H+]1CCC[C@]12CCCNC2)c1ccccc1 ZINC001222230622 1135211079 /nfs/dbraw/zinc/21/10/79/1135211079.db2.gz BQXPRCOXAOVMJY-IBGZPJMESA-N 1 3 286.463 3.572 20 0 CHADHO CC(C)(CC[N@H+]1CCC[C@]12CCCNC2)c1ccccc1 ZINC001222230622 1135211083 /nfs/dbraw/zinc/21/10/83/1135211083.db2.gz BQXPRCOXAOVMJY-IBGZPJMESA-N 1 3 286.463 3.572 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@@H+]1CCC[C@]2(CCCNC2)C1 ZINC001222259382 1135215923 /nfs/dbraw/zinc/21/59/23/1135215923.db2.gz OJUCDPHUSYLGGW-MSOLQXFVSA-N 1 3 278.484 3.835 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@H+]1CCC[C@]2(CCCNC2)C1 ZINC001222259382 1135215927 /nfs/dbraw/zinc/21/59/27/1135215927.db2.gz OJUCDPHUSYLGGW-MSOLQXFVSA-N 1 3 278.484 3.835 20 0 CHADHO Cc1c2ccccc2[nH]c1CN1CCC[C@@]12CCC[NH2+]CC2 ZINC001222314823 1135224091 /nfs/dbraw/zinc/22/40/91/1135224091.db2.gz IWPFCBQQVNWSBQ-LJQANCHMSA-N 1 3 297.446 3.584 20 0 CHADHO c1cc2cc(CN3CCC[C@@]34CCC[NH2+]CC4)ccc2o1 ZINC001222315620 1135224333 /nfs/dbraw/zinc/22/43/33/1135224333.db2.gz OZNUBDCALWWIOK-GOSISDBHSA-N 1 3 284.403 3.541 20 0 CHADHO c1cc2cc(CN3CCC[C@]34CCC[NH2+]CC4)ccc2o1 ZINC001222315622 1135224457 /nfs/dbraw/zinc/22/44/57/1135224457.db2.gz OZNUBDCALWWIOK-SFHVURJKSA-N 1 3 284.403 3.541 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@@H+]1CC[C@]2(C1)CCCCN2 ZINC001222421723 1135239152 /nfs/dbraw/zinc/23/91/52/1135239152.db2.gz OYTLDTBPVZUVCA-IRXDYDNUSA-N 1 3 264.457 3.587 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@H+]1CC[C@]2(C1)CCCCN2 ZINC001222421723 1135239155 /nfs/dbraw/zinc/23/91/55/1135239155.db2.gz OYTLDTBPVZUVCA-IRXDYDNUSA-N 1 3 264.457 3.587 20 0 CHADHO C[N@@H+]1CC[C@H](N[C@@H]2CCCc3sccc32)[C@H]2CCC[C@@H]21 ZINC000353668105 529807245 /nfs/dbraw/zinc/80/72/45/529807245.db2.gz FTDGOSHKNZVOQN-OJLVUWQFSA-N 1 3 290.476 3.588 20 0 CHADHO C[N@H+]1CC[C@H](N[C@@H]2CCCc3sccc32)[C@H]2CCC[C@@H]21 ZINC000353668105 529807246 /nfs/dbraw/zinc/80/72/46/529807246.db2.gz FTDGOSHKNZVOQN-OJLVUWQFSA-N 1 3 290.476 3.588 20 0 CHADHO COc1cccc([C@@H](C)NCc2ccc(C[NH+](C)C)cc2)c1 ZINC000171129810 335056229 /nfs/dbraw/zinc/05/62/29/335056229.db2.gz IQHRLVNSWQRGEP-OAHLLOKOSA-N 1 3 298.430 3.608 20 0 CHADHO CCC[NH+]1CCC(N[C@@H](CC)c2ccccc2)CC1 ZINC000020189640 171055342 /nfs/dbraw/zinc/05/53/42/171055342.db2.gz ZDQGQMAKOFLCRA-KRWDZBQOSA-N 1 3 260.425 3.602 20 0 CHADHO CC[C@@H]([NH2+]CCCN1CCCC1)c1cccc(Cl)c1 ZINC000021030569 171291711 /nfs/dbraw/zinc/29/17/11/171291711.db2.gz LJZHWJOOCUJDTN-MRXNPFEDSA-N 1 3 280.843 3.867 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)c1ccc(F)cc1)CN1CCCCC1 ZINC000038041767 174043179 /nfs/dbraw/zinc/04/31/79/174043179.db2.gz KFXAHBKCQMMYIG-CABCVRRESA-N 1 3 278.415 3.598 20 0 CHADHO C[C@@H]([NH2+]C[C@H](C)CN1CCCCC1)c1cccc(F)c1 ZINC000038041856 174044028 /nfs/dbraw/zinc/04/40/28/174044028.db2.gz JHPQZGMGIGCPPT-LSDHHAIUSA-N 1 3 278.415 3.598 20 0 CHADHO CC[C@@H]([NH2+]CCCN1CCCCC1)c1ccccc1OC ZINC000037229257 260075721 /nfs/dbraw/zinc/07/57/21/260075721.db2.gz ZMUNHQAYDDCYDR-QGZVFWFLSA-N 1 3 290.451 3.612 20 0 CHADHO C[C@H]1CC(C)(C)C[C@@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000193140396 228139287 /nfs/dbraw/zinc/13/92/87/228139287.db2.gz QIPZDVLCZASBJC-YOEHRIQHSA-N 1 3 278.484 3.808 20 0 CHADHO CCCN1CC[C@H](C[NH2+]C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000187705768 260042690 /nfs/dbraw/zinc/04/26/90/260042690.db2.gz BWZBXTVZQLCQEC-HUUCEWRRSA-N 1 3 294.870 3.765 20 0 CHADHO CC[NH+]1CCC(N[C@@H](C)c2ccc(OC(C)C)cc2)CC1 ZINC000037878835 260118973 /nfs/dbraw/zinc/11/89/73/260118973.db2.gz VYHNAVSVIJXEGE-HNNXBMFYSA-N 1 3 290.451 3.609 20 0 CHADHO C[C@H](C[NH2+]C1CCC(c2ccccc2)CC1)CN(C)C ZINC000312566865 260151024 /nfs/dbraw/zinc/15/10/24/260151024.db2.gz UHMAJFUYUDDPJC-FAEJEUNOSA-N 1 3 274.452 3.500 20 0 CHADHO C[NH2+]C[C@H]1CCN([C@@H](C)c2ccc(C(C)(C)C)cc2)C1 ZINC000071141968 260159902 /nfs/dbraw/zinc/15/99/02/260159902.db2.gz ZQYGNDAMHTVBMV-LSDHHAIUSA-N 1 3 274.452 3.586 20 0 CHADHO C[C@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1cccs1 ZINC000037786278 260163846 /nfs/dbraw/zinc/16/38/46/260163846.db2.gz QDQWYBYOJNCRJO-LBPRGKRZSA-N 1 3 266.454 3.662 20 0 CHADHO CC[NH+](CC)Cc1ccccc1CN[C@@H](C)c1ccncc1 ZINC000074335608 260165050 /nfs/dbraw/zinc/16/50/50/260165050.db2.gz UROXRCFOWFTVEZ-INIZCTEOSA-N 1 3 297.446 3.774 20 0 CHADHO C[C@@H](C[NH2+][C@H]1CCc2c1cccc2F)CN1CCCCC1 ZINC000211628177 260308173 /nfs/dbraw/zinc/30/81/73/260308173.db2.gz DKVXLPJLJZCKDC-KSSFIOAISA-N 1 3 290.426 3.525 20 0 CHADHO C[C@@H]1C[C@H](NCc2ccc(C(C)(C)C)cc2)CC[N@@H+]1C ZINC000090721264 260392844 /nfs/dbraw/zinc/39/28/44/260392844.db2.gz ODHSOFJSMAUKQW-RHSMWYFYSA-N 1 3 274.452 3.556 20 0 CHADHO C[C@@H]1C[C@H](NCc2ccc(C(C)(C)C)cc2)CC[N@H+]1C ZINC000090721264 260392845 /nfs/dbraw/zinc/39/28/45/260392845.db2.gz ODHSOFJSMAUKQW-RHSMWYFYSA-N 1 3 274.452 3.556 20 0 CHADHO C[C@@H](NCCCCC[NH+]1CCCCC1)c1ccco1 ZINC000164634999 261356019 /nfs/dbraw/zinc/35/60/19/261356019.db2.gz WQSHKTNRBHCLSJ-OAHLLOKOSA-N 1 3 264.413 3.586 20 0 CHADHO CC(C)[N@H+](C)Cc1ccccc1CN[C@@H](C)c1ccncc1 ZINC000173915273 261550121 /nfs/dbraw/zinc/55/01/21/261550121.db2.gz ORURQTVZWXHADO-INIZCTEOSA-N 1 3 297.446 3.773 20 0 CHADHO CC(C)[N@@H+](C)Cc1ccccc1CN[C@@H](C)c1ccncc1 ZINC000173915273 261550123 /nfs/dbraw/zinc/55/01/23/261550123.db2.gz ORURQTVZWXHADO-INIZCTEOSA-N 1 3 297.446 3.773 20 0 CHADHO Cc1cncc([C@H](C)NCCCC[N@@H+]2CCC[C@H](C)C2)c1 ZINC000184281082 262014595 /nfs/dbraw/zinc/01/45/95/262014595.db2.gz PBWLWDIIHPGPKT-RDJZCZTQSA-N 1 3 289.467 3.553 20 0 CHADHO Cc1cncc([C@H](C)NCCCC[N@H+]2CCC[C@H](C)C2)c1 ZINC000184281082 262014597 /nfs/dbraw/zinc/01/45/97/262014597.db2.gz PBWLWDIIHPGPKT-RDJZCZTQSA-N 1 3 289.467 3.553 20 0 CHADHO CCC[NH+]1CCC(N[C@@H](C)c2ccc(C)cc2C)CC1 ZINC000020189822 262233402 /nfs/dbraw/zinc/23/34/02/262233402.db2.gz BHRIJWQTYOATDV-INIZCTEOSA-N 1 3 274.452 3.828 20 0 CHADHO N[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCCC2(F)F)c2ccccc21 ZINC000390669870 262237797 /nfs/dbraw/zinc/23/77/97/262237797.db2.gz RTQRAOTVVMYRQY-GLQYFDAESA-N 1 3 280.362 3.546 20 0 CHADHO Cc1nc(C)c([C@H](C)[NH2+]C2CCN(CC(C)C)CC2)s1 ZINC000221943407 262332975 /nfs/dbraw/zinc/33/29/75/262332975.db2.gz HNFAFKUXQQWYQC-ZDUSSCGKSA-N 1 3 295.496 3.531 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@@H]1C[C@@H](C)c2ccccc21 ZINC000311720997 262339952 /nfs/dbraw/zinc/33/99/52/262339952.db2.gz PCTVMWVKJLIYJS-RHSMWYFYSA-N 1 3 260.425 3.555 20 0 CHADHO CC(C)[C@H](C)[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000390782842 262346005 /nfs/dbraw/zinc/34/60/05/262346005.db2.gz UGKACKAREGMKCS-HKUYNNGSSA-N 1 3 288.479 3.923 20 0 CHADHO C[C@H]([NH2+]CCCN1CCCCC1)c1ccc(Cl)cc1 ZINC000021014553 262373584 /nfs/dbraw/zinc/37/35/84/262373584.db2.gz IVIVTXYQQIXQBS-AWEZNQCLSA-N 1 3 280.843 3.867 20 0 CHADHO CC[C@H](NC[C@H](C)C[NH+]1CCCC1)c1ccc(C)cc1 ZINC000062077492 262408836 /nfs/dbraw/zinc/40/88/36/262408836.db2.gz XNEAWNACSAJWIV-WMZOPIPTSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@H]([NH2+]C[C@H](C)CN1CCCC1)c1ccc(C)cc1 ZINC000062077492 262408837 /nfs/dbraw/zinc/40/88/37/262408837.db2.gz XNEAWNACSAJWIV-WMZOPIPTSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@H](C[N@H+](CC)[C@@H]1CCCNCC1)c1ccccc1 ZINC000414714100 263034205 /nfs/dbraw/zinc/03/42/05/263034205.db2.gz LUIILGCXPVTZQD-SJLPKXTDSA-N 1 3 274.452 3.644 20 0 CHADHO CC[C@H](C[N@@H+](CC)[C@@H]1CCCNCC1)c1ccccc1 ZINC000414714100 263034206 /nfs/dbraw/zinc/03/42/06/263034206.db2.gz LUIILGCXPVTZQD-SJLPKXTDSA-N 1 3 274.452 3.644 20 0 CHADHO CC[C@@H](C[N@H+](CC)[C@H]1CCCNCC1)c1ccccc1 ZINC000414714102 263034234 /nfs/dbraw/zinc/03/42/34/263034234.db2.gz LUIILGCXPVTZQD-WMZOPIPTSA-N 1 3 274.452 3.644 20 0 CHADHO CC[C@@H](C[N@@H+](CC)[C@H]1CCCNCC1)c1ccccc1 ZINC000414714102 263034235 /nfs/dbraw/zinc/03/42/35/263034235.db2.gz LUIILGCXPVTZQD-WMZOPIPTSA-N 1 3 274.452 3.644 20 0 CHADHO CCN(Cc1ccc(Cl)cc1C)[C@@H]1CCC[NH2+]CC1 ZINC000414719288 263034458 /nfs/dbraw/zinc/03/44/58/263034458.db2.gz UVMXDYFZDZDPJQ-MRXNPFEDSA-N 1 3 280.843 3.612 20 0 CHADHO C[C@H]([NH3+])c1ccc(CNCc2cccc(Cl)c2)cc1 ZINC000414813617 263053275 /nfs/dbraw/zinc/05/32/75/263053275.db2.gz UGNHKDLRGWUTJQ-LBPRGKRZSA-N 1 3 274.795 3.650 20 0 CHADHO CC(C)C[C@@H](Cc1cccc(Cl)c1)[NH2+]CC[C@H](C)N ZINC000414822096 263054731 /nfs/dbraw/zinc/05/47/31/263054731.db2.gz MNKVOUIEZAWFFV-BBRMVZONSA-N 1 3 282.859 3.624 20 0 CHADHO CC(C)C[C@@H](Cc1cccc(Cl)c1)NCC[C@H](C)[NH3+] ZINC000414822096 263054732 /nfs/dbraw/zinc/05/47/32/263054732.db2.gz MNKVOUIEZAWFFV-BBRMVZONSA-N 1 3 282.859 3.624 20 0 CHADHO C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@H]2CCCNCC2)C1 ZINC000414910700 263117195 /nfs/dbraw/zinc/11/71/95/263117195.db2.gz FXKIRCRTTZYGMD-NQYYFHDYSA-N 1 3 286.463 3.691 20 0 CHADHO CC1(c2ccccc2)CCC([NH2+][C@@H]2CCC[C@H](N)C2)CC1 ZINC000414928989 263135119 /nfs/dbraw/zinc/13/51/19/263135119.db2.gz QXBDKGSACGNRQD-BKVYNOPKSA-N 1 3 286.463 3.746 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+]CC1CCC(c2ccccc2)CC1 ZINC000414948422 263156273 /nfs/dbraw/zinc/15/62/73/263156273.db2.gz YDVMSHOMKZGEKX-JVGQSUMCSA-N 1 3 286.463 3.548 20 0 CHADHO CC(C)C[C@H](C[NH2+][C@H]1CCN[C@H](C)C1)c1ccccc1 ZINC000414952961 263158095 /nfs/dbraw/zinc/15/80/95/263158095.db2.gz RGUKBQRRVGODDP-NXHRZFHOSA-N 1 3 274.452 3.546 20 0 CHADHO CC(C)C[C@H](CN[C@H]1CC[NH2+][C@H](C)C1)c1ccccc1 ZINC000414952961 263158096 /nfs/dbraw/zinc/15/80/96/263158096.db2.gz RGUKBQRRVGODDP-NXHRZFHOSA-N 1 3 274.452 3.546 20 0 CHADHO Clc1scc(CNCCC[C@H]2CCC[NH2+]2)c1Cl ZINC000414965646 263168477 /nfs/dbraw/zinc/16/84/77/263168477.db2.gz NPBIYEWVNFABMA-JTQLQIEISA-N 1 3 293.263 3.677 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+]Cc1cc(-c2ccccc2)cs1 ZINC000414966347 263169498 /nfs/dbraw/zinc/16/94/98/263169498.db2.gz WLUCLMUIEYHYKI-DYVFJYSZSA-N 1 3 286.444 3.503 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H](C2CC2)C2CCCC2)C1 ZINC000453116095 263190722 /nfs/dbraw/zinc/19/07/22/263190722.db2.gz XRHPIZQIATUCSR-YJBOKZPZSA-N 1 3 278.484 3.665 20 0 CHADHO Cc1ccc(-c2ccc(C[NH2+][C@H](C)[C@@H](C)N)s2)cc1 ZINC000415002017 263202242 /nfs/dbraw/zinc/20/22/42/263202242.db2.gz DEBRKLJLOOVIGJ-CHWSQXEVSA-N 1 3 274.433 3.549 20 0 CHADHO CC[C@H](Cc1ccc(Cl)cc1Cl)N[C@H](C)[C@@H](C)[NH3+] ZINC000415007233 263220710 /nfs/dbraw/zinc/22/07/10/263220710.db2.gz CLPYUDLEGNKJGP-GIPNMCIBSA-N 1 3 289.250 3.640 20 0 CHADHO c1ccc2cc(CN3CCCC[C@@H]3[C@H]3CC[NH2+]C3)ccc2c1 ZINC000415036706 263257172 /nfs/dbraw/zinc/25/71/72/263257172.db2.gz GCSCNTULBQCJHC-VQTJNVASSA-N 1 3 294.442 3.804 20 0 CHADHO c1ccc2cc(CN3CCCC[C@H]3[C@H]3CC[NH2+]C3)ccc2c1 ZINC000415036702 263257195 /nfs/dbraw/zinc/25/71/95/263257195.db2.gz GCSCNTULBQCJHC-PMACEKPBSA-N 1 3 294.442 3.804 20 0 CHADHO c1cc(C2CC2)ccc1CN1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000415041074 263257420 /nfs/dbraw/zinc/25/74/20/263257420.db2.gz KVFUGSVVCPMQFV-RTBURBONSA-N 1 3 284.447 3.528 20 0 CHADHO CCc1ccc(CN[C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000415062242 263258632 /nfs/dbraw/zinc/25/86/32/263258632.db2.gz FASRMNNCRAVYMZ-LJQANCHMSA-N 1 3 282.431 3.819 20 0 CHADHO Cc1oc2ccccc2c1CN1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000415060914 263259035 /nfs/dbraw/zinc/25/90/35/263259035.db2.gz ZKSRWCQSJOPLOL-YJBOKZPZSA-N 1 3 298.430 3.705 20 0 CHADHO c1ccc([C@@H]2C[C@@H](N[C@H]3CCc4ccccc43)CC[NH2+]2)cc1 ZINC000415109508 263273343 /nfs/dbraw/zinc/27/33/43/263273343.db2.gz PQHVBZCXLMQLOD-IHPCNDPISA-N 1 3 292.426 3.757 20 0 CHADHO CCSc1ccccc1[C@H](C)[NH2+]C[C@H](C)CN(C)C ZINC000425952054 264070693 /nfs/dbraw/zinc/07/06/93/264070693.db2.gz RPGSMIPQGUTECH-KBPBESRZSA-N 1 3 280.481 3.647 20 0 CHADHO Cc1ccc2cc([C@H](C)[NH2+][C@H](C)CCN(C)C)oc2c1 ZINC000425958310 264226405 /nfs/dbraw/zinc/22/64/05/264226405.db2.gz MLQKGBKIBIQABS-KGLIPLIRSA-N 1 3 274.408 3.732 20 0 CHADHO Cc1ccc2cc([C@@H](C)[NH2+][C@H](C)CCN(C)C)oc2c1 ZINC000425958312 264226717 /nfs/dbraw/zinc/22/67/17/264226717.db2.gz MLQKGBKIBIQABS-ZIAGYGMSSA-N 1 3 274.408 3.732 20 0 CHADHO CC(C)CC1(CN[C@@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC000391948178 265031864 /nfs/dbraw/zinc/03/18/64/265031864.db2.gz XUTQBFYVKDUDBU-HZPDHXFCSA-N 1 3 258.409 3.547 20 0 CHADHO CN(C)Cc1cccc(C[NH2+]C[C@H]2C[C@@H]2c2ccccc2)c1 ZINC000348242798 265147243 /nfs/dbraw/zinc/14/72/43/265147243.db2.gz LCSMAOMRIDEQEH-WOJBJXKFSA-N 1 3 294.442 3.642 20 0 CHADHO CCc1ccc(CN[C@H](CCC[NH3+])c2ccccc2)s1 ZINC000519111707 265323231 /nfs/dbraw/zinc/32/32/31/265323231.db2.gz TZGJGSYYIBDIMG-QGZVFWFLSA-N 1 3 288.460 3.880 20 0 CHADHO CC[NH+](CC)CC1CCN([C@@H](C)c2cccc(F)c2)CC1 ZINC000519225045 265370885 /nfs/dbraw/zinc/37/08/85/265370885.db2.gz NNYHILLZROGQBB-HNNXBMFYSA-N 1 3 292.442 3.941 20 0 CHADHO CN(C)Cc1cccc(C[NH2+]C2CCC3(CC3)CC2)c1 ZINC000362912839 267059417 /nfs/dbraw/zinc/05/94/17/267059417.db2.gz IUVVQNVNHCJQEW-UHFFFAOYSA-N 1 3 272.436 3.561 20 0 CHADHO CC(C)(C)[C@@H]1C[C@@H](NC2CC([NH+]3CCCCC3)C2)CS1 ZINC000369671085 267258528 /nfs/dbraw/zinc/25/85/28/267258528.db2.gz ROLSTCNGPMLYRB-KNIAUWFNSA-N 1 3 296.524 3.513 20 0 CHADHO Cc1ccccc1C[C@H]([NH2+][C@H]1CCN2CCC[C@@H]2C1)C1CC1 ZINC000370534161 267327102 /nfs/dbraw/zinc/32/71/02/267327102.db2.gz RFULLVQBNROCHS-ZCNNSNEGSA-N 1 3 298.474 3.533 20 0 CHADHO Cc1ccccc1C[C@H](N[C@H]1CC[N@@H+]2CCC[C@@H]2C1)C1CC1 ZINC000370534161 267327105 /nfs/dbraw/zinc/32/71/05/267327105.db2.gz RFULLVQBNROCHS-ZCNNSNEGSA-N 1 3 298.474 3.533 20 0 CHADHO Cc1ccccc1C[C@H](N[C@H]1CC[N@H+]2CCC[C@@H]2C1)C1CC1 ZINC000370534161 267327107 /nfs/dbraw/zinc/32/71/07/267327107.db2.gz RFULLVQBNROCHS-ZCNNSNEGSA-N 1 3 298.474 3.533 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCc1ccc(-c2ccccc2)s1 ZINC000570842149 327624777 /nfs/dbraw/zinc/62/47/77/327624777.db2.gz CAZCKUKUDTWXLV-CHWSQXEVSA-N 1 3 274.433 3.631 20 0 CHADHO CC[C@@H]1CCC[C@@H](C[NH2+]C[C@@H]2CCN(C(C)C)C2)C1 ZINC000394505777 329124419 /nfs/dbraw/zinc/12/44/19/329124419.db2.gz GIRWECUMJCKKRF-ZACQAIPSSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@H](N)[C@@H]1CCC[N@@H+]([C@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000414652031 328208471 /nfs/dbraw/zinc/20/84/71/328208471.db2.gz CWSQRQWRRIAWHF-OGWHTMIXSA-N 1 3 286.463 3.556 20 0 CHADHO C[C@H](N)[C@@H]1CCC[N@H+]([C@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000414652031 328208472 /nfs/dbraw/zinc/20/84/72/328208472.db2.gz CWSQRQWRRIAWHF-OGWHTMIXSA-N 1 3 286.463 3.556 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[C@H](Cc2ccccc2)C1 ZINC000414794249 328229158 /nfs/dbraw/zinc/22/91/58/328229158.db2.gz FMZNOHHLRNATFA-XWSJACJDSA-N 1 3 286.463 3.505 20 0 CHADHO CSc1ccccc1C[C@@H](C)NCC1([NH3+])CCCCC1 ZINC000414843867 328233987 /nfs/dbraw/zinc/23/39/87/328233987.db2.gz OVDZHKSZBRONHX-CQSZACIVSA-N 1 3 292.492 3.591 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](NCc2ccc(-c3ccccc3)s2)C1 ZINC000414934573 328274943 /nfs/dbraw/zinc/27/49/43/328274943.db2.gz XWINRXNXEVCOGL-CABCVRRESA-N 1 3 286.444 3.775 20 0 CHADHO [NH3+]CCC[C@H](NCc1sccc1Cl)c1ccccc1 ZINC000415052371 328299008 /nfs/dbraw/zinc/29/90/08/328299008.db2.gz KWHRHKZQJCQFMA-AWEZNQCLSA-N 1 3 294.851 3.971 20 0 CHADHO CCC[NH+]1CCC(N[C@H](CC2CC2)c2ccccc2)CC1 ZINC000531944838 328323905 /nfs/dbraw/zinc/32/39/05/328323905.db2.gz UBLFJUDKOOOGGO-LJQANCHMSA-N 1 3 286.463 3.992 20 0 CHADHO C[C@@H](CC[NH+](C)C)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000049553709 328371600 /nfs/dbraw/zinc/37/16/00/328371600.db2.gz FTBVPXWFXXJXPH-GJZGRUSLSA-N 1 3 274.452 3.556 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1ccc(Cl)c(Cl)c1 ZINC000093210162 328510820 /nfs/dbraw/zinc/51/08/20/328510820.db2.gz MOFPPAXTHLTSSS-ZMLRMANQSA-N 1 3 287.234 3.914 20 0 CHADHO Cc1cc(N2CCC([C@H]3CCC[NH2+]3)CC2)c2ccccc2n1 ZINC000261999210 326995968 /nfs/dbraw/zinc/99/59/68/326995968.db2.gz UVWZCINZYSGNNO-QGZVFWFLSA-N 1 3 295.430 3.512 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)C/C(C)=C\c2ccccc2)[C@@H](C)C1 ZINC000255868957 327021912 /nfs/dbraw/zinc/02/19/12/327021912.db2.gz TZACIYWDEMMGGA-KISRCWLHSA-N 1 3 286.463 3.752 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)C/C(C)=C\c2ccccc2)[C@@H](C)C1 ZINC000255868957 327021914 /nfs/dbraw/zinc/02/19/14/327021914.db2.gz TZACIYWDEMMGGA-KISRCWLHSA-N 1 3 286.463 3.752 20 0 CHADHO C1CC1[C@H]1CC[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000558241304 327080706 /nfs/dbraw/zinc/08/07/06/327080706.db2.gz NSKAELOJOURVIK-MSOLQXFVSA-N 1 3 276.468 3.562 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CC[C@](C)(C[NH3+])C2)cc1 ZINC000261617661 327359625 /nfs/dbraw/zinc/35/96/25/327359625.db2.gz UFYLVRFYPWAYJS-WMLDXEAASA-N 1 3 260.425 3.542 20 0 CHADHO CC(C)c1ccc([C@H](C)[N@@H+]2CC[C@](C)(CN)C2)cc1 ZINC000261617661 327359626 /nfs/dbraw/zinc/35/96/26/327359626.db2.gz UFYLVRFYPWAYJS-WMLDXEAASA-N 1 3 260.425 3.542 20 0 CHADHO CC(C)c1ccc([C@H](C)[N@H+]2CC[C@](C)(CN)C2)cc1 ZINC000261617661 327359627 /nfs/dbraw/zinc/35/96/27/327359627.db2.gz UFYLVRFYPWAYJS-WMLDXEAASA-N 1 3 260.425 3.542 20 0 CHADHO N[C@H]1CCC[C@@H]([NH2+]CC2(c3cccs3)CCCCC2)C1 ZINC000566481232 327392014 /nfs/dbraw/zinc/39/20/14/327392014.db2.gz GBPCQKWWCXRDBI-LSDHHAIUSA-N 1 3 292.492 3.810 20 0 CHADHO [NH3+][C@H]1CCC[C@@H](NCC2(c3cccs3)CCCCC2)C1 ZINC000566481232 327392016 /nfs/dbraw/zinc/39/20/16/327392016.db2.gz GBPCQKWWCXRDBI-LSDHHAIUSA-N 1 3 292.492 3.810 20 0 CHADHO CC(C)[C@H](Cc1ccccc1)[NH2+][C@@H]1CCC[C@H](N(C)C)C1 ZINC000427695298 327417303 /nfs/dbraw/zinc/41/73/03/327417303.db2.gz LSHIHNONSAEYOE-QYZOEREBSA-N 1 3 288.479 3.716 20 0 CHADHO C[C@@H]1CCC[C@H]([NH2+]CCCN2C[C@@H](C)C[C@H](C)C2)C1 ZINC000525694078 327503864 /nfs/dbraw/zinc/50/38/64/327503864.db2.gz LXOKJVAZKYQPBO-QZWWFDLISA-N 1 3 266.473 3.523 20 0 CHADHO CC[NH2+]CCCN[C@@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000583198212 329360287 /nfs/dbraw/zinc/36/02/87/329360287.db2.gz SVFKRLFRJKDSDA-GOEBONIOSA-N 1 3 280.843 3.565 20 0 CHADHO CCNCCC[NH2+][C@@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000583198212 329360289 /nfs/dbraw/zinc/36/02/89/329360289.db2.gz SVFKRLFRJKDSDA-GOEBONIOSA-N 1 3 280.843 3.565 20 0 CHADHO C[C@@H](NCC[C@@H]1CCC[NH2+]C1)c1ccc(F)cc1Cl ZINC000420397402 329763738 /nfs/dbraw/zinc/76/37/38/329763738.db2.gz GCUMBQPDAAHWRR-NEPJUHHUSA-N 1 3 284.806 3.519 20 0 CHADHO CCC[NH+]1CCC(CN[C@H](C)c2ccncc2Cl)CC1 ZINC000421824391 330083130 /nfs/dbraw/zinc/08/31/30/330083130.db2.gz ILMNLAIDFQYDJX-CYBMUJFWSA-N 1 3 295.858 3.508 20 0 CHADHO CCN(C)C[C@@H]1CC[N@@H+]([C@@H](C)c2ccc3c(c2)CCC3)C1 ZINC000445403227 330111110 /nfs/dbraw/zinc/11/11/10/330111110.db2.gz MNPHHXDUKMVVEZ-HOTGVXAUSA-N 1 3 286.463 3.510 20 0 CHADHO CCN(C)C[C@@H]1CC[N@H+]([C@@H](C)c2ccc3c(c2)CCC3)C1 ZINC000445403227 330111112 /nfs/dbraw/zinc/11/11/12/330111112.db2.gz MNPHHXDUKMVVEZ-HOTGVXAUSA-N 1 3 286.463 3.510 20 0 CHADHO C[C@H](CN1CCC(CC[NH3+])CC1)c1cccc(Cl)c1 ZINC000580452633 330138917 /nfs/dbraw/zinc/13/89/17/330138917.db2.gz AXVSMPXFHCETGS-CYBMUJFWSA-N 1 3 280.843 3.504 20 0 CHADHO CC1CCN(CCC[NH2+][C@@H]2CC[C@@H]2C(C)(C)C)CC1 ZINC000580479793 330146754 /nfs/dbraw/zinc/14/67/54/330146754.db2.gz HUYYPKZFUJNTLL-JKSUJKDBSA-N 1 3 266.473 3.523 20 0 CHADHO CC[C@H](Cc1ccccc1)[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000422717959 330152173 /nfs/dbraw/zinc/15/21/73/330152173.db2.gz WGBZGMZKWQLLKI-WMLDXEAASA-N 1 3 297.446 3.521 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@H](C)CCc1ccccc1 ZINC000422725605 330152584 /nfs/dbraw/zinc/15/25/84/330152584.db2.gz BYMSHIPFOLZMEE-HUUCEWRRSA-N 1 3 297.446 3.521 20 0 CHADHO C[C@@H](CCC[NH3+])N[C@@H](C)c1cc(F)c(Cl)cc1Cl ZINC000422728025 330152593 /nfs/dbraw/zinc/15/25/93/330152593.db2.gz IPWYEFLIZMLBSL-IUCAKERBSA-N 1 3 293.213 3.911 20 0 CHADHO C[C@@H]([NH2+][C@@H](CC1CCCCC1)C(C)(C)C)C1CNC1 ZINC000422748446 330152957 /nfs/dbraw/zinc/15/29/57/330152957.db2.gz UQQBFADPKWSVBZ-CJNGLKHVSA-N 1 3 266.473 3.569 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000422752924 330153334 /nfs/dbraw/zinc/15/33/34/330153334.db2.gz HWXNFPQQHZRGLA-JKSUJKDBSA-N 1 3 282.431 3.534 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCC(c1ccccc1)c1ccccc1 ZINC000422752924 330153336 /nfs/dbraw/zinc/15/33/36/330153336.db2.gz HWXNFPQQHZRGLA-JKSUJKDBSA-N 1 3 282.431 3.534 20 0 CHADHO c1ccc([C@@H](N[C@@H]2CCC[NH2+]CC2)C2CCCC2)cc1 ZINC000422782775 330154970 /nfs/dbraw/zinc/15/49/70/330154970.db2.gz MHBUOGXEZQYWAH-QZTJIDSGSA-N 1 3 272.436 3.650 20 0 CHADHO C[C@@H](N[C@@H](C)CCC[NH3+])c1cc(Cl)ccc1Cl ZINC000422780587 330155018 /nfs/dbraw/zinc/15/50/18/330155018.db2.gz KKOJTZUHKNSGDQ-VHSXEESVSA-N 1 3 275.223 3.771 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H](c1ccc(F)cc1)C(C)(C)C ZINC000422787282 330155329 /nfs/dbraw/zinc/15/53/29/330155329.db2.gz UMWMPFCXKQQTIJ-YWPYICTPSA-N 1 3 266.404 3.628 20 0 CHADHO C[C@@H]1CCNCC[C@H]1[NH2+]C1CCC(c2ccccc2)CC1 ZINC000422801255 330155541 /nfs/dbraw/zinc/15/55/41/330155541.db2.gz BOBKAKIKHPNCLC-JYPHPWERSA-N 1 3 286.463 3.691 20 0 CHADHO CC(C)[C@@H](N[C@@H](C)C1C[NH2+]C1)c1ccc(C(C)(C)C)cc1 ZINC000422793639 330155641 /nfs/dbraw/zinc/15/56/41/330155641.db2.gz XFXJQRIMCIEFID-KBXCAEBGSA-N 1 3 288.479 3.879 20 0 CHADHO CC(C)[C@@H]([NH2+][C@@H](C)C1CNC1)c1ccc(C(C)(C)C)cc1 ZINC000422793639 330155642 /nfs/dbraw/zinc/15/56/42/330155642.db2.gz XFXJQRIMCIEFID-KBXCAEBGSA-N 1 3 288.479 3.879 20 0 CHADHO C[C@H](N[C@@H]1C[C@H]([NH3+])c2ccccc21)[C@@H](C)c1ccccc1 ZINC000422818286 330156167 /nfs/dbraw/zinc/15/61/67/330156167.db2.gz FZXLJOACPQRDIZ-SPLQCWDRSA-N 1 3 280.415 3.913 20 0 CHADHO CC[C@H](N[C@H](C)C[C@H](C)[NH3+])c1ccc(Cl)cc1 ZINC000422824835 330156711 /nfs/dbraw/zinc/15/67/11/330156711.db2.gz OPQOMZZRUYBRDD-WDMOLILDSA-N 1 3 254.805 3.507 20 0 CHADHO C[C@H](N[C@H](c1cccc(F)c1)C(C)(C)C)[C@@H]1CC[NH2+]C1 ZINC000422837559 330157171 /nfs/dbraw/zinc/15/71/71/330157171.db2.gz MBQFXXYZUNEZJS-JGGQBBKZSA-N 1 3 278.415 3.501 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCc1ccc(OC2CCCCC2)cc1 ZINC000422847412 330157588 /nfs/dbraw/zinc/15/75/88/330157588.db2.gz ICZUTDGZVMGLQA-HUUCEWRRSA-N 1 3 290.451 3.614 20 0 CHADHO CC(C)CCOc1ccc([C@H](C)[NH2+]C2CCNCC2)cc1 ZINC000422862246 330158085 /nfs/dbraw/zinc/15/80/85/330158085.db2.gz PNCUNBSAMWHMNX-HNNXBMFYSA-N 1 3 290.451 3.514 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]CC(C)(C)Cc1cccc(Cl)c1 ZINC000422880675 330159026 /nfs/dbraw/zinc/15/90/26/330159026.db2.gz XKYBGLQFOUUQFA-STQMWFEESA-N 1 3 282.859 3.624 20 0 CHADHO CCC[C@H]([NH2+]C1CCNCC1)c1ccc(Cl)cc1 ZINC000422930255 330161230 /nfs/dbraw/zinc/16/12/30/330161230.db2.gz SPDRVOOIGDDTPN-HNNXBMFYSA-N 1 3 266.816 3.523 20 0 CHADHO c1ccc([C@H](NC2CC[NH2+]CC2)C2CCCCC2)cc1 ZINC000422945849 330161898 /nfs/dbraw/zinc/16/18/98/330161898.db2.gz VLOWZTXMIFUORJ-SFHVURJKSA-N 1 3 272.436 3.650 20 0 CHADHO c1ccc([C@H]([NH2+]C2CCNCC2)C2CCCCC2)cc1 ZINC000422945849 330161900 /nfs/dbraw/zinc/16/19/00/330161900.db2.gz VLOWZTXMIFUORJ-SFHVURJKSA-N 1 3 272.436 3.650 20 0 CHADHO CCC(CC)[C@H](N[C@H](C)C[C@H](C)[NH3+])c1cccs1 ZINC000422944489 330162088 /nfs/dbraw/zinc/16/20/88/330162088.db2.gz ZUGAVZHURLPDOT-ZOWXZIJZSA-N 1 3 268.470 3.941 20 0 CHADHO [NH3+][C@H]1CCCCC[C@@H]1NCC1(Sc2ccccc2)CC1 ZINC000422901446 330162285 /nfs/dbraw/zinc/16/22/85/330162285.db2.gz CARHZGPQJHIFTM-HOTGVXAUSA-N 1 3 290.476 3.561 20 0 CHADHO CC(C)C[C@H](N[C@@H](C)C[C@@H](C)[NH3+])c1cccs1 ZINC000422950262 330163733 /nfs/dbraw/zinc/16/37/33/330163733.db2.gz VOQKSMQPUJEONA-AGIUHOORSA-N 1 3 254.443 3.551 20 0 CHADHO CC(C)C[C@@H](N[C@@H]1CCC[NH2+]CC1)c1cccs1 ZINC000422949581 330163891 /nfs/dbraw/zinc/16/38/91/330163891.db2.gz UJPLGOWCABQDDB-ZIAGYGMSSA-N 1 3 266.454 3.567 20 0 CHADHO [NH3+][C@H]1CCCCC[C@H]1NCCc1ccc2ccccc2c1 ZINC000422950982 330164051 /nfs/dbraw/zinc/16/40/51/330164051.db2.gz ZHDZWLVNSQIWHU-RBUKOAKNSA-N 1 3 282.431 3.632 20 0 CHADHO [NH3+][C@H]1C[C@@H](NC2(Cc3ccccc3)CCC2)c2ccccc21 ZINC000422956430 330164137 /nfs/dbraw/zinc/16/41/37/330164137.db2.gz LEPGZXWLVBGTLC-RBUKOAKNSA-N 1 3 292.426 3.886 20 0 CHADHO C[C@@H](N[C@@H](C)CCC[NH3+])c1nc(-c2ccccc2)cs1 ZINC000422961780 330164234 /nfs/dbraw/zinc/16/42/34/330164234.db2.gz ZYCOLRGGUIETAO-QWHCGFSZSA-N 1 3 289.448 3.588 20 0 CHADHO c1ccc([C@H]2C[C@H](N[C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)C2)cc1 ZINC000422968670 330164631 /nfs/dbraw/zinc/16/46/31/330164631.db2.gz RTRBKUSCIKASKP-WKWVNEEDSA-N 1 3 298.474 3.833 20 0 CHADHO CC1(C)CC[C@@H](CNC2C[C@H]3CC[C@@H](C2)[NH2+]3)c2ccccc21 ZINC000423018263 330165430 /nfs/dbraw/zinc/16/54/30/330165430.db2.gz QNUGJOPXZHJZHC-PMRDEQMMSA-N 1 3 298.474 3.714 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]C[C@H]1CCC(C)(C)c2ccccc21 ZINC000423020074 330165614 /nfs/dbraw/zinc/16/56/14/330165614.db2.gz YORIIUHDYAXVQG-SOUVJXGZSA-N 1 3 274.452 3.557 20 0 CHADHO CC[C@H](CC(F)(F)F)N[C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000423037587 330166671 /nfs/dbraw/zinc/16/66/71/330166671.db2.gz MZTXQBGSVDGBEU-YNEHKIRRSA-N 1 3 280.378 3.618 20 0 CHADHO c1ccc(CC2(CNC3C[C@H]4CC[C@@H](C3)[NH2+]4)CCCC2)cc1 ZINC000423047719 330166984 /nfs/dbraw/zinc/16/69/84/330166984.db2.gz VORHRFHVQQYFDO-DFNIBXOVSA-N 1 3 298.474 3.662 20 0 CHADHO CC(C)c1cccc(CN[C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)c1 ZINC000423056983 330167741 /nfs/dbraw/zinc/16/77/41/330167741.db2.gz YPEMSHDHBSKSRX-GUDVDZBRSA-N 1 3 286.463 3.820 20 0 CHADHO C1CCC2(CC1)CCC([NH2+][C@@H]1CCCNCC1)CC2 ZINC000423066822 330168325 /nfs/dbraw/zinc/16/83/25/330168325.db2.gz FKDQWYXBTYEZOM-OAHLLOKOSA-N 1 3 264.457 3.611 20 0 CHADHO CC(C)[C@H]1C[C@@H](N[C@H](C)C[C@H](C)[NH3+])c2ccccc21 ZINC000423088331 330169160 /nfs/dbraw/zinc/16/91/60/330169160.db2.gz RMNTUERPGLUAFA-NSNWQYSKSA-N 1 3 260.425 3.586 20 0 CHADHO N[C@H]1C[C@H]([NH2+][C@H]2C[C@H](c3ccccc3F)C2)c2ccccc21 ZINC000423093537 330169392 /nfs/dbraw/zinc/16/93/92/330169392.db2.gz HXLUBQNQBWOBBM-OYUDYFSCSA-N 1 3 296.389 3.806 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@@H]1N[C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423099758 330170111 /nfs/dbraw/zinc/17/01/11/330170111.db2.gz UGOJGIJWPHJIHL-DZUCGIPZSA-N 1 3 292.854 3.836 20 0 CHADHO C[C@@]1(CN[C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)C[C@H]1c1ccccc1 ZINC000423133877 330172087 /nfs/dbraw/zinc/17/20/87/330172087.db2.gz LFQYVFVNRLJPIX-FSGKZVOOSA-N 1 3 298.474 3.691 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]C1(Cc2ccc(Cl)cc2)CCC1 ZINC000423136550 330172111 /nfs/dbraw/zinc/17/21/11/330172111.db2.gz VGUVFNIJINQWJL-QWHCGFSZSA-N 1 3 280.843 3.521 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NC1(Cc2ccc(Cl)cc2)CCC1 ZINC000423136550 330172112 /nfs/dbraw/zinc/17/21/12/330172112.db2.gz VGUVFNIJINQWJL-QWHCGFSZSA-N 1 3 280.843 3.521 20 0 CHADHO CC(C)(C)C1CC([NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCCN2)C1 ZINC000423140402 330172263 /nfs/dbraw/zinc/17/22/63/330172263.db2.gz YCHITEXXISTQEL-LMNGEROHSA-N 1 3 278.484 3.712 20 0 CHADHO N[C@H]1C[C@@H]([NH2+]C2(Cc3ccc(F)cc3)CC2)c2ccccc21 ZINC000423150728 330172805 /nfs/dbraw/zinc/17/28/05/330172805.db2.gz CCPZBVQLDBKFHB-ZWKOTPCHSA-N 1 3 296.389 3.635 20 0 CHADHO CCC[C@@H]([NH2+][C@H](C)c1ccc(CN)nc1C)C(C)(C)C ZINC000423154455 330173047 /nfs/dbraw/zinc/17/30/47/330173047.db2.gz HSYIFTUKHYHFGT-CZUORRHYSA-N 1 3 277.456 3.714 20 0 CHADHO C[C@@H]1CCNCC[C@@H]1[NH2+]C[C@H]1CCC[C@@H]1c1ccccc1 ZINC000423159376 330173596 /nfs/dbraw/zinc/17/35/96/330173596.db2.gz OYIDKJAXJVIXFE-OWYHZJEWSA-N 1 3 286.463 3.548 20 0 CHADHO Clc1ccc([C@@H]2CC[C@H]([NH2+][C@@H]3CCCNCC3)C2)cc1 ZINC000423174188 330174694 /nfs/dbraw/zinc/17/46/94/330174694.db2.gz BOHYGERWNRWDEE-OIISXLGYSA-N 1 3 292.854 3.708 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@@H]1C[C@H](C)C[C@@H](c2ccccc2)C1 ZINC000423174192 330174842 /nfs/dbraw/zinc/17/48/42/330174842.db2.gz BOJKKOKHFOCZFC-MISMHTLLSA-N 1 3 274.452 3.674 20 0 CHADHO CC(C)CCC[C@@H]([NH2+]C1CCNCC1)c1ccccc1 ZINC000423178735 330175224 /nfs/dbraw/zinc/17/52/24/330175224.db2.gz GMKKWOPOULIMBI-GOSISDBHSA-N 1 3 274.452 3.896 20 0 CHADHO c1ccc(C[C@@H]([NH2+]C2CCNCC2)C2CCCCC2)cc1 ZINC000423183034 330175493 /nfs/dbraw/zinc/17/54/93/330175493.db2.gz KVFTXYDIJITFHJ-LJQANCHMSA-N 1 3 286.463 3.520 20 0 CHADHO C[C@@H]([NH2+]CC1(N)CCCCC1)c1cc2c(s1)CCC2 ZINC000423183904 330175748 /nfs/dbraw/zinc/17/57/48/330175748.db2.gz SHPMAEMZBFIEAD-GFCCVEGCSA-N 1 3 278.465 3.549 20 0 CHADHO C[C@H](NCCC[NH3+])c1ccc(-c2ccc(F)cc2)s1 ZINC000423187969 330175791 /nfs/dbraw/zinc/17/57/91/330175791.db2.gz YUXUVDHHRPFXQW-NSHDSACASA-N 1 3 278.396 3.554 20 0 CHADHO CCCC[C@@H](NC[C@@H]1CCC[NH2+]C1)c1ccccc1 ZINC000423215354 330178270 /nfs/dbraw/zinc/17/82/70/330178270.db2.gz QMEUYMNGWHZYAC-NVXWUHKLSA-N 1 3 260.425 3.507 20 0 CHADHO CCCC[C@@H]([NH2+]C[C@@H]1CCCNC1)c1ccccc1 ZINC000423215354 330178271 /nfs/dbraw/zinc/17/82/71/330178271.db2.gz QMEUYMNGWHZYAC-NVXWUHKLSA-N 1 3 260.425 3.507 20 0 CHADHO C[C@H](N[C@@H]1CCCc2c3ccccc3[nH]c21)[C@H]1CCC[NH2+]C1 ZINC000423222071 330179777 /nfs/dbraw/zinc/17/97/77/330179777.db2.gz ZMJZVKKYKFHBOR-SUNYJGFJSA-N 1 3 297.446 3.523 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCCc2c3ccccc3[nH]c21)[C@H]1CCCNC1 ZINC000423222071 330179779 /nfs/dbraw/zinc/17/97/79/330179779.db2.gz ZMJZVKKYKFHBOR-SUNYJGFJSA-N 1 3 297.446 3.523 20 0 CHADHO C[C@H](N)CC[NH2+][C@H](Cc1ccccc1)C1CCCCC1 ZINC000423223058 330179793 /nfs/dbraw/zinc/17/97/93/330179793.db2.gz DQKQHMKTAPJWEL-MAUKXSAKSA-N 1 3 274.452 3.505 20 0 CHADHO C[C@H](N)CC[NH2+][C@@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000423228239 330180325 /nfs/dbraw/zinc/18/03/25/330180325.db2.gz YWLGRZZLQOMYOQ-KBPBESRZSA-N 1 3 287.451 3.551 20 0 CHADHO C[C@H]([NH3+])CCN[C@@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000423228239 330180327 /nfs/dbraw/zinc/18/03/27/330180327.db2.gz YWLGRZZLQOMYOQ-KBPBESRZSA-N 1 3 287.451 3.551 20 0 CHADHO Cc1nc(-c2ccccc2)sc1[C@H](C)NCC[C@H](C)[NH3+] ZINC000423228388 330180459 /nfs/dbraw/zinc/18/04/59/330180459.db2.gz ZKVQABRPKVLMBQ-RYUDHWBXSA-N 1 3 289.448 3.506 20 0 CHADHO CC[C@H](N[C@@H](C[NH3+])C1CC1)c1ccc2cc(OC)ccc2c1 ZINC000423275883 330184994 /nfs/dbraw/zinc/18/49/94/330184994.db2.gz MGEBIRIFYCMULV-OALUTQOASA-N 1 3 298.430 3.626 20 0 CHADHO CC(C)(N)C[NH2+][C@H](CCc1ccccc1)c1ccccc1 ZINC000423288408 330186075 /nfs/dbraw/zinc/18/60/75/330186075.db2.gz RZUVWNMKEIAQSC-GOSISDBHSA-N 1 3 282.431 3.687 20 0 CHADHO Cc1cc([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)cs1 ZINC000423290964 330186968 /nfs/dbraw/zinc/18/69/68/330186968.db2.gz GBSWXXBQBRDTKB-QWHCGFSZSA-N 1 3 274.433 3.927 20 0 CHADHO COc1cccc([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000423292772 330187745 /nfs/dbraw/zinc/18/77/45/330187745.db2.gz OJFFOAAZTVYKFG-KGLIPLIRSA-N 1 3 284.403 3.566 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc3c(c2)COC3)cc1 ZINC000423293862 330188060 /nfs/dbraw/zinc/18/80/60/330188060.db2.gz SGAQDBJDYREXML-KBPBESRZSA-N 1 3 296.414 3.587 20 0 CHADHO C[C@@H](C[NH3+])CN[C@@H](c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000423296954 330188542 /nfs/dbraw/zinc/18/85/42/330188542.db2.gz ICBGMYYTDOLVPJ-LKFCYVNXSA-N 1 3 287.234 3.629 20 0 CHADHO Cc1ccsc1[C@H](Cc1ccccc1)NC[C@H](C)C[NH3+] ZINC000423303060 330189073 /nfs/dbraw/zinc/18/90/73/330189073.db2.gz WMFPCHHDOXFEQD-CJNGLKHVSA-N 1 3 288.460 3.525 20 0 CHADHO Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]C[C@H](C)CN ZINC000423303060 330189075 /nfs/dbraw/zinc/18/90/75/330189075.db2.gz WMFPCHHDOXFEQD-CJNGLKHVSA-N 1 3 288.460 3.525 20 0 CHADHO C[C@@H](C[NH3+])CN[C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000423299393 330189080 /nfs/dbraw/zinc/18/90/80/330189080.db2.gz QAEKNAMKELDUCQ-GJZGRUSLSA-N 1 3 268.404 3.599 20 0 CHADHO C[C@@H](NC[C@@H](C)C[NH3+])c1ccc(-c2ccccc2)cc1 ZINC000423299395 330189127 /nfs/dbraw/zinc/18/91/27/330189127.db2.gz QAEKNAMKELDUCQ-LSDHHAIUSA-N 1 3 268.404 3.599 20 0 CHADHO N[C@@H](C[NH2+][C@@H](CC1CC1)c1ccc(Cl)cc1)C1CC1 ZINC000423313546 330189744 /nfs/dbraw/zinc/18/97/44/330189744.db2.gz FULRGNUZMGMNSP-HOTGVXAUSA-N 1 3 278.827 3.508 20 0 CHADHO C[C@H](NC[C@@H]([NH3+])C1CC1)C(c1ccccc1)c1ccccc1 ZINC000423314421 330189817 /nfs/dbraw/zinc/18/98/17/330189817.db2.gz HCRIVQVWYZCQSX-HNAYVOBHSA-N 1 3 294.442 3.534 20 0 CHADHO C[C@H](NC[C@]1(C)CCC[NH2+]C1)c1cccc2ccccc21 ZINC000423318679 330190080 /nfs/dbraw/zinc/19/00/80/330190080.db2.gz CWGRBCUSDWIZDM-HNAYVOBHSA-N 1 3 282.431 3.880 20 0 CHADHO C[C@H]([NH2+]C[C@]1(C)CCCNC1)c1cccc2ccccc21 ZINC000423318679 330190082 /nfs/dbraw/zinc/19/00/82/330190082.db2.gz CWGRBCUSDWIZDM-HNAYVOBHSA-N 1 3 282.431 3.880 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H](N)C1CC1)c1ccc2cc(OC)ccc2c1 ZINC000423322670 330190786 /nfs/dbraw/zinc/19/07/86/330190786.db2.gz OCYWLUSFEYXLJO-RTBURBONSA-N 1 3 298.430 3.626 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]C[C@@]1(C)CCCNC1 ZINC000423329834 330191136 /nfs/dbraw/zinc/19/11/36/330191136.db2.gz FLAIEPPSYCDFSL-HFTRVMKXSA-N 1 3 272.436 3.523 20 0 CHADHO C[C@H](NCC1([NH3+])CCC1)C(c1ccccc1)c1ccccc1 ZINC000423336775 330191772 /nfs/dbraw/zinc/19/17/72/330191772.db2.gz VBKOEBPHCYRAQU-INIZCTEOSA-N 1 3 294.442 3.678 20 0 CHADHO CC(C)Sc1ccc([C@H](C)[NH2+]CC2(N)CCC2)cc1 ZINC000423339793 330192013 /nfs/dbraw/zinc/19/20/13/330192013.db2.gz WYHXJMVUOYBYTD-ZDUSSCGKSA-N 1 3 278.465 3.719 20 0 CHADHO C[C@@H](NCC1=CC[NH2+]CC1)c1cccc(Cl)c1Cl ZINC000423342953 330192130 /nfs/dbraw/zinc/19/21/30/330192130.db2.gz LDJUSULCQXNQON-SNVBAGLBSA-N 1 3 285.218 3.564 20 0 CHADHO C[C@@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CNC3)CC(C)(C)C1 ZINC000423354837 330193009 /nfs/dbraw/zinc/19/30/09/330193009.db2.gz HDMNZDGLKTUBLH-DYVFJYSZSA-N 1 3 272.436 3.594 20 0 CHADHO Clc1cccc([C@H]2CC[C@H](NCC[C@H]3CCC[NH2+]3)C2)c1 ZINC000423355547 330193428 /nfs/dbraw/zinc/19/34/28/330193428.db2.gz ICLGJFMNAYVBLN-UAGQMJEPSA-N 1 3 292.854 3.708 20 0 CHADHO Cc1ccc([C@@H](C)NCc2ccc3c(c2)C[NH2+]C3)cc1C ZINC000423361277 330193566 /nfs/dbraw/zinc/19/35/66/330193566.db2.gz RLFRLUOVTYADSD-OAHLLOKOSA-N 1 3 280.415 3.757 20 0 CHADHO C[C@H](CCc1ccccc1F)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423363586 330193825 /nfs/dbraw/zinc/19/38/25/330193825.db2.gz ABAAXOXOPQXZSI-CQSZACIVSA-N 1 3 298.405 3.540 20 0 CHADHO Fc1ccc2c(c1)CCC[C@H]2NCc1ccc2c(c1)C[NH2+]C2 ZINC000423372831 330195187 /nfs/dbraw/zinc/19/51/87/330195187.db2.gz HGGVNXUAHSYCRN-LJQANCHMSA-N 1 3 296.389 3.596 20 0 CHADHO Cc1ccccc1[C@H](N[C@@H]1CC[NH2+][C@H](C)C1)C1CCCC1 ZINC000423372417 330195371 /nfs/dbraw/zinc/19/53/71/330195371.db2.gz GGVXGZXTJYURQE-SZVBFZGTSA-N 1 3 286.463 3.956 20 0 CHADHO Cc1ccccc1[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)C1CCCC1 ZINC000423372417 330195372 /nfs/dbraw/zinc/19/53/72/330195372.db2.gz GGVXGZXTJYURQE-SZVBFZGTSA-N 1 3 286.463 3.956 20 0 CHADHO C[C@H](N[C@@H]1CC[NH2+]C[C@H]1C)c1ccc(F)c2ccccc21 ZINC000423397650 330195815 /nfs/dbraw/zinc/19/58/15/330195815.db2.gz OIIUREAGEDVUPK-FHSNZYRGSA-N 1 3 286.394 3.628 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCNC[C@H]1C)c1ccc(F)c2ccccc21 ZINC000423397650 330195816 /nfs/dbraw/zinc/19/58/16/330195816.db2.gz OIIUREAGEDVUPK-FHSNZYRGSA-N 1 3 286.394 3.628 20 0 CHADHO C[C@@H]1C[C@H](N[C@@H](CC(C)(C)C)c2ccccc2)CC[NH2+]1 ZINC000423401110 330196205 /nfs/dbraw/zinc/19/62/05/330196205.db2.gz WVSVKVKJBIXZKM-OIISXLGYSA-N 1 3 274.452 3.894 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H](CC(C)(C)C)c2ccccc2)CCN1 ZINC000423401110 330196206 /nfs/dbraw/zinc/19/62/06/330196206.db2.gz WVSVKVKJBIXZKM-OIISXLGYSA-N 1 3 274.452 3.894 20 0 CHADHO C[C@@H]1C[C@@H](N[C@@H](CC(C)(C)C)c2ccccc2)CC[NH2+]1 ZINC000423401111 330196252 /nfs/dbraw/zinc/19/62/52/330196252.db2.gz WVSVKVKJBIXZKM-PVAVHDDUSA-N 1 3 274.452 3.894 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@@H](CC(C)(C)C)c2ccccc2)CCN1 ZINC000423401111 330196253 /nfs/dbraw/zinc/19/62/53/330196253.db2.gz WVSVKVKJBIXZKM-PVAVHDDUSA-N 1 3 274.452 3.894 20 0 CHADHO C[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1ccc2ccccc2c1 ZINC000423403933 330196635 /nfs/dbraw/zinc/19/66/35/330196635.db2.gz XKXCRAWUNDXJND-KKXDTOCCSA-N 1 3 268.404 3.760 20 0 CHADHO Cc1ccc([C@H](N[C@@H]2CCC[C@H]([NH3+])C2)C2CCCC2)o1 ZINC000423404683 330196668 /nfs/dbraw/zinc/19/66/68/330196668.db2.gz XOOYUNITADJUGF-ZMSDIMECSA-N 1 3 276.424 3.679 20 0 CHADHO CC(C)CC[C@@H](N[C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccoc1 ZINC000423428981 330198432 /nfs/dbraw/zinc/19/84/32/330198432.db2.gz GZQJATUPGFPZDY-RCCFBDPRSA-N 1 3 290.451 3.735 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@H](N)C1)[C@@H](C)c1ccc(Cl)cc1 ZINC000423374269 330198589 /nfs/dbraw/zinc/19/85/89/330198589.db2.gz SOIRHTLUZNZCAI-GUYJKWIASA-N 1 3 280.843 3.692 20 0 CHADHO CCC[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccsc1 ZINC000423376896 330198741 /nfs/dbraw/zinc/19/87/41/330198741.db2.gz JFTBRZUGPRYTPH-KRWDZBQOSA-N 1 3 286.444 3.982 20 0 CHADHO CC(C)c1ccc([C@@H](C)[NH2+][C@H]2CCN[C@H](C)C2)cc1 ZINC000423378083 330198846 /nfs/dbraw/zinc/19/88/46/330198846.db2.gz MDWMTDFVOAXDIY-CPUCHLNUSA-N 1 3 260.425 3.601 20 0 CHADHO CSc1ccccc1[C@H](C)NCc1ccc2c(c1)C[NH2+]C2 ZINC000423383034 330199156 /nfs/dbraw/zinc/19/91/56/330199156.db2.gz KFSLQPIVYNLQAY-ZDUSSCGKSA-N 1 3 298.455 3.863 20 0 CHADHO C[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1ccccc1C(F)(F)F ZINC000423381945 330199345 /nfs/dbraw/zinc/19/93/45/330199345.db2.gz JQBTXGAULWWFKS-SRVKXCTJSA-N 1 3 286.341 3.626 20 0 CHADHO CCc1ccc([C@H](C)NCc2ccc3c(c2)C[NH2+]C3)s1 ZINC000423391701 330200249 /nfs/dbraw/zinc/20/02/49/330200249.db2.gz PORYABMCRMQDHB-LBPRGKRZSA-N 1 3 286.444 3.765 20 0 CHADHO CCSc1ccc([C@H](C)N[C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000423390663 330200403 /nfs/dbraw/zinc/20/04/03/330200403.db2.gz PBTIARHAXSVSEG-NWANDNLSSA-N 1 3 278.465 3.719 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H](c3cccc(Cl)c3)C2)CCN1 ZINC000423394429 330200714 /nfs/dbraw/zinc/20/07/14/330200714.db2.gz ZQWOHNUBJHYGFY-JWZBEHFJSA-N 1 3 292.854 3.706 20 0 CHADHO CCCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423393610 330200730 /nfs/dbraw/zinc/20/07/30/330200730.db2.gz QPNLIXUYMUCOLB-QAPCUYQASA-N 1 3 272.436 3.738 20 0 CHADHO C[C@@H](CCC[NH3+])N[C@@H](C)c1csc(-c2ccccc2)n1 ZINC000423446315 330202342 /nfs/dbraw/zinc/20/23/42/330202342.db2.gz CMRNIIDZHGQJNH-STQMWFEESA-N 1 3 289.448 3.588 20 0 CHADHO CCCCCOc1ccc([C@H](C)[NH2+][C@@H](C)[C@H](C)N)cc1 ZINC000423450696 330202870 /nfs/dbraw/zinc/20/28/70/330202870.db2.gz UAAWCTJZJIEXNH-KKUMJFAQSA-N 1 3 278.440 3.642 20 0 CHADHO C[C@@H](N)[C@H](C)[NH2+][C@@H](C)c1ccc(-c2cccs2)cc1 ZINC000423452732 330203222 /nfs/dbraw/zinc/20/32/22/330203222.db2.gz WTONFGYPPBEIPB-AGIUHOORSA-N 1 3 274.433 3.801 20 0 CHADHO C[C@H](NC[C@@H]1CCC[C@@H]([NH3+])C1)c1ccc(F)cc1Cl ZINC000423455112 330203430 /nfs/dbraw/zinc/20/34/30/330203430.db2.gz DRFFPNCEEMFYJP-DMDPSCGWSA-N 1 3 284.806 3.647 20 0 CHADHO CC[C@H]([NH2+][C@@H](C)[C@H](C)N)c1ccc(Cl)c(Cl)c1 ZINC000423454759 330203460 /nfs/dbraw/zinc/20/34/60/330203460.db2.gz ZNQHNWFFUQZVJR-RVBZMBCESA-N 1 3 275.223 3.770 20 0 CHADHO CC[C@@H](N)C[NH2+][C@@H](C)c1ccc(-c2ccccc2OC)cc1 ZINC000423459460 330203959 /nfs/dbraw/zinc/20/39/59/330203959.db2.gz IBQWXGYXYAUTQG-WMLDXEAASA-N 1 3 298.430 3.750 20 0 CHADHO CC[C@H](N)C[NH2+][C@@H](C)c1sc(-c2ccccc2)nc1C ZINC000423461083 330204114 /nfs/dbraw/zinc/20/41/14/330204114.db2.gz JHQSEJHIKBIDFD-FZMZJTMJSA-N 1 3 289.448 3.506 20 0 CHADHO [NH3+]CCC[C@H](N[C@@H]1CCc2ccccc21)c1ccccc1 ZINC000423495306 330207821 /nfs/dbraw/zinc/20/78/21/330207821.db2.gz BQFSQRIUHQTGJL-RBUKOAKNSA-N 1 3 280.415 3.744 20 0 CHADHO COc1cccc([C@H](C)N[C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000423501707 330208341 /nfs/dbraw/zinc/20/83/41/330208341.db2.gz LMYSCLQMTWJAKN-KXBFYZLASA-N 1 3 298.430 3.826 20 0 CHADHO COc1cccc([C@H](C)N[C@H](CCC[NH3+])c2ccccc2)c1 ZINC000423501706 330208463 /nfs/dbraw/zinc/20/84/63/330208463.db2.gz LMYSCLQMTWJAKN-HNAYVOBHSA-N 1 3 298.430 3.826 20 0 CHADHO Cc1cncc([C@@H](C)N[C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000423519705 330209616 /nfs/dbraw/zinc/20/96/16/330209616.db2.gz QETAQHYTTSAWRT-QAPCUYQASA-N 1 3 283.419 3.521 20 0 CHADHO Cc1cncc([C@H](C)N[C@H](CCC[NH3+])c2ccccc2)c1 ZINC000423519704 330209837 /nfs/dbraw/zinc/20/98/37/330209837.db2.gz QETAQHYTTSAWRT-MAUKXSAKSA-N 1 3 283.419 3.521 20 0 CHADHO [NH3+]CCC[C@H](N[C@H]1CCCc2occc21)c1ccccc1 ZINC000423521052 330209972 /nfs/dbraw/zinc/20/99/72/330209972.db2.gz RXGDYBKSVRBBPQ-IRXDYDNUSA-N 1 3 284.403 3.727 20 0 CHADHO Clc1cccc([C@@H]2CC[C@H]([NH2+]CCCNC3CC3)C2)c1 ZINC000423543034 330211161 /nfs/dbraw/zinc/21/11/61/330211161.db2.gz BNZFRAFJUHPBNK-PBHICJAKSA-N 1 3 292.854 3.708 20 0 CHADHO C[C@@H]([NH2+]CCCNC1CC1)c1cc2ccccc2s1 ZINC000423551769 330211658 /nfs/dbraw/zinc/21/16/58/330211658.db2.gz JNHLTPHEFPTACU-GFCCVEGCSA-N 1 3 274.433 3.694 20 0 CHADHO Cc1ccc([C@@H](NCCC[NH2+]C2CC2)C2CCC2)cc1 ZINC000423567915 330212111 /nfs/dbraw/zinc/21/21/11/330212111.db2.gz VJGAUKDLDVXSDY-SFHVURJKSA-N 1 3 272.436 3.568 20 0 CHADHO Cc1ccc([C@@H]([NH2+]CCCNC2CC2)C2CCC2)cc1 ZINC000423567915 330212112 /nfs/dbraw/zinc/21/21/12/330212112.db2.gz VJGAUKDLDVXSDY-SFHVURJKSA-N 1 3 272.436 3.568 20 0 CHADHO CC[NH+]1CCC(N[C@@H](C)c2cccc(C(C)C)c2)CC1 ZINC000527845968 330287795 /nfs/dbraw/zinc/28/77/95/330287795.db2.gz KZMSRJLNGHSRSD-HNNXBMFYSA-N 1 3 274.452 3.945 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2c(C)cc(C)cc2C)[C@H](C)C1 ZINC000533072665 330326866 /nfs/dbraw/zinc/32/68/66/330326866.db2.gz WZBXYBBOSYBNBI-MJGOQNOKSA-N 1 3 288.479 3.774 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2c(C)cc(C)cc2C)[C@H](C)C1 ZINC000533072665 330326867 /nfs/dbraw/zinc/32/68/67/330326867.db2.gz WZBXYBBOSYBNBI-MJGOQNOKSA-N 1 3 288.479 3.774 20 0 CHADHO [NH3+][C@H]1C[C@H](N[C@@H]2CCC[C@H](C3CC3)C2)c2ccccc21 ZINC000424385621 330349551 /nfs/dbraw/zinc/34/95/51/330349551.db2.gz WNQDNXVLNCLWDP-DACLVMHWSA-N 1 3 270.420 3.690 20 0 CHADHO Cc1cc(N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)c2ccccc2n1 ZINC000107830462 330351292 /nfs/dbraw/zinc/35/12/92/330351292.db2.gz CLCRTMQQNNFDOG-LSDHHAIUSA-N 1 3 281.403 3.582 20 0 CHADHO Cc1cc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc2n1 ZINC000107830462 330351293 /nfs/dbraw/zinc/35/12/93/330351293.db2.gz CLCRTMQQNNFDOG-LSDHHAIUSA-N 1 3 281.403 3.582 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1ccc(Cl)c(F)c1 ZINC000212707119 330367046 /nfs/dbraw/zinc/36/70/46/330367046.db2.gz VSHSALITIJWGSH-VXGBXAGGSA-N 1 3 296.817 3.614 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1ccc(Cl)c(F)c1 ZINC000212706985 330367132 /nfs/dbraw/zinc/36/71/32/330367132.db2.gz VSHSALITIJWGSH-NEPJUHHUSA-N 1 3 296.817 3.614 20 0 CHADHO CC(C)CN1CCC([NH2+][C@H](c2ccccc2)C2CC2)CC1 ZINC000120366770 330387248 /nfs/dbraw/zinc/38/72/48/330387248.db2.gz SQUYDURMQSBYAS-LJQANCHMSA-N 1 3 286.463 3.848 20 0 CHADHO CC(C)C[NH+]1CCC(N[C@H](c2ccccc2)C2CC2)CC1 ZINC000120366770 330387249 /nfs/dbraw/zinc/38/72/49/330387249.db2.gz SQUYDURMQSBYAS-LJQANCHMSA-N 1 3 286.463 3.848 20 0 CHADHO C[C@@H](c1ccc(F)c(Cl)c1)N1CCC2(CC[NH2+]C2)CC1 ZINC000431012498 330577780 /nfs/dbraw/zinc/57/77/80/330577780.db2.gz FMAWMGMZMXXVLV-LBPRGKRZSA-N 1 3 296.817 3.616 20 0 CHADHO CC[NH+](CC)CC1CCN(CCCCC(F)(F)F)CC1 ZINC000443621935 330803465 /nfs/dbraw/zinc/80/34/65/330803465.db2.gz AFGWJUINUWLNCK-UHFFFAOYSA-N 1 3 294.405 3.773 20 0 CHADHO CCC[C@H]([NH2+]C1CCN(C2CCCC2)CC1)C1CCC1 ZINC000453139191 331093214 /nfs/dbraw/zinc/09/32/14/331093214.db2.gz RKZPTLMEIDUXGQ-SFHVURJKSA-N 1 3 278.484 3.952 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@@H]2NC1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000453335243 331118346 /nfs/dbraw/zinc/11/83/46/331118346.db2.gz DFVUOJPOEMVNLG-PHSGOXPASA-N 1 3 298.474 3.896 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@@H]2NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000453335243 331118347 /nfs/dbraw/zinc/11/83/47/331118347.db2.gz DFVUOJPOEMVNLG-PHSGOXPASA-N 1 3 298.474 3.896 20 0 CHADHO C[C@@H]1CC[C@@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2sccc21 ZINC000453347667 331120253 /nfs/dbraw/zinc/12/02/53/331120253.db2.gz KXMBHSRZKYTBSX-QAXSNASLSA-N 1 3 290.476 3.901 20 0 CHADHO C[C@@H]1CC[C@@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2sccc21 ZINC000453347667 331120254 /nfs/dbraw/zinc/12/02/54/331120254.db2.gz KXMBHSRZKYTBSX-QAXSNASLSA-N 1 3 290.476 3.901 20 0 CHADHO CC(C)c1nc([C@H](C)NCCCC[N@H+](C)C2CC2)cs1 ZINC000453409524 331129745 /nfs/dbraw/zinc/12/97/45/331129745.db2.gz UNNUCGHPJOVPOE-ZDUSSCGKSA-N 1 3 295.496 3.792 20 0 CHADHO CC(C)c1nc([C@H](C)NCCCC[N@@H+](C)C2CC2)cs1 ZINC000453409524 331129746 /nfs/dbraw/zinc/12/97/46/331129746.db2.gz UNNUCGHPJOVPOE-ZDUSSCGKSA-N 1 3 295.496 3.792 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)CCc2cccc(Cl)c2)[C@H](C)C1 ZINC000459376895 331279066 /nfs/dbraw/zinc/27/90/66/331279066.db2.gz ODGGLXJCQYDQLE-PBHICJAKSA-N 1 3 294.870 3.545 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)CCc2cccc(Cl)c2)[C@H](C)C1 ZINC000459376895 331279067 /nfs/dbraw/zinc/27/90/67/331279067.db2.gz ODGGLXJCQYDQLE-PBHICJAKSA-N 1 3 294.870 3.545 20 0 CHADHO c1cc(N2CCC([NH2+][C@@H]3CC[C@@H]4CCC[C@H]4C3)CC2)ccn1 ZINC000459419801 331280588 /nfs/dbraw/zinc/28/05/88/331280588.db2.gz XJQOFCNJEVNXJD-XYJFISCASA-N 1 3 299.462 3.609 20 0 CHADHO C[C@@H]1CCC[C@@H](N2CCC([NH2+][C@H]3CCC[C@@H]4C[C@@H]43)CC2)C1 ZINC000459751674 331298503 /nfs/dbraw/zinc/29/85/03/331298503.db2.gz ICYZVQJTEIYOLB-LIEJCIORSA-N 1 3 290.495 3.808 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)C(C)(C)c1ccccc1 ZINC000484485116 331899450 /nfs/dbraw/zinc/89/94/50/331899450.db2.gz IWMPBTGSFNZQNY-SZMVWBNQSA-N 1 3 288.479 3.815 20 0 CHADHO CC[NH+](CC)CC1CCN([C@H](C)c2ccc(F)cc2)CC1 ZINC000488389771 332003630 /nfs/dbraw/zinc/00/36/30/332003630.db2.gz KTSFFLUADONHSV-OAHLLOKOSA-N 1 3 292.442 3.941 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H]2CS[C@H](C(C)(C)C)C2)C1 ZINC000488449048 332010058 /nfs/dbraw/zinc/01/00/58/332010058.db2.gz OMGVIBYKJAIXSW-OAGGEKHMSA-N 1 3 298.540 3.617 20 0 CHADHO CC(C)[N@@H+]1CCC[C@H](CN[C@H]2CS[C@H](C(C)(C)C)C2)C1 ZINC000488449048 332010059 /nfs/dbraw/zinc/01/00/59/332010059.db2.gz OMGVIBYKJAIXSW-OAGGEKHMSA-N 1 3 298.540 3.617 20 0 CHADHO CC(C)[N@H+]1CCC[C@H](CN[C@H]2CS[C@H](C(C)(C)C)C2)C1 ZINC000488449048 332010061 /nfs/dbraw/zinc/01/00/61/332010061.db2.gz OMGVIBYKJAIXSW-OAGGEKHMSA-N 1 3 298.540 3.617 20 0 CHADHO CC(C)C1CC([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000488451070 332010447 /nfs/dbraw/zinc/01/04/47/332010447.db2.gz RVVGSQQVSXRREC-UHFFFAOYSA-N 1 3 278.484 3.808 20 0 CHADHO CC(C)C1CC(NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000488451070 332010449 /nfs/dbraw/zinc/01/04/49/332010449.db2.gz RVVGSQQVSXRREC-UHFFFAOYSA-N 1 3 278.484 3.808 20 0 CHADHO CC(C)(C[NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1)CN1CCCC1 ZINC000488531954 332015977 /nfs/dbraw/zinc/01/59/77/332015977.db2.gz FSTIOVRZASIHLV-LSDHHAIUSA-N 1 3 298.540 3.618 20 0 CHADHO CC(C)(CN[C@@H]1CS[C@@H](C(C)(C)C)C1)C[NH+]1CCCC1 ZINC000488531954 332015978 /nfs/dbraw/zinc/01/59/78/332015978.db2.gz FSTIOVRZASIHLV-LSDHHAIUSA-N 1 3 298.540 3.618 20 0 CHADHO CC[C@]1(C)CCN(CCC[N@@H+]2CC[C@@](C)(CC)C2)C1 ZINC000489297756 332045976 /nfs/dbraw/zinc/04/59/76/332045976.db2.gz VOXANJWXDKMFNV-IAGOWNOFSA-N 1 3 266.473 3.621 20 0 CHADHO CC[C@]1(C)CCN(CCC[N@H+]2CC[C@@](C)(CC)C2)C1 ZINC000489297756 332045977 /nfs/dbraw/zinc/04/59/77/332045977.db2.gz VOXANJWXDKMFNV-IAGOWNOFSA-N 1 3 266.473 3.621 20 0 CHADHO C[C@]12C[C@H]1CCC[C@@H]2[NH2+]C1CCN(C2CCCC2)CC1 ZINC000502281442 332652217 /nfs/dbraw/zinc/65/22/17/332652217.db2.gz AOHXOFJNCYHVOB-JLSDUUJJSA-N 1 3 276.468 3.562 20 0 CHADHO C[C@@H]1C[C@@H](CCNCc2ccco2)C[N@@H+]1Cc1ccccc1 ZINC000513508617 333023441 /nfs/dbraw/zinc/02/34/41/333023441.db2.gz YTZSQFNCJSFMSF-SJLPKXTDSA-N 1 3 298.430 3.670 20 0 CHADHO C[C@@H]1C[C@@H](CCNCc2ccco2)C[N@H+]1Cc1ccccc1 ZINC000513508617 333023442 /nfs/dbraw/zinc/02/34/42/333023442.db2.gz YTZSQFNCJSFMSF-SJLPKXTDSA-N 1 3 298.430 3.670 20 0 CHADHO CC[NH+](CC)CCCN1CC[C@@H](c2ccccc2)[C@H]1C ZINC000514077357 333065088 /nfs/dbraw/zinc/06/50/88/333065088.db2.gz PSZOSIALXXLHOR-SJLPKXTDSA-N 1 3 274.452 3.596 20 0 CHADHO CCN(CC)CCC[N@@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC000514077357 333065089 /nfs/dbraw/zinc/06/50/89/333065089.db2.gz PSZOSIALXXLHOR-SJLPKXTDSA-N 1 3 274.452 3.596 20 0 CHADHO CCN(CC)CCC[N@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC000514077357 333065090 /nfs/dbraw/zinc/06/50/90/333065090.db2.gz PSZOSIALXXLHOR-SJLPKXTDSA-N 1 3 274.452 3.596 20 0 CHADHO CCN(CC)CCC[N@@H+]1CCC[C@@H]1c1ccccc1C ZINC000514079642 333065406 /nfs/dbraw/zinc/06/54/06/333065406.db2.gz HOTXKIWQEPPMFX-GOSISDBHSA-N 1 3 274.452 3.864 20 0 CHADHO CCN(CC)CCC[N@H+]1CCC[C@@H]1c1ccccc1C ZINC000514079642 333065407 /nfs/dbraw/zinc/06/54/07/333065407.db2.gz HOTXKIWQEPPMFX-GOSISDBHSA-N 1 3 274.452 3.864 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CC=CCC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000183102126 333119228 /nfs/dbraw/zinc/11/92/28/333119228.db2.gz LQSQOFQRMGBBTK-YESZJQIVSA-N 1 3 276.468 3.585 20 0 CHADHO Cc1cccc([C@@H]2CCN(CC[C@H]3CCCC[N@H+]3C)C2)c1 ZINC000564157470 333124799 /nfs/dbraw/zinc/12/47/99/333124799.db2.gz OYHINVOFYJFREF-RTBURBONSA-N 1 3 286.463 3.659 20 0 CHADHO Cc1cccc([C@@H]2CCN(CC[C@H]3CCCC[N@@H+]3C)C2)c1 ZINC000564157470 333124800 /nfs/dbraw/zinc/12/48/00/333124800.db2.gz OYHINVOFYJFREF-RTBURBONSA-N 1 3 286.463 3.659 20 0 CHADHO COc1ccsc1[C@H](C)[NH2+]CC1(CN(C)C)CCCC1 ZINC000186287883 333158297 /nfs/dbraw/zinc/15/82/97/333158297.db2.gz NEECNVVZMHWESD-ZDUSSCGKSA-N 1 3 296.480 3.529 20 0 CHADHO C[C@@H](c1cccc(F)c1)N1CCC(C[NH+]2CCCC2)CC1 ZINC000194740547 333276887 /nfs/dbraw/zinc/27/68/87/333276887.db2.gz DNVFWZIBOJMSOM-HNNXBMFYSA-N 1 3 290.426 3.695 20 0 CHADHO C[C@@H](NCC1(C)CC[NH+](C)CC1)c1ccc(F)cc1Cl ZINC000227497491 333283665 /nfs/dbraw/zinc/28/36/65/333283665.db2.gz GWCYHIWDCQOGCW-GFCCVEGCSA-N 1 3 298.833 3.862 20 0 CHADHO C[C@@H](N[C@H](CC[NH+](C)C)C(C)(C)C)c1ccccc1 ZINC000522545219 333289626 /nfs/dbraw/zinc/28/96/26/333289626.db2.gz IBSFFYKUQICELI-GDBMZVCRSA-N 1 3 262.441 3.704 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](N[C@H]2CCSc3ccc(Cl)cc32)C1 ZINC000250016229 333301342 /nfs/dbraw/zinc/30/13/42/333301342.db2.gz JUWYTVCXPPRVCT-DYEKYZERSA-N 1 3 296.867 3.736 20 0 CHADHO CN(Cc1ccc(C(C)(C)C)cc1)[C@@H]1CCC[NH2+]CC1 ZINC000234316103 333359624 /nfs/dbraw/zinc/35/96/24/333359624.db2.gz RGRTYIZBVAGVIN-QGZVFWFLSA-N 1 3 274.452 3.558 20 0 CHADHO CC1=C[C@@H](C)C[C@H](C[NH2+]C2CCN(C(C)(C)C)CC2)C1 ZINC000235663887 333371364 /nfs/dbraw/zinc/37/13/64/333371364.db2.gz UXSGJARHUHTGEU-ZBFHGGJFSA-N 1 3 278.484 3.831 20 0 CHADHO CC1=C[C@@H](C)C[C@H](C[NH2+]C2CC(C)(C)NC(C)(C)C2)C1 ZINC000235663448 333371412 /nfs/dbraw/zinc/37/14/12/333371412.db2.gz KBIZBMLAIHHBHM-HIFRSBDPSA-N 1 3 278.484 3.878 20 0 CHADHO CCN(C)C[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2)C1 ZINC000173898136 335143032 /nfs/dbraw/zinc/14/30/32/335143032.db2.gz JIGAXFJXUIQXKY-KRWDZBQOSA-N 1 3 282.431 3.613 20 0 CHADHO CCN(C)C[C@@H]1CC[N@@H+](Cc2ccc3ccccc3c2)C1 ZINC000173898136 335143034 /nfs/dbraw/zinc/14/30/34/335143034.db2.gz JIGAXFJXUIQXKY-KRWDZBQOSA-N 1 3 282.431 3.613 20 0 CHADHO CCC(F)(F)C(C)(C)CN[C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000530218949 333528867 /nfs/dbraw/zinc/52/88/67/333528867.db2.gz OEHMESUGMTWZOZ-BFHYXJOUSA-N 1 3 288.426 3.568 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1C[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000134015349 334077628 /nfs/dbraw/zinc/07/76/28/334077628.db2.gz JXCXAJMUPYGMHK-DOTOQJQBSA-N 1 3 278.484 3.831 20 0 CHADHO CC1(C)CCC[C@H]([NH2+]C2CC(C)(C)NC(C)(C)C2)C1 ZINC000079971879 334164646 /nfs/dbraw/zinc/16/46/46/334164646.db2.gz XMSUEQIOGNPCRH-ZDUSSCGKSA-N 1 3 266.473 3.854 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]C[C@@H]2CCC[C@@H](C)C2)C1 ZINC000245513710 334199055 /nfs/dbraw/zinc/19/90/55/334199055.db2.gz DLFCCGNRGGPMMF-BRWVUGGUSA-N 1 3 266.473 3.523 20 0 CHADHO CC[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000245755890 334217458 /nfs/dbraw/zinc/21/74/58/334217458.db2.gz UVGBAIVMBMYQEI-BRWVUGGUSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@H](NCCCCC[NH+]1CCCC1)c1ccc(F)cc1F ZINC000550881998 334231509 /nfs/dbraw/zinc/23/15/09/334231509.db2.gz GZVGUENNQALHRK-AWEZNQCLSA-N 1 3 296.405 3.882 20 0 CHADHO CC(C)(CC[NH2+]C1CCN(C2CCCC2)CC1)C1CC1 ZINC000551295998 334245515 /nfs/dbraw/zinc/24/55/15/334245515.db2.gz DJXWHHXERKVPNQ-UHFFFAOYSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@H](CCC(C)(C)C)[NH2+][C@@H]1CCC[C@H](N(C)C)C1 ZINC000551787756 334260977 /nfs/dbraw/zinc/26/09/77/334260977.db2.gz LWBIVFXJVXMQRO-KFWWJZLASA-N 1 3 254.462 3.664 20 0 CHADHO Cc1cc(C)c(CN(C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)c(C)c1 ZINC000246607112 334265131 /nfs/dbraw/zinc/26/51/31/334265131.db2.gz GKWSYLULHNPAAP-DLBZAZTESA-N 1 3 274.452 3.526 20 0 CHADHO Cc1cc(C)c(CN(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c(C)c1 ZINC000246607112 334265132 /nfs/dbraw/zinc/26/51/32/334265132.db2.gz GKWSYLULHNPAAP-DLBZAZTESA-N 1 3 274.452 3.526 20 0 CHADHO Cc1cc(C)c(CN(C)[C@H]2CC[N@H+](C)[C@@H](C)C2)c(C)c1 ZINC000246607119 334265197 /nfs/dbraw/zinc/26/51/97/334265197.db2.gz GKWSYLULHNPAAP-IRXDYDNUSA-N 1 3 274.452 3.526 20 0 CHADHO Cc1cc(C)c(CN(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c(C)c1 ZINC000246607119 334265199 /nfs/dbraw/zinc/26/51/99/334265199.db2.gz GKWSYLULHNPAAP-IRXDYDNUSA-N 1 3 274.452 3.526 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]C2[C@H](C)CCC[C@H]2C)C1 ZINC000246890574 334271349 /nfs/dbraw/zinc/27/13/49/334271349.db2.gz DSBLMZVARJDDFT-BZUAXINKSA-N 1 3 266.473 3.521 20 0 CHADHO Cc1ccccc1[C@H](C)[NH2+][C@H]1CCC[C@@H](N(C)C)C1 ZINC000247253376 334278307 /nfs/dbraw/zinc/27/83/07/334278307.db2.gz YMHRBWMHIJFWBH-HRCADAONSA-N 1 3 260.425 3.518 20 0 CHADHO C[C@@H]1CC[C@@H](NC[C@H]2CCC[N@H+](C)C2)c2ccccc21 ZINC000248168576 334296436 /nfs/dbraw/zinc/29/64/36/334296436.db2.gz UGEAZMBLOCARSM-IIDMSEBBSA-N 1 3 272.436 3.556 20 0 CHADHO C[C@@H]1CC[C@@H](NC[C@H]2CCC[N@@H+](C)C2)c2ccccc21 ZINC000248168576 334296437 /nfs/dbraw/zinc/29/64/37/334296437.db2.gz UGEAZMBLOCARSM-IIDMSEBBSA-N 1 3 272.436 3.556 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCCC[C@H]1C)c1ccccc1 ZINC000248412962 334300660 /nfs/dbraw/zinc/30/06/60/334300660.db2.gz KLWSNYSXZKFAJO-HZPDHXFCSA-N 1 3 260.425 3.602 20 0 CHADHO CC(C)[C@@H]1CC[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000552251194 334308754 /nfs/dbraw/zinc/30/87/54/334308754.db2.gz NBCKSAKZDAWMOX-ZWKOTPCHSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@H]1CCC[N@H+](CCCCN[C@H]2CCCc3occc32)C1 ZINC000248877623 334320417 /nfs/dbraw/zinc/32/04/17/334320417.db2.gz JTMBPZWVAHTFEE-RDJZCZTQSA-N 1 3 290.451 3.759 20 0 CHADHO C[C@H]1CCC[N@@H+](CCCCN[C@H]2CCCc3occc32)C1 ZINC000248877623 334320418 /nfs/dbraw/zinc/32/04/18/334320418.db2.gz JTMBPZWVAHTFEE-RDJZCZTQSA-N 1 3 290.451 3.759 20 0 CHADHO C[C@H](CC[NH2+][C@@H]1CCN2CCC[C@H]2C1)CC(C)(C)C ZINC000249046437 334325560 /nfs/dbraw/zinc/32/55/60/334325560.db2.gz FEANMLREAKOAAN-OAGGEKHMSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@H](CCN[C@@H]1CC[N@@H+]2CCC[C@H]2C1)CC(C)(C)C ZINC000249046437 334325562 /nfs/dbraw/zinc/32/55/62/334325562.db2.gz FEANMLREAKOAAN-OAGGEKHMSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@H](CCN[C@@H]1CC[N@H+]2CCC[C@H]2C1)CC(C)(C)C ZINC000249046437 334325563 /nfs/dbraw/zinc/32/55/63/334325563.db2.gz FEANMLREAKOAAN-OAGGEKHMSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)[C@H](N[C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(F)c(F)c1 ZINC000552580091 334337452 /nfs/dbraw/zinc/33/74/52/334337452.db2.gz PJGKDHJRSZDOFX-MRRJBJDNSA-N 1 3 296.405 3.734 20 0 CHADHO CC(C)[C@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(F)c(F)c1 ZINC000552580091 334337453 /nfs/dbraw/zinc/33/74/53/334337453.db2.gz PJGKDHJRSZDOFX-MRRJBJDNSA-N 1 3 296.405 3.734 20 0 CHADHO CC(C)c1ccc(CN[C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000250577845 334346571 /nfs/dbraw/zinc/34/65/71/334346571.db2.gz QGITZKOZNBXKOV-IPMKNSEASA-N 1 3 286.463 3.820 20 0 CHADHO CC(C)C[C@H](N[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000251383846 334360495 /nfs/dbraw/zinc/36/04/95/334360495.db2.gz IEDOGMLVVNUSIJ-QYZOEREBSA-N 1 3 286.463 3.990 20 0 CHADHO CC(C)C[C@H](N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000251383846 334360496 /nfs/dbraw/zinc/36/04/96/334360496.db2.gz IEDOGMLVVNUSIJ-QYZOEREBSA-N 1 3 286.463 3.990 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@H]1CN)c1cccc2ccccc21 ZINC000251522107 334363228 /nfs/dbraw/zinc/36/32/28/334363228.db2.gz LDQFYJWZRUZUIQ-YEWWUXTCSA-N 1 3 268.404 3.618 20 0 CHADHO C[C@H](N[C@H]1CCC[C@H]1C[NH3+])c1cccc2ccccc21 ZINC000251522107 334363230 /nfs/dbraw/zinc/36/32/30/334363230.db2.gz LDQFYJWZRUZUIQ-YEWWUXTCSA-N 1 3 268.404 3.618 20 0 CHADHO CC[C@@H]1CCC[C@H]([NH2+]C[C@H](C)CN2CCCCC2)C1 ZINC000251591441 334365145 /nfs/dbraw/zinc/36/51/45/334365145.db2.gz CRDZSNLARXSBRT-BBWFWOEESA-N 1 3 266.473 3.667 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H](c2ccc(C)cc2)C2CC2)C1 ZINC000091305945 334375748 /nfs/dbraw/zinc/37/57/48/334375748.db2.gz ANOQLZNYPUDACM-APWZRJJASA-N 1 3 286.463 3.768 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H](c2ccc(C)cc2)C2CC2)C1 ZINC000091305945 334375749 /nfs/dbraw/zinc/37/57/49/334375749.db2.gz ANOQLZNYPUDACM-APWZRJJASA-N 1 3 286.463 3.768 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H](c2ccc(C)cc2)C2CC2)C1 ZINC000091305945 334375750 /nfs/dbraw/zinc/37/57/50/334375750.db2.gz ANOQLZNYPUDACM-APWZRJJASA-N 1 3 286.463 3.768 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H](c2ccccc2)C2CC2)C1 ZINC000091333254 334376456 /nfs/dbraw/zinc/37/64/56/334376456.db2.gz SLBAPKIMAPXUNV-APWZRJJASA-N 1 3 286.463 3.848 20 0 CHADHO CC(C)[N@@H+]1CCC[C@H](CN[C@@H](c2ccccc2)C2CC2)C1 ZINC000091333254 334376457 /nfs/dbraw/zinc/37/64/57/334376457.db2.gz SLBAPKIMAPXUNV-APWZRJJASA-N 1 3 286.463 3.848 20 0 CHADHO CC(C)[N@H+]1CCC[C@H](CN[C@@H](c2ccccc2)C2CC2)C1 ZINC000091333254 334376459 /nfs/dbraw/zinc/37/64/59/334376459.db2.gz SLBAPKIMAPXUNV-APWZRJJASA-N 1 3 286.463 3.848 20 0 CHADHO c1csc(CN2CCC(CCC[NH+]3CCCC3)CC2)c1 ZINC000093769296 334479359 /nfs/dbraw/zinc/47/93/59/334479359.db2.gz YQQITLFFANNXMC-UHFFFAOYSA-N 1 3 292.492 3.836 20 0 CHADHO Cc1cc([C@H](C)NCc2ccc(C[NH3+])cc2)c(C)s1 ZINC000564989198 334532845 /nfs/dbraw/zinc/53/28/45/334532845.db2.gz UATHIUYKFGFCAD-LBPRGKRZSA-N 1 3 274.433 3.674 20 0 CHADHO C[C@H]1CCc2c(F)cccc2[C@H]1NCc1ccc(C[NH3+])cc1 ZINC000578868241 335682531 /nfs/dbraw/zinc/68/25/31/335682531.db2.gz VPSITFKVFXNRQW-DJJJIMSYSA-N 1 3 298.405 3.698 20 0 CHADHO CCC[C@@H](CC)[NH2+][C@H](C)c1cccc(OCCN(C)C)c1 ZINC000581268168 336034776 /nfs/dbraw/zinc/03/47/76/336034776.db2.gz SZZVLNWGEQFYRX-NVXWUHKLSA-N 1 3 292.467 3.856 20 0 CHADHO C[C@H](CC(C)(C)C)[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCCN1 ZINC000384682123 336129009 /nfs/dbraw/zinc/12/90/09/336129009.db2.gz UQEAOUUYLDWFMH-LVQVYYBASA-N 1 3 266.473 3.712 20 0 CHADHO CCC[C@@H](NC1CC[NH+](CC)CC1)c1ccsc1 ZINC000276146917 520771641 /nfs/dbraw/zinc/77/16/41/520771641.db2.gz DGSGEHJSTUXULO-OAHLLOKOSA-N 1 3 266.454 3.663 20 0 CHADHO CC(C)(C)[NH+]1CCC(NC2CC(c3ccccc3)C2)CC1 ZINC000037786499 518707162 /nfs/dbraw/zinc/70/71/62/518707162.db2.gz GHMHOURHKAMDGP-UHFFFAOYSA-N 1 3 286.463 3.785 20 0 CHADHO CC(C)Oc1ccc([C@H](C)N[C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000130122905 519781987 /nfs/dbraw/zinc/78/19/87/519781987.db2.gz MIIDCWDURZPSBY-VYDXJSESSA-N 1 3 290.451 3.607 20 0 CHADHO CC(C)Oc1ccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000130122905 519781988 /nfs/dbraw/zinc/78/19/88/519781988.db2.gz MIIDCWDURZPSBY-VYDXJSESSA-N 1 3 290.451 3.607 20 0 CHADHO CC1(C)CCCC[C@@H]1N[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227542158 520315714 /nfs/dbraw/zinc/31/57/14/520315714.db2.gz BQNPBNOECIPLFH-PMPSAXMXSA-N 1 3 258.409 3.690 20 0 CHADHO CN(C)Cc1cccc(C[NH2+]C(C2CCC2)C2CCC2)c1 ZINC000338686695 521924932 /nfs/dbraw/zinc/92/49/32/521924932.db2.gz IXYOFHOTGRQASP-UHFFFAOYSA-N 1 3 286.463 3.807 20 0 CHADHO NCCC[N@@H+](Cc1ccc2ncccc2c1)CC1CCCC1 ZINC000352540814 534607776 /nfs/dbraw/zinc/60/77/76/534607776.db2.gz PTXJJTZUVJADAJ-UHFFFAOYSA-N 1 3 297.446 3.576 20 0 CHADHO NCCC[N@H+](Cc1ccc2ncccc2c1)CC1CCCC1 ZINC000352540814 534607779 /nfs/dbraw/zinc/60/77/79/534607779.db2.gz PTXJJTZUVJADAJ-UHFFFAOYSA-N 1 3 297.446 3.576 20 0 CHADHO CC[C@H](N[C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000129625911 522754563 /nfs/dbraw/zinc/75/45/63/522754563.db2.gz OKKDMGPFEUHTQZ-KCXAZCMYSA-N 1 3 280.843 3.863 20 0 CHADHO CC[C@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000129625911 522754564 /nfs/dbraw/zinc/75/45/64/522754564.db2.gz OKKDMGPFEUHTQZ-KCXAZCMYSA-N 1 3 280.843 3.863 20 0 CHADHO CSC1(CNC2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)CC1 ZINC000365106205 525330134 /nfs/dbraw/zinc/33/01/34/525330134.db2.gz CPSVVBDQLBQTLK-GDBMZVCRSA-N 1 3 296.524 3.515 20 0 CHADHO CSC1(C[NH2+]C2CCN([C@@H]3CCCC[C@H]3C)CC2)CC1 ZINC000365106205 525330142 /nfs/dbraw/zinc/33/01/42/525330142.db2.gz CPSVVBDQLBQTLK-GDBMZVCRSA-N 1 3 296.524 3.515 20 0 CHADHO C[C@H]([NH2+][C@@H]1C[C@@H]1c1ccccc1)[C@@H]1CCCN(C2CCC2)C1 ZINC000291292423 525589360 /nfs/dbraw/zinc/58/93/60/525589360.db2.gz ZZTPDSFCTIYLAE-JQERWDHBSA-N 1 3 298.474 3.785 20 0 CHADHO C[C@H](N[C@@H]1C[C@@H]1c1ccccc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000291292423 525589371 /nfs/dbraw/zinc/58/93/71/525589371.db2.gz ZZTPDSFCTIYLAE-JQERWDHBSA-N 1 3 298.474 3.785 20 0 CHADHO C[C@H](N[C@@H]1C[C@@H]1c1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000291292423 525589382 /nfs/dbraw/zinc/58/93/82/525589382.db2.gz ZZTPDSFCTIYLAE-JQERWDHBSA-N 1 3 298.474 3.785 20 0 CHADHO Cc1ccc([C@@H](NC[C@@H]2CC[N@@H+](C3CC3)C2)C2CC2)cc1 ZINC000037648848 525774507 /nfs/dbraw/zinc/77/45/07/525774507.db2.gz UODNGVXQSFUFQB-HNAYVOBHSA-N 1 3 284.447 3.520 20 0 CHADHO Cc1ccc([C@@H](NC[C@@H]2CC[N@H+](C3CC3)C2)C2CC2)cc1 ZINC000037648848 525774510 /nfs/dbraw/zinc/77/45/10/525774510.db2.gz UODNGVXQSFUFQB-HNAYVOBHSA-N 1 3 284.447 3.520 20 0 CHADHO CSc1ccc([C@H](C)NC[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000037649185 526072203 /nfs/dbraw/zinc/07/22/03/526072203.db2.gz NCEYQEHAFMBTIF-UONOGXRCSA-N 1 3 290.476 3.543 20 0 CHADHO CSc1ccc([C@H](C)NC[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000037649185 526072211 /nfs/dbraw/zinc/07/22/11/526072211.db2.gz NCEYQEHAFMBTIF-UONOGXRCSA-N 1 3 290.476 3.543 20 0 CHADHO Cc1nc(C)c([C@@H](C)[NH2+]CCCN2CCC(C)CC2)s1 ZINC000111360075 526745064 /nfs/dbraw/zinc/74/50/64/526745064.db2.gz FJPBVUNHWAOMIO-CYBMUJFWSA-N 1 3 295.496 3.533 20 0 CHADHO CC1=CCC[C@@H](C)[C@@H]1C[NH+]1CCC(N2CCCC2)CC1 ZINC000191047211 528104979 /nfs/dbraw/zinc/10/49/79/528104979.db2.gz UWZVILIDIHHFGH-SJLPKXTDSA-N 1 3 276.468 3.539 20 0 CHADHO CC1=CCC[C@@H](C)[C@@H]1CN1CCC([NH+]2CCCC2)CC1 ZINC000191047211 528104985 /nfs/dbraw/zinc/10/49/85/528104985.db2.gz UWZVILIDIHHFGH-SJLPKXTDSA-N 1 3 276.468 3.539 20 0 CHADHO CC(C)Cc1ccc([C@H](C)N[C@@H]2CCC[NH2+]CC2)cc1 ZINC000133640651 1125481212 /nfs/dbraw/zinc/48/12/12/1125481212.db2.gz HYULYVMHDCUAAJ-MAUKXSAKSA-N 1 3 274.452 3.678 20 0 CHADHO CC[C@H](C)C[C@H](CC)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000624119505 1117983493 /nfs/dbraw/zinc/98/34/93/1117983493.db2.gz DGAGCGGXFAHHBB-XHSDSOJGSA-N 1 3 254.462 3.523 20 0 CHADHO CCCCCC[C@H](C)[NH2+][C@@H]1CCC[C@H](N(C)C)C1 ZINC000715508952 1118308575 /nfs/dbraw/zinc/30/85/75/1118308575.db2.gz LTKUUMCWXPKYHH-XHSDSOJGSA-N 1 3 254.462 3.808 20 0 CHADHO C[C@H](NCc1ccc(C[NH+]2CCCC2)cc1)c1cccnc1 ZINC000112518291 1125486482 /nfs/dbraw/zinc/48/64/82/1125486482.db2.gz UKSPYZHTWJQHQC-INIZCTEOSA-N 1 3 295.430 3.528 20 0 CHADHO CCN(C)C1CC[NH+](C[C@@H](C)CCC=C(C)C)CC1 ZINC001201497778 1123111288 /nfs/dbraw/zinc/11/12/88/1123111288.db2.gz YZTVYMPKBAOPSR-INIZCTEOSA-N 1 3 266.473 3.785 20 0 CHADHO CC[C@H](C)C[N@@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001201521627 1123121507 /nfs/dbraw/zinc/12/15/07/1123121507.db2.gz WNVNEOPSJLVIRH-HNNXBMFYSA-N 1 3 266.473 3.761 20 0 CHADHO CCC(CC)C[N@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001201531769 1123122304 /nfs/dbraw/zinc/12/23/04/1123122304.db2.gz VLLSUCYLAJNXRI-KRWDZBQOSA-N 1 3 266.473 3.763 20 0 CHADHO Cc1ccc([C@@H](C)N[C@H]2CC[N@H+](C)C(C)(C)C2)s1 ZINC000858106880 1123632036 /nfs/dbraw/zinc/63/20/36/1123632036.db2.gz CICXDQKOTPINGE-OLZOCXBDSA-N 1 3 266.454 3.580 20 0 CHADHO Cc1ccc([C@@H](C)N[C@H]2CC[N@@H+](C)C(C)(C)C2)s1 ZINC000858106880 1123632038 /nfs/dbraw/zinc/63/20/38/1123632038.db2.gz CICXDQKOTPINGE-OLZOCXBDSA-N 1 3 266.454 3.580 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)C1CCCC1 ZINC000449131479 1124652944 /nfs/dbraw/zinc/65/29/44/1124652944.db2.gz MWQNCTFPHVVARM-DOTOQJQBSA-N 1 3 266.473 3.665 20 0 CHADHO CC1(N2CCC2)CC[NH+](CCSC2CCCCC2)CC1 ZINC000880473734 1125276574 /nfs/dbraw/zinc/27/65/74/1125276574.db2.gz MNNNWYJFPFWBJQ-UHFFFAOYSA-N 1 3 296.524 3.613 20 0 CHADHO CC[C@@H](NCC1=CC[N@H+](C)CC1)c1sccc1Cl ZINC000883210409 1125378341 /nfs/dbraw/zinc/37/83/41/1125378341.db2.gz TWAWVNBJHICVBG-CYBMUJFWSA-N 1 3 284.856 3.704 20 0 CHADHO CC[C@@H](NCC1=CC[N@@H+](C)CC1)c1sccc1Cl ZINC000883210409 1125378343 /nfs/dbraw/zinc/37/83/43/1125378343.db2.gz TWAWVNBJHICVBG-CYBMUJFWSA-N 1 3 284.856 3.704 20 0 CHADHO C=C/C=C\CC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000883260442 1125386975 /nfs/dbraw/zinc/38/69/75/1125386975.db2.gz UPBUJTMMOCLRRU-ARJAWSKDSA-N 1 3 262.441 3.505 20 0 CHADHO CCCCC(CCCC)[N@@H+]1C[C@H](CF)[C@@H](C2(N)CC2)C1 ZINC001246698431 1131780455 /nfs/dbraw/zinc/78/04/55/1131780455.db2.gz XWNICBXKUHTFET-HOCLYGCPSA-N 1 3 284.463 3.744 20 0 CHADHO CCCCC(CCCC)[N@H+]1C[C@H](CF)[C@@H](C2(N)CC2)C1 ZINC001246698431 1131780463 /nfs/dbraw/zinc/78/04/63/1131780463.db2.gz XWNICBXKUHTFET-HOCLYGCPSA-N 1 3 284.463 3.744 20 0 CHADHO Cc1c(Cl)ccc(CN2CCC[C@](C)(C[NH3+])CC2)c1F ZINC001206326450 1133689595 /nfs/dbraw/zinc/68/95/95/1133689595.db2.gz NPHFTXBUVQSKCZ-INIZCTEOSA-N 1 3 298.833 3.738 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1N[C@H]1CCCc2cc(F)ccc21 ZINC000245597618 1125583896 /nfs/dbraw/zinc/58/38/96/1125583896.db2.gz NSNHKKMVHSZSBZ-COCCGSRQSA-N 1 3 290.426 3.521 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1N[C@H]1CCCc2cc(F)ccc21 ZINC000245597618 1125583900 /nfs/dbraw/zinc/58/39/00/1125583900.db2.gz NSNHKKMVHSZSBZ-COCCGSRQSA-N 1 3 290.426 3.521 20 0 CHADHO CCN1CC[C@H]([N@H+](C)Cc2ccc([C@@H]3C[C@H]3C)o2)[C@@H](C)C1 ZINC000245771700 1125594039 /nfs/dbraw/zinc/59/40/39/1125594039.db2.gz RZASARWNGFBHJO-WTTBNOFXSA-N 1 3 290.451 3.565 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)Cc2ccc([C@@H]3C[C@H]3C)o2)[C@@H](C)C1 ZINC000245771700 1125594045 /nfs/dbraw/zinc/59/40/45/1125594045.db2.gz RZASARWNGFBHJO-WTTBNOFXSA-N 1 3 290.451 3.565 20 0 CHADHO Clc1ccc(C2CCN(C[C@H]3CCC[NH2+]C3)CC2)cc1 ZINC000262009375 1125750577 /nfs/dbraw/zinc/75/05/77/1125750577.db2.gz UYYDJMSJLFWOBM-AWEZNQCLSA-N 1 3 292.854 3.519 20 0 CHADHO C[C@H]([NH2+][C@H](CCN(C)C)C(C)(C)C)c1cc(F)cc(F)c1 ZINC000483194609 1126772142 /nfs/dbraw/zinc/77/21/42/1126772142.db2.gz JGECGJIVYOJEFB-BLLLJJGKSA-N 1 3 298.421 3.982 20 0 CHADHO Cc1ccccc1[C@@H](C)N1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000483222072 1126773282 /nfs/dbraw/zinc/77/32/82/1126773282.db2.gz SRAAAHIHCBFWPP-AEFFLSMTSA-N 1 3 286.463 3.720 20 0 CHADHO Cc1ccccc1[C@@H](C)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000483222072 1126773283 /nfs/dbraw/zinc/77/32/83/1126773283.db2.gz SRAAAHIHCBFWPP-AEFFLSMTSA-N 1 3 286.463 3.720 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CC(C)(C)c3ccccc32)C1 ZINC000484463583 1126817949 /nfs/dbraw/zinc/81/79/49/1126817949.db2.gz ADRGNEDOSVGTKW-DAYGRLMNSA-N 1 3 286.463 3.871 20 0 CHADHO C(C1CCCC1)N1CCC([NH2+]C2CCC3(CC3)CC2)CC1 ZINC000486722459 1126997469 /nfs/dbraw/zinc/99/74/69/1126997469.db2.gz PCEPNARIKWLUQV-UHFFFAOYSA-N 1 3 290.495 3.953 20 0 CHADHO C[C@H]([NH2+]C1CCN(C2CCCCC2)CC1)[C@@H]1CC1(C)C ZINC000487275492 1127027667 /nfs/dbraw/zinc/02/76/67/1127027667.db2.gz PFSQUBINSIQHME-YOEHRIQHSA-N 1 3 278.484 3.808 20 0 CHADHO Cc1ccc([C@@H](C)NC2CC[NH+](C3CCC3)CC2)s1 ZINC000269059445 1127034507 /nfs/dbraw/zinc/03/45/07/1127034507.db2.gz XLNVNQANWJVDRD-CYBMUJFWSA-N 1 3 278.465 3.724 20 0 CHADHO C[C@H](Cc1ccc(Cl)cc1)[NH2+][C@@H]1CCNC2(CCC2)C1 ZINC000666995323 1127139630 /nfs/dbraw/zinc/13/96/30/1127139630.db2.gz KCYYUWKOCLODKL-CZUORRHYSA-N 1 3 292.854 3.535 20 0 CHADHO CCSc1cccc(C[NH2+]CCCN2CCCCC2)c1 ZINC000349665351 1127157762 /nfs/dbraw/zinc/15/77/62/1127157762.db2.gz ILOCNDUDEAEUPW-UHFFFAOYSA-N 1 3 292.492 3.764 20 0 CHADHO CC[C@H]1c2ccccc2CCN1C1CC[NH+](CC2CC2)CC1 ZINC001168387738 1127215087 /nfs/dbraw/zinc/21/50/87/1127215087.db2.gz RXWCYTBVKSZWBU-FQEVSTJZSA-N 1 3 298.474 3.870 20 0 CHADHO CN(Cc1cccc2ccccc21)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000285451348 1127228276 /nfs/dbraw/zinc/22/82/76/1127228276.db2.gz JBEWJOISIFYIPK-DFNIBXOVSA-N 1 3 294.442 3.897 20 0 CHADHO CN(Cc1cccc2ccccc21)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000285451348 1127228278 /nfs/dbraw/zinc/22/82/78/1127228278.db2.gz JBEWJOISIFYIPK-DFNIBXOVSA-N 1 3 294.442 3.897 20 0 CHADHO Cc1cc(Cl)ccc1C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)N2C ZINC000285483347 1127232386 /nfs/dbraw/zinc/23/23/86/1127232386.db2.gz LOHQZNVWEDEKTA-SJPCQFCGSA-N 1 3 292.854 3.705 20 0 CHADHO Cc1cc(Cl)ccc1C[N@H+](C)C1C[C@H]2CC[C@@H](C1)N2C ZINC000285483347 1127232389 /nfs/dbraw/zinc/23/23/89/1127232389.db2.gz LOHQZNVWEDEKTA-SJPCQFCGSA-N 1 3 292.854 3.705 20 0 CHADHO CCC[N@@H+]1CCC[C@H]1CN[C@@H](CC)c1ccc(OC)cc1 ZINC000353973021 1127282796 /nfs/dbraw/zinc/28/27/96/1127282796.db2.gz PCXYSGREXDIMJX-WMZOPIPTSA-N 1 3 290.451 3.610 20 0 CHADHO CCC[N@H+]1CCC[C@H]1CN[C@@H](CC)c1ccc(OC)cc1 ZINC000353973021 1127282799 /nfs/dbraw/zinc/28/27/99/1127282799.db2.gz PCXYSGREXDIMJX-WMZOPIPTSA-N 1 3 290.451 3.610 20 0 CHADHO CC[C@@H]1CCC[C@H]([NH2+]CC[C@@H](C)N2CCCCC2)C1 ZINC001308365065 1127372814 /nfs/dbraw/zinc/37/28/14/1127372814.db2.gz CLTUZFHDNDFRQO-ZACQAIPSSA-N 1 3 266.473 3.809 20 0 CHADHO CCN1CC[C@@H]([N@H+](C)Cc2ccccc2SC)C[C@H]1C ZINC000358030279 1127397383 /nfs/dbraw/zinc/39/73/83/1127397383.db2.gz GLSZARZKBRBTER-GDBMZVCRSA-N 1 3 292.492 3.713 20 0 CHADHO CCN1CC[C@@H]([N@@H+](C)Cc2ccccc2SC)C[C@H]1C ZINC000358030279 1127397385 /nfs/dbraw/zinc/39/73/85/1127397385.db2.gz GLSZARZKBRBTER-GDBMZVCRSA-N 1 3 292.492 3.713 20 0 CHADHO CC(C)[C@@H]([NH2+]CCCN1CCCC1)c1ccc(F)c(F)c1 ZINC000543774286 1127438480 /nfs/dbraw/zinc/43/84/80/1127438480.db2.gz OOHSXFMLEDSVOT-QGZVFWFLSA-N 1 3 296.405 3.737 20 0 CHADHO CCCN1CCC([NH2+]Cc2ccc(C(C)(F)F)cc2)CC1 ZINC000293591667 1127507478 /nfs/dbraw/zinc/50/74/78/1127507478.db2.gz CTQVKHLRNGOFMI-UHFFFAOYSA-N 1 3 296.405 3.762 20 0 CHADHO C[C@H](N[C@H]1CC[N@H+](C)[C@H](C)C1)c1cccc(C2CC2)c1 ZINC000294564000 1127582368 /nfs/dbraw/zinc/58/23/68/1127582368.db2.gz BNRKQKMMCICLMK-GLJUWKHASA-N 1 3 272.436 3.697 20 0 CHADHO C[C@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc(C2CC2)c1 ZINC000294564000 1127582370 /nfs/dbraw/zinc/58/23/70/1127582370.db2.gz BNRKQKMMCICLMK-GLJUWKHASA-N 1 3 272.436 3.697 20 0 CHADHO Cc1cc([C@H](C)[NH2+]C2CCN(CC3CC3)CC2)cs1 ZINC000295996515 1127659701 /nfs/dbraw/zinc/65/97/01/1127659701.db2.gz NZRLQCSHDADQJN-ZDUSSCGKSA-N 1 3 278.465 3.582 20 0 CHADHO C[C@H](CN[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1cccc(Cl)c1 ZINC000372459312 1127800103 /nfs/dbraw/zinc/80/01/03/1127800103.db2.gz BVYJZJYUNYHRCO-XYPHTWIQSA-N 1 3 292.854 3.660 20 0 CHADHO C[C@H](CN[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cccc(Cl)c1 ZINC000372459312 1127800107 /nfs/dbraw/zinc/80/01/07/1127800107.db2.gz BVYJZJYUNYHRCO-XYPHTWIQSA-N 1 3 292.854 3.660 20 0 CHADHO FCCC[C@@H]1CCC[C@@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000374603641 1127906165 /nfs/dbraw/zinc/90/61/65/1127906165.db2.gz NGAPDLURNCUBII-YJBOKZPZSA-N 1 3 296.474 3.901 20 0 CHADHO Cc1cc(C[NH2+][C@H]2CCN(C)C(C)(C)C2)ccc1Cl ZINC000623492147 1127903092 /nfs/dbraw/zinc/90/30/92/1127903092.db2.gz NRXMFRXTRBNXBI-AWEZNQCLSA-N 1 3 280.843 3.611 20 0 CHADHO C[N@@H+]1CCC[C@@H]1CCN[C@H](c1ccc(F)cc1)C1CCC1 ZINC000535468456 1127916762 /nfs/dbraw/zinc/91/67/62/1127916762.db2.gz IXVXBINEZWCZDO-MSOLQXFVSA-N 1 3 290.426 3.741 20 0 CHADHO C[N@H+]1CCC[C@@H]1CCN[C@H](c1ccc(F)cc1)C1CCC1 ZINC000535468456 1127916765 /nfs/dbraw/zinc/91/67/65/1127916765.db2.gz IXVXBINEZWCZDO-MSOLQXFVSA-N 1 3 290.426 3.741 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+][C@H](c1ccc(F)cc1)C1CCC1 ZINC000535468456 1127916768 /nfs/dbraw/zinc/91/67/68/1127916768.db2.gz IXVXBINEZWCZDO-MSOLQXFVSA-N 1 3 290.426 3.741 20 0 CHADHO CC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCCN(CC(C)C)C1 ZINC000540147244 1127963423 /nfs/dbraw/zinc/96/34/23/1127963423.db2.gz HUZCLOZOELOZCM-GVDBMIGSSA-N 1 3 266.473 3.523 20 0 CHADHO CC[N@@H+]1CC[C@H](NCc2csc3ccccc23)[C@@H](C)C1 ZINC000540195229 1127968940 /nfs/dbraw/zinc/96/89/40/1127968940.db2.gz OXNLTJCMIXMZAY-BBRMVZONSA-N 1 3 288.460 3.721 20 0 CHADHO CC[N@H+]1CC[C@H](NCc2csc3ccccc23)[C@@H](C)C1 ZINC000540195229 1127968944 /nfs/dbraw/zinc/96/89/44/1127968944.db2.gz OXNLTJCMIXMZAY-BBRMVZONSA-N 1 3 288.460 3.721 20 0 CHADHO CCc1cccc(CN2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000469730908 1128051342 /nfs/dbraw/zinc/05/13/42/1128051342.db2.gz GZHMBKKLLZJADJ-QUCCMNQESA-N 1 3 298.474 3.698 20 0 CHADHO CCc1cccc(CN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000469730908 1128051347 /nfs/dbraw/zinc/05/13/47/1128051347.db2.gz GZHMBKKLLZJADJ-QUCCMNQESA-N 1 3 298.474 3.698 20 0 CHADHO c1ccc([C@@H]2CCCCC[N@H+]2C[C@H]2CCCNC2)cc1 ZINC000469873126 1128056926 /nfs/dbraw/zinc/05/69/26/1128056926.db2.gz XUBQYIKVWGDMCM-WMZOPIPTSA-N 1 3 272.436 3.603 20 0 CHADHO c1ccc([C@@H]2CCCCC[N@@H+]2C[C@H]2CCCNC2)cc1 ZINC000469873126 1128056931 /nfs/dbraw/zinc/05/69/31/1128056931.db2.gz XUBQYIKVWGDMCM-WMZOPIPTSA-N 1 3 272.436 3.603 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@H+](C)C[C@@H]1CCCNC1 ZINC000469977569 1128060409 /nfs/dbraw/zinc/06/04/09/1128060409.db2.gz VOJXAKLPIHTNPL-SOUVJXGZSA-N 1 3 294.870 3.763 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)C[C@@H]1CCCNC1 ZINC000469977569 1128060413 /nfs/dbraw/zinc/06/04/13/1128060413.db2.gz VOJXAKLPIHTNPL-SOUVJXGZSA-N 1 3 294.870 3.763 20 0 CHADHO CCC[C@@H](NCCCC[NH+](C)C)c1ncccc1Cl ZINC000924853321 1128114781 /nfs/dbraw/zinc/11/47/81/1128114781.db2.gz JNHGWRWUAJSHHV-CQSZACIVSA-N 1 3 283.847 3.508 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1cc2ccccc2[nH]1 ZINC000925217454 1128125875 /nfs/dbraw/zinc/12/58/75/1128125875.db2.gz PCNWRVAHGADYDW-CWRNSKLLSA-N 1 3 285.435 3.691 20 0 CHADHO CCC1([NH3+])CCN([C@H]2CC[C@H](C)c3ccsc32)CC1 ZINC000925760801 1128140963 /nfs/dbraw/zinc/14/09/63/1128140963.db2.gz SESDNGUBTJNLMM-JSGCOSHPSA-N 1 3 278.465 3.890 20 0 CHADHO CN(C[C@@H]1CCC[N@H+](C)C1)[C@@H]1CCc2cc(Cl)ccc21 ZINC000777783643 1128274557 /nfs/dbraw/zinc/27/45/57/1128274557.db2.gz CUHYLOYFMZSWRV-CXAGYDPISA-N 1 3 292.854 3.601 20 0 CHADHO CN(C[C@@H]1CCC[N@@H+](C)C1)[C@@H]1CCc2cc(Cl)ccc21 ZINC000777783643 1128274561 /nfs/dbraw/zinc/27/45/61/1128274561.db2.gz CUHYLOYFMZSWRV-CXAGYDPISA-N 1 3 292.854 3.601 20 0 CHADHO CC(C)CCC[C@H](C)[NH2+][C@H]1CCC[C@H](N(C)C)C1 ZINC000715232778 1128290389 /nfs/dbraw/zinc/29/03/89/1128290389.db2.gz AIQQNSVLOXTGOO-JYJNAYRXSA-N 1 3 254.462 3.664 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H]2C[C@H](C(C)C)c3ccccc32)C1 ZINC000562592603 1128412618 /nfs/dbraw/zinc/41/26/18/1128412618.db2.gz MPCOGOKXUXGMCB-LZQZEXGQSA-N 1 3 286.463 3.802 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H]2C[C@H](C(C)C)c3ccccc32)C1 ZINC000562592603 1128412619 /nfs/dbraw/zinc/41/26/19/1128412619.db2.gz MPCOGOKXUXGMCB-LZQZEXGQSA-N 1 3 286.463 3.802 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H]2C[C@H](C(C)C)c3ccccc32)C1 ZINC000562592603 1128412622 /nfs/dbraw/zinc/41/26/22/1128412622.db2.gz MPCOGOKXUXGMCB-LZQZEXGQSA-N 1 3 286.463 3.802 20 0 CHADHO CCCC[N@H+](CCC[C@H](C)O)C1CC(C)(C)NC(C)(C)C1 ZINC000931034139 1128345193 /nfs/dbraw/zinc/34/51/93/1128345193.db2.gz OQZJVZUCRJLPFY-HNNXBMFYSA-N 1 3 298.515 3.559 20 0 CHADHO CCCC[N@@H+](CCC[C@H](C)O)C1CC(C)(C)NC(C)(C)C1 ZINC000931034139 1128345197 /nfs/dbraw/zinc/34/51/97/1128345197.db2.gz OQZJVZUCRJLPFY-HNNXBMFYSA-N 1 3 298.515 3.559 20 0 CHADHO C[C@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc2c(c1)CCCC2 ZINC000124358616 1128444005 /nfs/dbraw/zinc/44/40/05/1128444005.db2.gz FZQQOLQUSGVXGG-HOTGVXAUSA-N 1 3 298.474 3.700 20 0 CHADHO C[C@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc2c(c1)CCCC2 ZINC000124358616 1128444008 /nfs/dbraw/zinc/44/40/08/1128444008.db2.gz FZQQOLQUSGVXGG-HOTGVXAUSA-N 1 3 298.474 3.700 20 0 CHADHO Cc1ccccc1[C@H](C)[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000125905444 1128456346 /nfs/dbraw/zinc/45/63/46/1128456346.db2.gz HXEYEQFSRPCCOP-IRXDYDNUSA-N 1 3 274.452 3.766 20 0 CHADHO Cc1ccccc1[C@@H](C)[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000125905228 1128456496 /nfs/dbraw/zinc/45/64/96/1128456496.db2.gz HXEYEQFSRPCCOP-SJORKVTESA-N 1 3 274.452 3.766 20 0 CHADHO CCCc1ccc(C[NH2+]C2CCN(C(C)(C)C)CC2)cc1 ZINC000916838310 1128457327 /nfs/dbraw/zinc/45/73/27/1128457327.db2.gz VOYVBIHBQAAAOY-UHFFFAOYSA-N 1 3 288.479 3.992 20 0 CHADHO CCC[C@@H](C)CC[C@@H](C)N1CCC([NH+](C)C)CC1 ZINC001257476520 1128480789 /nfs/dbraw/zinc/48/07/89/1128480789.db2.gz LPAWZLUKRSVGLY-HUUCEWRRSA-N 1 3 254.462 3.617 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]C[C@@H](C)c2ccc(F)cc2)C1 ZINC000127879323 1128483217 /nfs/dbraw/zinc/48/32/17/1128483217.db2.gz BYFRQMNAFSGTPR-CVEARBPZSA-N 1 3 292.442 3.639 20 0 CHADHO CCC[C@H](C)CC[C@@H](C)[NH+]1CCC2(CN(C)C2)CC1 ZINC001257485192 1128503772 /nfs/dbraw/zinc/50/37/72/1128503772.db2.gz JIMUVXLSJUDYGZ-JKSUJKDBSA-N 1 3 266.473 3.619 20 0 CHADHO CCCCC[C@@H](C)N1CCC(C)([NH+]2CCCC2)CC1 ZINC001257520707 1128540673 /nfs/dbraw/zinc/54/06/73/1128540673.db2.gz VRPCPYNPUFZICZ-MRXNPFEDSA-N 1 3 266.473 3.906 20 0 CHADHO CCc1cccc(C[NH2+]C2CCN(C(C)(C)C)CC2)c1 ZINC000567240228 1128560772 /nfs/dbraw/zinc/56/07/72/1128560772.db2.gz MEBJYMLGZNNZGQ-UHFFFAOYSA-N 1 3 274.452 3.602 20 0 CHADHO C1CCC(N2CCC([NH2+][C@@H]3CC4CCC3CC4)CC2)CC1 ZINC000556202403 1128563283 /nfs/dbraw/zinc/56/32/83/1128563283.db2.gz NILXYPATUCPGNT-LADRWXRNSA-N 1 3 290.495 3.952 20 0 CHADHO C[C@H](NCCCCC[NH+]1CCCC1)c1cc(F)ccc1F ZINC000556231980 1128567106 /nfs/dbraw/zinc/56/71/06/1128567106.db2.gz GWSICDNEWBPRSH-AWEZNQCLSA-N 1 3 296.405 3.882 20 0 CHADHO CN1CCC[C@H]1CC[NH2+]C(C)(C)c1cccc(Cl)c1 ZINC000569995848 1128613474 /nfs/dbraw/zinc/61/34/74/1128613474.db2.gz PFLQZAAKEVHNSX-HNNXBMFYSA-N 1 3 280.843 3.649 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC(C)(C)C1)[C@H]1CCCN(C2CCC2)C1 ZINC000568137406 1128579062 /nfs/dbraw/zinc/57/90/62/1128579062.db2.gz AXTWFTLUTGVJQA-HRCADAONSA-N 1 3 278.484 3.808 20 0 CHADHO CC[C@@H]1CCC[C@@H]([NH2+]CCCN2CCCC[C@@H]2C)C1 ZINC000071105386 1128583563 /nfs/dbraw/zinc/58/35/63/1128583563.db2.gz FMXDZQUFTILFQK-GVDBMIGSSA-N 1 3 266.473 3.809 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H]2CCCc3c(Cl)cccc32)C1 ZINC000568801505 1128592160 /nfs/dbraw/zinc/59/21/60/1128592160.db2.gz XQIQNLYGOLPVIP-DYVFJYSZSA-N 1 3 292.854 3.649 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H]2CCCc3c(Cl)cccc32)C1 ZINC000568801505 1128592164 /nfs/dbraw/zinc/59/21/64/1128592164.db2.gz XQIQNLYGOLPVIP-DYVFJYSZSA-N 1 3 292.854 3.649 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H]2CCCc3c(Cl)cccc32)C1 ZINC000568801505 1128592168 /nfs/dbraw/zinc/59/21/68/1128592168.db2.gz XQIQNLYGOLPVIP-DYVFJYSZSA-N 1 3 292.854 3.649 20 0 CHADHO Cc1cccc([C@H](C)[NH2+]C2CCN(CC(C)C)CC2)c1 ZINC000131233466 1128610115 /nfs/dbraw/zinc/61/01/15/1128610115.db2.gz IKMKWPPZTSIYQL-INIZCTEOSA-N 1 3 274.452 3.766 20 0 CHADHO CC(C)C[C@H](C)C[NH2+]C1CCN(CC2CCCC2)CC1 ZINC000570485304 1128624524 /nfs/dbraw/zinc/62/45/24/1128624524.db2.gz WFTPXHSPKOMZIU-INIZCTEOSA-N 1 3 280.500 3.913 20 0 CHADHO CN1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccc3ccccc3c2)C1 ZINC000571924246 1128639571 /nfs/dbraw/zinc/63/95/71/1128639571.db2.gz FRIPYTIHRPDDTL-WOJBJXKFSA-N 1 3 294.442 3.756 20 0 CHADHO CN1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccc3ccccc3c2)C1 ZINC000571924246 1128639574 /nfs/dbraw/zinc/63/95/74/1128639574.db2.gz FRIPYTIHRPDDTL-WOJBJXKFSA-N 1 3 294.442 3.756 20 0 CHADHO Cc1cc(C)c(CN2CC[C@@]3(C2)CCC[N@@H+](C)C3)cc1C ZINC000556933522 1128648275 /nfs/dbraw/zinc/64/82/75/1128648275.db2.gz LHMZWHFSJPSJIO-IBGZPJMESA-N 1 3 286.463 3.530 20 0 CHADHO Cc1cc(C)c(CN2CC[C@@]3(C2)CCC[N@H+](C)C3)cc1C ZINC000556933522 1128648276 /nfs/dbraw/zinc/64/82/76/1128648276.db2.gz LHMZWHFSJPSJIO-IBGZPJMESA-N 1 3 286.463 3.530 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H]2C[C@H](C)c3ccccc32)C1 ZINC000574114190 1128661365 /nfs/dbraw/zinc/66/13/65/1128661365.db2.gz CGNWEACSLFOWJP-HDMKZQKVSA-N 1 3 272.436 3.556 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H]2C[C@H](C)c3ccccc32)C1 ZINC000574114190 1128661368 /nfs/dbraw/zinc/66/13/68/1128661368.db2.gz CGNWEACSLFOWJP-HDMKZQKVSA-N 1 3 272.436 3.556 20 0 CHADHO CCC(C)(C)[C@@H](C)[NH2+]CC1(N)C2CC3CC(C2)CC1C3 ZINC000578878135 1128731616 /nfs/dbraw/zinc/73/16/16/1128731616.db2.gz KXSOPOPUYGVGQN-XKMJEZSVSA-N 1 3 278.484 3.554 20 0 CHADHO CC(C)CC(CC(C)C)[NH2+][C@H]1CCNC2(CCC2)C1 ZINC000643546064 1117792004 /nfs/dbraw/zinc/79/20/04/1117792004.db2.gz HQBVVWXHFAZRIC-HNNXBMFYSA-N 1 3 266.473 3.712 20 0 CHADHO CCCN1C[C@@H]2C[NH+]([C@H](C)C[C@H](C)CC(C)C)C[C@H]2C1 ZINC001258073072 1128736261 /nfs/dbraw/zinc/73/62/61/1128736261.db2.gz BBBWHIHIRDVKPO-BRSBDYLESA-N 1 3 280.500 3.721 20 0 CHADHO C[C@H](Cc1ccc(Cl)cc1)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000623657761 1117885392 /nfs/dbraw/zinc/88/53/92/1117885392.db2.gz YGQHFTCKSTXLPU-ZBFHGGJFSA-N 1 3 294.870 3.593 20 0 CHADHO CCCN1C[C@@H]2C[N@@H+](CC[C@@H](C)CC(C)(C)C)C[C@@H]2C1 ZINC001208667090 1117906645 /nfs/dbraw/zinc/90/66/45/1117906645.db2.gz XLJKIWQPRSBJLZ-ZACQAIPSSA-N 1 3 280.500 3.722 20 0 CHADHO CCCN1C[C@@H]2C[N@H+](CC[C@@H](C)CC(C)(C)C)C[C@@H]2C1 ZINC001208667090 1117906649 /nfs/dbraw/zinc/90/66/49/1117906649.db2.gz XLJKIWQPRSBJLZ-ZACQAIPSSA-N 1 3 280.500 3.722 20 0 CHADHO CCC[N@H+]1C[C@H]2CN(CC[C@@H](C)CC(C)(C)C)C[C@H]2C1 ZINC001208667090 1117906652 /nfs/dbraw/zinc/90/66/52/1117906652.db2.gz XLJKIWQPRSBJLZ-ZACQAIPSSA-N 1 3 280.500 3.722 20 0 CHADHO CCC[N@@H+]1C[C@H]2CN(CC[C@@H](C)CC(C)(C)C)C[C@H]2C1 ZINC001208667090 1117906654 /nfs/dbraw/zinc/90/66/54/1117906654.db2.gz XLJKIWQPRSBJLZ-ZACQAIPSSA-N 1 3 280.500 3.722 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H]2CCc3cc(F)ccc32)C1 ZINC000125727642 1117963491 /nfs/dbraw/zinc/96/34/91/1117963491.db2.gz GYWNOWXZVBSEIZ-KBXCAEBGSA-N 1 3 290.426 3.523 20 0 CHADHO CC[C@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cc(C)ccc1C ZINC000623995611 1117966567 /nfs/dbraw/zinc/96/65/67/1117966567.db2.gz CHDBQHLOVBOBGA-PHSGOXPASA-N 1 3 286.463 3.969 20 0 CHADHO CC[C@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc(C)ccc1C ZINC000623995611 1117966570 /nfs/dbraw/zinc/96/65/70/1117966570.db2.gz CHDBQHLOVBOBGA-PHSGOXPASA-N 1 3 286.463 3.969 20 0 CHADHO CCCC[C@H](C)[C@@H](C)[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000579877964 1117979595 /nfs/dbraw/zinc/97/95/95/1117979595.db2.gz YMOACVAIBDUHCM-GVDBMIGSSA-N 1 3 268.489 3.911 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccc(Cl)s1 ZINC000624120111 1117985550 /nfs/dbraw/zinc/98/55/50/1117985550.db2.gz RLJGOPDYQWZVFV-RYUDHWBXSA-N 1 3 286.872 3.784 20 0 CHADHO Cc1ccc(CC[C@H](C)[NH2+]C[C@H]2CCCCN(C)C2)cc1 ZINC000624120856 1117985755 /nfs/dbraw/zinc/98/57/55/1117985755.db2.gz IMCATEHOGOLJDT-PKOBYXMFSA-N 1 3 288.479 3.638 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1cccc(F)c1 ZINC000624123741 1117986672 /nfs/dbraw/zinc/98/66/72/1117986672.db2.gz RVKLLIKBYSUEIZ-WMLDXEAASA-N 1 3 278.415 3.598 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@H]2CCCCC23CCCC3)C1 ZINC000380634504 1118002657 /nfs/dbraw/zinc/00/26/57/1118002657.db2.gz JBQICRLVNHJGFC-SJORKVTESA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)[C@H](NC[C@H]1CCC[N@H+](C)C1)c1ccc(F)c(F)c1 ZINC000182073336 1118012914 /nfs/dbraw/zinc/01/29/14/1118012914.db2.gz QUJXBOKCFNIFSO-DYVFJYSZSA-N 1 3 296.405 3.593 20 0 CHADHO CC(C)[C@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccc(F)c(F)c1 ZINC000182073336 1118012917 /nfs/dbraw/zinc/01/29/17/1118012917.db2.gz QUJXBOKCFNIFSO-DYVFJYSZSA-N 1 3 296.405 3.593 20 0 CHADHO CCc1ccc([C@@H](CC)[NH2+]C[C@H]2CCN(CC)C2)cc1 ZINC000037644303 1118033488 /nfs/dbraw/zinc/03/34/88/1118033488.db2.gz OPCSDHWVIFNUBL-SJLPKXTDSA-N 1 3 274.452 3.632 20 0 CHADHO CCc1ccc([C@@H](CC)NC[C@H]2CC[N@H+](CC)C2)cc1 ZINC000037644303 1118033492 /nfs/dbraw/zinc/03/34/92/1118033492.db2.gz OPCSDHWVIFNUBL-SJLPKXTDSA-N 1 3 274.452 3.632 20 0 CHADHO CCc1ccc([C@@H](CC)NC[C@H]2CC[N@@H+](CC)C2)cc1 ZINC000037644303 1118033496 /nfs/dbraw/zinc/03/34/96/1118033496.db2.gz OPCSDHWVIFNUBL-SJLPKXTDSA-N 1 3 274.452 3.632 20 0 CHADHO Cc1cccc2c1CC[C@@H]2[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000125752330 1118036917 /nfs/dbraw/zinc/03/69/17/1118036917.db2.gz LDRFNBYFVLPZLI-LPHOPBHVSA-N 1 3 286.463 3.692 20 0 CHADHO Cc1cc(C)cc([C@@H]2CCN(CCC[NH+]3CCCC3)C2)c1 ZINC000183472079 1118044931 /nfs/dbraw/zinc/04/49/31/1118044931.db2.gz GCOGXVIRBQINPG-GOSISDBHSA-N 1 3 286.463 3.579 20 0 CHADHO Cc1cc(C)cc([C@@H]2CC[N@H+](CCCN3CCCC3)C2)c1 ZINC000183472079 1118044935 /nfs/dbraw/zinc/04/49/35/1118044935.db2.gz GCOGXVIRBQINPG-GOSISDBHSA-N 1 3 286.463 3.579 20 0 CHADHO Cc1cc(C)cc([C@@H]2CC[N@@H+](CCCN3CCCC3)C2)c1 ZINC000183472079 1118044939 /nfs/dbraw/zinc/04/49/39/1118044939.db2.gz GCOGXVIRBQINPG-GOSISDBHSA-N 1 3 286.463 3.579 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H](C)CCC(C)(C)C)C1 ZINC000579620818 1128752900 /nfs/dbraw/zinc/75/29/00/1128752900.db2.gz CXMCFARMQMXPBY-JKSUJKDBSA-N 1 3 268.489 3.911 20 0 CHADHO CCC[C@@H](NCc1ccc(C[NH+](C)C)cc1)c1cccnc1 ZINC000184895292 1118057753 /nfs/dbraw/zinc/05/77/53/1118057753.db2.gz NZRJWFOANGOQLO-LJQANCHMSA-N 1 3 297.446 3.774 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H](C)CCC(C)(C)C)C1 ZINC000579620815 1128753471 /nfs/dbraw/zinc/75/34/71/1128753471.db2.gz CXMCFARMQMXPBY-CVEARBPZSA-N 1 3 268.489 3.911 20 0 CHADHO Cc1ccc2c(c1)CC[C@@H]2NC1CC[NH+](C2CCC2)CC1 ZINC000765429401 1118152012 /nfs/dbraw/zinc/15/20/12/1118152012.db2.gz VHNQTWHQLCMOAY-IBGZPJMESA-N 1 3 284.447 3.589 20 0 CHADHO C[C@H]1CC[C@H]([NH2+]C2CCN(CC3CCCC3)CC2)CS1 ZINC000655703781 1118188197 /nfs/dbraw/zinc/18/81/97/1118188197.db2.gz LHEFFEBVXPIUGU-YOEHRIQHSA-N 1 3 296.524 3.515 20 0 CHADHO CC[C@H](C)[C@H]1CCCC[N@@H+]1CCCN(CC)CC ZINC001652547109 1118272114 /nfs/dbraw/zinc/27/21/14/1118272114.db2.gz WYCFHWVVRXZAKR-JKSUJKDBSA-N 1 3 254.462 3.619 20 0 CHADHO CC[C@H](C)[C@H]1CCCC[N@H+]1CCCN(CC)CC ZINC001652547109 1118272118 /nfs/dbraw/zinc/27/21/18/1118272118.db2.gz WYCFHWVVRXZAKR-JKSUJKDBSA-N 1 3 254.462 3.619 20 0 CHADHO CCCCCC[C@H](C)[NH2+][C@H]1CCC[C@@H](N(C)C)C1 ZINC000715508928 1118308024 /nfs/dbraw/zinc/30/80/24/1118308024.db2.gz LTKUUMCWXPKYHH-HRCADAONSA-N 1 3 254.462 3.808 20 0 CHADHO C[C@H]([NH2+][C@H](CN)C1CC1)c1cc2c(ccc3ccccc23)o1 ZINC000580301817 1118415260 /nfs/dbraw/zinc/41/52/60/1118415260.db2.gz NGHWEBONKDLTKB-YVEFUNNKSA-N 1 3 294.398 3.974 20 0 CHADHO CCc1ccc([C@@H](N[C@@H]2CCC[NH2+]CC2)C(C)C)cc1 ZINC000261596731 1118478950 /nfs/dbraw/zinc/47/89/50/1118478950.db2.gz PJZDLDIAAPQJPL-MSOLQXFVSA-N 1 3 274.452 3.678 20 0 CHADHO Cc1ccccc1-c1cccc(CN2CC[C@H]([NH3+])C[C@H]2C)c1 ZINC000580841129 1118513403 /nfs/dbraw/zinc/51/34/03/1118513403.db2.gz IGZNFPCKQNYEMK-APWZRJJASA-N 1 3 294.442 3.974 20 0 CHADHO CC[C@H]([NH2+]CC[C@H]1CCCN1C)c1cccc(Cl)c1 ZINC000341106575 1118602896 /nfs/dbraw/zinc/60/28/96/1118602896.db2.gz QUUPOAOXWFRTAI-CVEARBPZSA-N 1 3 280.843 3.865 20 0 CHADHO C[C@@H](N[C@H](C)C1CC[NH+](C)CC1)c1c(F)cccc1Cl ZINC000090180459 1118623247 /nfs/dbraw/zinc/62/32/47/1118623247.db2.gz JEVFBZXAFWFQSY-VXGBXAGGSA-N 1 3 298.833 3.860 20 0 CHADHO Clc1cscc1CN1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000656784139 1118657420 /nfs/dbraw/zinc/65/74/20/1118657420.db2.gz YXAWUQGLPOXSOA-ZDUSSCGKSA-N 1 3 298.883 3.613 20 0 CHADHO C[C@@H]1C[C@@H](C[NH3+])CN1Cc1cccc(C2CCCC2)c1 ZINC000656786772 1118659130 /nfs/dbraw/zinc/65/91/30/1118659130.db2.gz QHHCQELRTRFOSH-ZBFHGGJFSA-N 1 3 272.436 3.513 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCC[C@H]1CCCF)CN1CCCCC1 ZINC000510724396 1118796923 /nfs/dbraw/zinc/79/69/23/1118796923.db2.gz XNLLVCPHGPFBNF-IKGGRYGDSA-N 1 3 284.463 3.616 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]C[C@@H]2CCC[C@@H](C)C2)C1 ZINC000092565122 1118856331 /nfs/dbraw/zinc/85/63/31/1118856331.db2.gz DLFCCGNRGGPMMF-ZACQAIPSSA-N 1 3 266.473 3.523 20 0 CHADHO CCN1CCC[C@@H](C[NH2+]Cc2cc3c(ccc(C)c3C)[nH]2)C1 ZINC000472034543 1118942389 /nfs/dbraw/zinc/94/23/89/1118942389.db2.gz FOLGJPWNVGBWKP-INIZCTEOSA-N 1 3 299.462 3.606 20 0 CHADHO C[NH+]1CCC(NCc2cccc(C3CCCC3)c2)CC1 ZINC000657294245 1118962837 /nfs/dbraw/zinc/96/28/37/1118962837.db2.gz JPQLUTAGIJYFDG-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO CCN(C)C1CC[NH+](CC[C@@H]2CC=C(C)C2(C)C)CC1 ZINC001207277237 1119010184 /nfs/dbraw/zinc/01/01/84/1119010184.db2.gz RCVTZABNDXGQHW-INIZCTEOSA-N 1 3 278.484 3.785 20 0 CHADHO CCN(C)C[C@H]1CC[N@H+](CC[C@H]2C[C@H](C)C[C@H](C)C2)C1 ZINC001167575545 1119085629 /nfs/dbraw/zinc/08/56/29/1119085629.db2.gz CSHYGTYEQXZZPG-VSZNYVQBSA-N 1 3 280.500 3.722 20 0 CHADHO CCN(C)C[C@H]1CC[N@@H+](CC[C@H]2C[C@H](C)C[C@H](C)C2)C1 ZINC001167575545 1119085633 /nfs/dbraw/zinc/08/56/33/1119085633.db2.gz CSHYGTYEQXZZPG-VSZNYVQBSA-N 1 3 280.500 3.722 20 0 CHADHO CCC[C@H](NC1CC[NH+](CC)CC1)c1ccc(OC)cc1 ZINC000159267441 1119111463 /nfs/dbraw/zinc/11/14/63/1119111463.db2.gz NKQBGJUUIJTTGL-SFHVURJKSA-N 1 3 290.451 3.610 20 0 CHADHO C([NH2+][C@H]1CCCC[C@@H]1C1CC1)[C@H]1CCCN(CC2CC2)C1 ZINC000663465109 1119145760 /nfs/dbraw/zinc/14/57/60/1119145760.db2.gz IBISMPHMZSYELW-QRQLOZEOSA-N 1 3 290.495 3.667 20 0 CHADHO CC[C@@H](C)CC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000657586130 1119198962 /nfs/dbraw/zinc/19/89/62/1119198962.db2.gz HZWMQNQAOWKQAF-OAHLLOKOSA-N 1 3 266.473 3.809 20 0 CHADHO Cc1ccc([C@H](C)C[NH2+]C[C@H]2CCCN(C(C)C)C2)cc1 ZINC000628213896 1128829458 /nfs/dbraw/zinc/82/94/58/1128829458.db2.gz CKKCBVHHZZEKGB-QZTJIDSGSA-N 1 3 288.479 3.809 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H](N(C)C)C2)c2ccccc21 ZINC000343593404 1119464712 /nfs/dbraw/zinc/46/47/12/1119464712.db2.gz AWVWCPSNVSOOTD-ADAWSYLGSA-N 1 3 272.436 3.697 20 0 CHADHO c1ccc([C@@H]2C[C@H]2C[N@@H+]2CC[C@H](CN3CCCCC3)C2)cc1 ZINC000093683619 1119571839 /nfs/dbraw/zinc/57/18/39/1119571839.db2.gz SQTRIKJGZDPUTP-HOJAQTOUSA-N 1 3 298.474 3.598 20 0 CHADHO c1ccc([C@@H]2C[C@H]2C[N@H+]2CC[C@H](CN3CCCCC3)C2)cc1 ZINC000093683619 1119571842 /nfs/dbraw/zinc/57/18/42/1119571842.db2.gz SQTRIKJGZDPUTP-HOJAQTOUSA-N 1 3 298.474 3.598 20 0 CHADHO c1ccc([C@@H]2C[C@H]2CN2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC000093683619 1119571845 /nfs/dbraw/zinc/57/18/45/1119571845.db2.gz SQTRIKJGZDPUTP-HOJAQTOUSA-N 1 3 298.474 3.598 20 0 CHADHO C[C@@]1(C[NH2+]C2CCN(CC3CCCC3)CC2)CCCS1 ZINC000628209977 1119615960 /nfs/dbraw/zinc/61/59/60/1119615960.db2.gz BSPYCMPBNKEPIH-KRWDZBQOSA-N 1 3 296.524 3.516 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2C[C@H](C)CC(C)(C)C2)C1 ZINC000708768907 1119809053 /nfs/dbraw/zinc/80/90/53/1119809053.db2.gz YNFSTVGYGWQPQL-ARFHVFGLSA-N 1 3 266.473 3.523 20 0 CHADHO CCC[C@H](C[N@@H+]1CC[C@H](N)[C@@H](CC)C1)c1ccccc1 ZINC000647498629 1119850051 /nfs/dbraw/zinc/85/00/51/1119850051.db2.gz LLTMKCQQJQROBK-JQHSSLGASA-N 1 3 274.452 3.630 20 0 CHADHO CCC[C@H](C[N@H+]1CC[C@H](N)[C@@H](CC)C1)c1ccccc1 ZINC000647498629 1119850055 /nfs/dbraw/zinc/85/00/55/1119850055.db2.gz LLTMKCQQJQROBK-JQHSSLGASA-N 1 3 274.452 3.630 20 0 CHADHO CC1=C[C@H](C)C[C@H](CN2CCC[C@H]([NH+]3CCCC3)C2)C1 ZINC000685834265 1119853609 /nfs/dbraw/zinc/85/36/09/1119853609.db2.gz BLLABQWKIFXTGD-SZMVWBNQSA-N 1 3 276.468 3.539 20 0 CHADHO Clc1ccsc1CN1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647543549 1120004500 /nfs/dbraw/zinc/00/45/00/1120004500.db2.gz PESWSYCDRSRJNB-CHWSQXEVSA-N 1 3 298.883 3.613 20 0 CHADHO Cc1ccc(C)c([C@@H](C)NC[C@@H]2CCCC[N@H+](C)C2)c1 ZINC000624119461 1120052042 /nfs/dbraw/zinc/05/20/42/1120052042.db2.gz BMESHBQENRNSDY-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc(C)c([C@@H](C)NC[C@@H]2CCCC[N@@H+](C)C2)c1 ZINC000624119461 1120052043 /nfs/dbraw/zinc/05/20/43/1120052043.db2.gz BMESHBQENRNSDY-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc(C)c([C@@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)c1 ZINC000624119461 1120052049 /nfs/dbraw/zinc/05/20/49/1120052049.db2.gz BMESHBQENRNSDY-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO CCC[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccsc1 ZINC000624123682 1120120402 /nfs/dbraw/zinc/12/04/02/1120120402.db2.gz QHQKMALCDAODSC-HOCLYGCPSA-N 1 3 280.481 3.911 20 0 CHADHO CC(C)(C)N1CCC([NH2+]Cc2cccc3cnccc32)CC1 ZINC000236644487 1120141245 /nfs/dbraw/zinc/14/12/45/1120141245.db2.gz JSOWQEOEKNULSO-UHFFFAOYSA-N 1 3 297.446 3.587 20 0 CHADHO C[NH+](C)Cc1ccc(CN[C@H]2CCc3ccc(F)cc32)cc1 ZINC000106478226 1120267576 /nfs/dbraw/zinc/26/75/76/1120267576.db2.gz CDRAJQKLJAWRNJ-IBGZPJMESA-N 1 3 298.405 3.664 20 0 CHADHO CCCN(Cc1ccc(Cl)c(C)c1C)C[C@@H]1CC[NH2+]C1 ZINC001236842297 1128904960 /nfs/dbraw/zinc/90/49/60/1128904960.db2.gz DOOSYHGGWFARNY-OAHLLOKOSA-N 1 3 294.870 3.778 20 0 CHADHO CC(C)[C@@H]1C[C@H](N[C@@H]2CCC[NH2+]CC2)c2ccccc21 ZINC000629532336 1128913889 /nfs/dbraw/zinc/91/38/89/1128913889.db2.gz VYROMWUHMBVLGO-JLSDUUJJSA-N 1 3 272.436 3.603 20 0 CHADHO c1ccc(C2CC([NH2+][C@@H]3CCNC[C@@H]3C3CCCC3)C2)cc1 ZINC000925604109 1120445017 /nfs/dbraw/zinc/44/50/17/1120445017.db2.gz HOCFQPMSIDEAIE-NTFDOXNWSA-N 1 3 298.474 3.691 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@H]1CCCC(C)(C)CC1 ZINC000226331371 1120552028 /nfs/dbraw/zinc/55/20/28/1120552028.db2.gz OSHYQKXHZFCEJG-HNNXBMFYSA-N 1 3 254.462 3.665 20 0 CHADHO CC[C@H](CN[C@H](c1ccccc1)[C@@H](C)[NH3+])CC(F)(F)F ZINC000925697424 1120622385 /nfs/dbraw/zinc/62/23/85/1120622385.db2.gz NLOWJSCFNRWVCD-DYEKYZERSA-N 1 3 288.357 3.643 20 0 CHADHO C[C@H]1C[C@@H](NCc2ccc(F)c3ccccc23)CC[N@@H+]1C ZINC000631079576 1120632667 /nfs/dbraw/zinc/63/26/67/1120632667.db2.gz IJFZTIUDRHUQQT-ZFWWWQNUSA-N 1 3 286.394 3.551 20 0 CHADHO C[C@H]1C[C@@H](NCc2ccc(F)c3ccccc23)CC[N@H+]1C ZINC000631079576 1120632668 /nfs/dbraw/zinc/63/26/68/1120632668.db2.gz IJFZTIUDRHUQQT-ZFWWWQNUSA-N 1 3 286.394 3.551 20 0 CHADHO C1CCC2(C1)CCC([N@@H+]1CCC[C@@]3(CCCNC3)C1)CC2 ZINC000228078609 1120689081 /nfs/dbraw/zinc/68/90/81/1120689081.db2.gz AUSMHIDWCUQEDQ-LJQANCHMSA-N 1 3 290.495 3.955 20 0 CHADHO C1CCC2(C1)CCC([N@H+]1CCC[C@@]3(CCCNC3)C1)CC2 ZINC000228078609 1120689082 /nfs/dbraw/zinc/68/90/82/1120689082.db2.gz AUSMHIDWCUQEDQ-LJQANCHMSA-N 1 3 290.495 3.955 20 0 CHADHO Cc1cc2c(cc1C)[C@@H](NCCC(C)(C)[NH3+])CCS2 ZINC000925737222 1120848626 /nfs/dbraw/zinc/84/86/26/1120848626.db2.gz HQTYNGVYAHLWKE-AWEZNQCLSA-N 1 3 278.465 3.557 20 0 CHADHO CC1=C[C@@H](C)C[N@@H+]([C@@H](C)CCN2CC(C)=C[C@H](C)C2)C1 ZINC000430264916 1120853364 /nfs/dbraw/zinc/85/33/64/1120853364.db2.gz CDQPZDHTPDYCRJ-LESCRADOSA-N 1 3 276.468 3.561 20 0 CHADHO CC1=C[C@@H](C)C[N@H+]([C@@H](C)CCN2CC(C)=C[C@H](C)C2)C1 ZINC000430264916 1120853365 /nfs/dbraw/zinc/85/33/65/1120853365.db2.gz CDQPZDHTPDYCRJ-LESCRADOSA-N 1 3 276.468 3.561 20 0 CHADHO CC1=C[C@@H](C)CN([C@@H](C)CC[N@H+]2CC(C)=C[C@H](C)C2)C1 ZINC000430264916 1120853366 /nfs/dbraw/zinc/85/33/66/1120853366.db2.gz CDQPZDHTPDYCRJ-LESCRADOSA-N 1 3 276.468 3.561 20 0 CHADHO CC1=C[C@@H](C)CN([C@@H](C)CC[N@@H+]2CC(C)=C[C@H](C)C2)C1 ZINC000430264916 1120853368 /nfs/dbraw/zinc/85/33/68/1120853368.db2.gz CDQPZDHTPDYCRJ-LESCRADOSA-N 1 3 276.468 3.561 20 0 CHADHO C[C@H](Cc1ccsc1)N[C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000251423383 1120883008 /nfs/dbraw/zinc/88/30/08/1120883008.db2.gz HMISIGYAFMMJFU-IJEWVQPXSA-N 1 3 280.481 3.580 20 0 CHADHO C[C@H](N)[C@H]1CCC[N@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000662245805 1120910599 /nfs/dbraw/zinc/91/05/99/1120910599.db2.gz OZDIRMUXZNMJSC-ISARSNTHSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@H](N)[C@H]1CCC[N@@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000662245805 1120910603 /nfs/dbraw/zinc/91/06/03/1120910603.db2.gz OZDIRMUXZNMJSC-ISARSNTHSA-N 1 3 286.463 3.630 20 0 CHADHO CC1(C)C[C@]1(CN[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000663368032 1120948344 /nfs/dbraw/zinc/94/83/44/1120948344.db2.gz MSYGIGYMSCAWCH-HBFSDRIKSA-N 1 3 298.474 3.571 20 0 CHADHO CC1(C)C[C@]1(CN[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000663368032 1120948347 /nfs/dbraw/zinc/94/83/47/1120948347.db2.gz MSYGIGYMSCAWCH-HBFSDRIKSA-N 1 3 298.474 3.571 20 0 CHADHO CCCC[C@@H](CC)[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663467502 1120981544 /nfs/dbraw/zinc/98/15/44/1120981544.db2.gz GJJUJNFHQLQIPO-IAGOWNOFSA-N 1 3 266.473 3.667 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N1CCc2cc(F)ccc2C1 ZINC001167840401 1121049997 /nfs/dbraw/zinc/04/99/97/1121049997.db2.gz GCRSIAPEDSANLF-OAHLLOKOSA-N 1 3 292.442 3.694 20 0 CHADHO Cc1cc(C)c(CN(C)[C@H]2CC[N@H+](C)[C@H](C)C2)cc1C ZINC000093643621 1128965947 /nfs/dbraw/zinc/96/59/47/1128965947.db2.gz NKUYYGHEQJMJIO-AEFFLSMTSA-N 1 3 274.452 3.526 20 0 CHADHO Cc1cc(C)c(CN(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1C ZINC000093643621 1128965949 /nfs/dbraw/zinc/96/59/49/1128965949.db2.gz NKUYYGHEQJMJIO-AEFFLSMTSA-N 1 3 274.452 3.526 20 0 CHADHO CN(CC[C@@H]1CCCC[N@@H+]1C)[C@@H]1CCCc2ccccc21 ZINC000674771517 1121179313 /nfs/dbraw/zinc/17/93/13/1121179313.db2.gz OBVJDOMEUXUQBK-PKOBYXMFSA-N 1 3 286.463 3.870 20 0 CHADHO CN(CC[C@@H]1CCCC[N@H+]1C)[C@@H]1CCCc2ccccc21 ZINC000674771517 1121179314 /nfs/dbraw/zinc/17/93/14/1121179314.db2.gz OBVJDOMEUXUQBK-PKOBYXMFSA-N 1 3 286.463 3.870 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)N1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000063197556 1121201730 /nfs/dbraw/zinc/20/17/30/1121201730.db2.gz GHMVCXRETYAAIH-DYVFJYSZSA-N 1 3 292.854 3.865 20 0 CHADHO CC[NH+](CC)Cc1ccccc1CNCc1ccc(O)cc1 ZINC000236912228 1121293358 /nfs/dbraw/zinc/29/33/58/1121293358.db2.gz OJPSUCHUBMVUQV-UHFFFAOYSA-N 1 3 298.430 3.524 20 0 CHADHO CC(C)CCCC[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000703992505 1121324715 /nfs/dbraw/zinc/32/47/15/1121324715.db2.gz AUGBKVKKMCXJBM-UHFFFAOYSA-N 1 3 254.462 3.665 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H](C)[C@H](C)c1ccccc1 ZINC000675724894 1121348363 /nfs/dbraw/zinc/34/83/63/1121348363.db2.gz PDPABNOMOQPHOV-HOTGVXAUSA-N 1 3 262.441 3.500 20 0 CHADHO CCC[C@@H](C[N@@H+]1CCC[C@@H](N(C)C)CC1)c1ccccc1 ZINC000432796718 1121358567 /nfs/dbraw/zinc/35/85/67/1121358567.db2.gz IMYPQQCDXKRZSV-RBUKOAKNSA-N 1 3 288.479 3.986 20 0 CHADHO CCC[C@@H](C[N@H+]1CCC[C@@H](N(C)C)CC1)c1ccccc1 ZINC000432796718 1121358576 /nfs/dbraw/zinc/35/85/76/1121358576.db2.gz IMYPQQCDXKRZSV-RBUKOAKNSA-N 1 3 288.479 3.986 20 0 CHADHO CC[NH+]1CCC(N[C@@H]2CCCc3c(Cl)cccc32)CC1 ZINC000543600411 1121509633 /nfs/dbraw/zinc/50/96/33/1121509633.db2.gz FPHZZIPTUZSXRM-QGZVFWFLSA-N 1 3 292.854 3.791 20 0 CHADHO CC[N@@H+]1CC[C@H](CNC/C(C)=C\c2ccc(Cl)cc2)C1 ZINC000513030689 1121665334 /nfs/dbraw/zinc/66/53/34/1121665334.db2.gz IFXJXDXWNBLWOA-SCOADAFUSA-N 1 3 292.854 3.675 20 0 CHADHO CC[N@H+]1CC[C@H](CNC/C(C)=C\c2ccc(Cl)cc2)C1 ZINC000513030689 1121665337 /nfs/dbraw/zinc/66/53/37/1121665337.db2.gz IFXJXDXWNBLWOA-SCOADAFUSA-N 1 3 292.854 3.675 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N[C@H](C)c1nc(C)sc1C ZINC000020089039 1121690917 /nfs/dbraw/zinc/69/09/17/1121690917.db2.gz WFNXXNMFJGEFFG-CHWSQXEVSA-N 1 3 297.512 3.921 20 0 CHADHO Cc1ccccc1[C@H](N[C@H]1CC[N@@H+]2CCC[C@@H]2C1)C(C)C ZINC000166584774 1121748307 /nfs/dbraw/zinc/74/83/07/1121748307.db2.gz UBCVYNHCWBTWGB-YQVWRLOYSA-N 1 3 286.463 3.909 20 0 CHADHO Cc1ccccc1[C@H](N[C@H]1CC[N@H+]2CCC[C@@H]2C1)C(C)C ZINC000166584774 1121748313 /nfs/dbraw/zinc/74/83/13/1121748313.db2.gz UBCVYNHCWBTWGB-YQVWRLOYSA-N 1 3 286.463 3.909 20 0 CHADHO Cc1cc(C)c(/C=C/CNC[C@@H]2CCC[N@@H+](C)C2)c(C)c1 ZINC001177795142 1121750674 /nfs/dbraw/zinc/75/06/74/1121750674.db2.gz OJEMHLGXXCDQPU-MOTZXUDYSA-N 1 3 286.463 3.556 20 0 CHADHO Cc1cc(C)c(/C=C/CNC[C@@H]2CCC[N@H+](C)C2)c(C)c1 ZINC001177795142 1121750679 /nfs/dbraw/zinc/75/06/79/1121750679.db2.gz OJEMHLGXXCDQPU-MOTZXUDYSA-N 1 3 286.463 3.556 20 0 CHADHO CC(C)Cc1ccc(C[N@@H+]2CCCC[C@@](F)(CN)C2)cc1 ZINC001206363573 1121848363 /nfs/dbraw/zinc/84/83/63/1121848363.db2.gz YBKYQYZRWGAIGI-GOSISDBHSA-N 1 3 292.442 3.538 20 0 CHADHO CC(C)Cc1ccc(C[N@H+]2CCCC[C@@](F)(CN)C2)cc1 ZINC001206363573 1121848375 /nfs/dbraw/zinc/84/83/75/1121848375.db2.gz YBKYQYZRWGAIGI-GOSISDBHSA-N 1 3 292.442 3.538 20 0 CHADHO CC(C)C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@@H]3CN(C)C[C@@H]23)C1 ZINC001179816787 1121912121 /nfs/dbraw/zinc/91/21/21/1121912121.db2.gz NTFCEMJDPIULLY-IGKNDFSCSA-N 1 3 278.484 3.521 20 0 CHADHO CC[NH+]1CCC(N(C)[C@H](C)c2nccc3ccccc32)CC1 ZINC001180531029 1121994303 /nfs/dbraw/zinc/99/43/03/1121994303.db2.gz BLQHHHFQGNGNOV-OAHLLOKOSA-N 1 3 297.446 3.712 20 0 CHADHO c1ccc2c(c1)CN(CC[C@@H]1CC[NH2+]C1)Cc1ccccc1-2 ZINC000420314134 1122000607 /nfs/dbraw/zinc/00/06/07/1122000607.db2.gz YUXKBMQBEJBSTC-INIZCTEOSA-N 1 3 292.426 3.669 20 0 CHADHO CCCc1ccc([C@H](NC[C@@H]2CC[NH2+]C2)C(C)C)cc1 ZINC000420376580 1122002877 /nfs/dbraw/zinc/00/28/77/1122002877.db2.gz QUJUBBUEFBZLIC-SJLPKXTDSA-N 1 3 274.452 3.535 20 0 CHADHO Clc1ccc([C@H](NC[C@H]2CCC[NH2+]C2)C2CCC2)cc1 ZINC000420399052 1122004135 /nfs/dbraw/zinc/00/41/35/1122004135.db2.gz HMPSPKYYSRYSBV-SUMWQHHRSA-N 1 3 292.854 3.770 20 0 CHADHO C[C@H](N)C[NH2+][C@@H](c1cccc(Cl)c1)C1CCCC1 ZINC000420422764 1122006092 /nfs/dbraw/zinc/00/60/92/1122006092.db2.gz ZNVXOJFWPPEIIX-XHDPSFHLSA-N 1 3 266.816 3.508 20 0 CHADHO C[C@@H](Cc1ccc(F)cc1)[NH2+]CC[C@H](C)N1CCCCC1 ZINC001180809127 1122017632 /nfs/dbraw/zinc/01/76/32/1122017632.db2.gz ARZAVLJDNFDUOO-HOTGVXAUSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@H](C[N@H+](C)CCCN1CCCC1)c1cccc(Cl)c1 ZINC001181234590 1122044502 /nfs/dbraw/zinc/04/45/02/1122044502.db2.gz MLPGBHYNZFNGOW-OAHLLOKOSA-N 1 3 294.870 3.861 20 0 CHADHO C[C@H](C[N@@H+](C)CCCN1CCCC1)c1cccc(Cl)c1 ZINC001181234590 1122044509 /nfs/dbraw/zinc/04/45/09/1122044509.db2.gz MLPGBHYNZFNGOW-OAHLLOKOSA-N 1 3 294.870 3.861 20 0 CHADHO CC1=C(C)C[C@H]([C@@H](C)[NH2+]C[C@H]2CCCCN(C)C2)CC1 ZINC001182908909 1122196210 /nfs/dbraw/zinc/19/62/10/1122196210.db2.gz DDVMSIVLEXGTAE-KZNAEPCWSA-N 1 3 278.484 3.833 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@H](C)[C@@H]1CC2CCC1CC2 ZINC001184419353 1122275865 /nfs/dbraw/zinc/27/58/65/1122275865.db2.gz ZUMOFLXZDQXTGS-QNVOQPSNSA-N 1 3 280.500 3.911 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+]C[C@@H]1C(C)=CCC[C@H]1C ZINC001184418061 1122276148 /nfs/dbraw/zinc/27/61/48/1122276148.db2.gz KJIUUZUBFWHYAA-IXDOHACOSA-N 1 3 266.473 3.689 20 0 CHADHO Cc1ccccc1CCNC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167958700 1122459525 /nfs/dbraw/zinc/45/95/25/1122459525.db2.gz ILWRDGCYCGRIGR-IHWFROFDSA-N 1 3 298.474 3.533 20 0 CHADHO Cc1ccccc1CCNC1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167958700 1122459527 /nfs/dbraw/zinc/45/95/27/1122459527.db2.gz ILWRDGCYCGRIGR-IHWFROFDSA-N 1 3 298.474 3.533 20 0 CHADHO C(C1CC1)N1[C@@H]2CC[C@H]1CC([NH2+]C1CCCCCC1)C2 ZINC001167959014 1122465922 /nfs/dbraw/zinc/46/59/22/1122465922.db2.gz MVVNDDDKXNTCME-AYHJJNSGSA-N 1 3 276.468 3.704 20 0 CHADHO CC[NH+](CC)CC1CCN(Cc2ccccc2Cl)CC1 ZINC000515138381 1122479318 /nfs/dbraw/zinc/47/93/18/1122479318.db2.gz WGVXOOJPINSGLT-UHFFFAOYSA-N 1 3 294.870 3.894 20 0 CHADHO CCN(CC)CCC[N@H+](CC(C)C)C1CCCC1 ZINC001190572230 1122544713 /nfs/dbraw/zinc/54/47/13/1122544713.db2.gz SODIEBRRXVXCIT-UHFFFAOYSA-N 1 3 254.462 3.619 20 0 CHADHO CCN(CC)CCC[N@@H+](CC(C)C)C1CCCC1 ZINC001190572230 1122544719 /nfs/dbraw/zinc/54/47/19/1122544719.db2.gz SODIEBRRXVXCIT-UHFFFAOYSA-N 1 3 254.462 3.619 20 0 CHADHO C[C@@H]1C[C@H]2CCCC[C@@H]2N1CC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001191076085 1122569721 /nfs/dbraw/zinc/56/97/21/1122569721.db2.gz GASNIWNITICOHT-ILOCAZANSA-N 1 3 278.484 3.617 20 0 CHADHO C[C@@H]1C[C@H]2CCCC[C@@H]2N1CC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001191076085 1122569724 /nfs/dbraw/zinc/56/97/24/1122569724.db2.gz GASNIWNITICOHT-ILOCAZANSA-N 1 3 278.484 3.617 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]C2CCN([C@@H]3CCC[C@@H](C)C3)CC2)C1 ZINC000437052945 1122606792 /nfs/dbraw/zinc/60/67/92/1122606792.db2.gz XOVWBXXTRPZMHB-XYVMCAHJSA-N 1 3 278.484 3.808 20 0 CHADHO CC(C)[C@H](CC(F)(F)F)[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000437082146 1122610194 /nfs/dbraw/zinc/61/01/94/1122610194.db2.gz AYAXPIHPWPTDAQ-ZDUSSCGKSA-N 1 3 294.405 3.816 20 0 CHADHO CC(C)[C@H](CC(F)(F)F)NC1CC[NH+](C(C)(C)C)CC1 ZINC000437082146 1122610196 /nfs/dbraw/zinc/61/01/96/1122610196.db2.gz AYAXPIHPWPTDAQ-ZDUSSCGKSA-N 1 3 294.405 3.816 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H](Cc1ccc(F)cc1)C(C)C ZINC001192848811 1122660329 /nfs/dbraw/zinc/66/03/29/1122660329.db2.gz QAXAWVOMXWXWNA-SFHVURJKSA-N 1 3 294.458 3.714 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](C)c2cc3ccc(C)cc3o2)C1 ZINC000425924534 1122662024 /nfs/dbraw/zinc/66/20/24/1122662024.db2.gz MVCVXCHDMAEVJH-CABCVRRESA-N 1 3 286.419 3.734 20 0 CHADHO CCCCOc1ccc([C@H](C)[NH2+]C[C@@H](C)CN(C)C)cc1 ZINC000425933763 1122663202 /nfs/dbraw/zinc/66/32/02/1122663202.db2.gz WRAGBAJVHMGVSA-CVEARBPZSA-N 1 3 292.467 3.714 20 0 CHADHO CC[C@H]([NH2+]C[C@H](C)CN(C)C)c1ccc(Cl)s1 ZINC000425938376 1122667841 /nfs/dbraw/zinc/66/78/41/1122667841.db2.gz PYWDOULRIKUIFB-QWRGUYRKSA-N 1 3 274.861 3.640 20 0 CHADHO CC(C)[C@@H]([NH2+]C[C@@H](C)CN(C)C)c1cc2ccccc2o1 ZINC000425943774 1122673842 /nfs/dbraw/zinc/67/38/42/1122673842.db2.gz SUUNFYFOAYRTHK-RDTXWAMCSA-N 1 3 288.435 3.917 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+]C[C@H](C)CN(C)C ZINC000425947147 1122675397 /nfs/dbraw/zinc/67/53/97/1122675397.db2.gz RMCQLXZFXYMJAV-FUHWJXTLSA-N 1 3 276.468 3.575 20 0 CHADHO Cc1c(F)ccc(CN2CC[C@@H](C)[C@H](C[NH3+])CC2)c1Cl ZINC001205651584 1122742781 /nfs/dbraw/zinc/74/27/81/1122742781.db2.gz HCORUECXSGVPEV-YPMHNXCESA-N 1 3 298.833 3.594 20 0 CHADHO Cc1c(F)ccc(CN2CC[C@@H](C)[C@@H](C[NH3+])CC2)c1Cl ZINC001205651582 1122742938 /nfs/dbraw/zinc/74/29/38/1122742938.db2.gz HCORUECXSGVPEV-DGCLKSJQSA-N 1 3 298.833 3.594 20 0 CHADHO CCCCC[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167965359 1122811078 /nfs/dbraw/zinc/81/10/78/1122811078.db2.gz CBDDLQITTKSTPD-CCNLRDMRSA-N 1 3 278.484 3.950 20 0 CHADHO CC(C)(CC1CCC1)[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167975024 1122875078 /nfs/dbraw/zinc/87/50/78/1122875078.db2.gz FNHJABZDWJJEDS-AYHJJNSGSA-N 1 3 290.495 3.950 20 0 CHADHO C[C@@H]1CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001167985025 1122938733 /nfs/dbraw/zinc/93/87/33/1122938733.db2.gz SHRFWZKYOXRLTK-NAZJXLNTSA-N 1 3 276.468 3.514 20 0 CHADHO C[C@@H]1CCC[N@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001167985025 1122938735 /nfs/dbraw/zinc/93/87/35/1122938735.db2.gz SHRFWZKYOXRLTK-NAZJXLNTSA-N 1 3 276.468 3.514 20 0 CHADHO CC1CCN(CC[C@@H]2CCC[N@@H+]2[C@H]2C=CCCC2)CC1 ZINC001196936130 1122940328 /nfs/dbraw/zinc/94/03/28/1122940328.db2.gz PYTIUGZNYKESQD-ROUUACIJSA-N 1 3 276.468 3.682 20 0 CHADHO CC1CCN(CC[C@@H]2CCC[N@H+]2[C@H]2C=CCCC2)CC1 ZINC001196936130 1122940333 /nfs/dbraw/zinc/94/03/33/1122940333.db2.gz PYTIUGZNYKESQD-ROUUACIJSA-N 1 3 276.468 3.682 20 0 CHADHO CC1CC[NH+](CC[C@@H]2CCCN2[C@H]2C=CCCC2)CC1 ZINC001196936130 1122940335 /nfs/dbraw/zinc/94/03/35/1122940335.db2.gz PYTIUGZNYKESQD-ROUUACIJSA-N 1 3 276.468 3.682 20 0 CHADHO Clc1ccc(CNC2CCC([NH+]3CCCCC3)CC2)o1 ZINC000080373664 1129092642 /nfs/dbraw/zinc/09/26/42/1129092642.db2.gz ZDHSOTFBIBJMOW-UHFFFAOYSA-N 1 3 296.842 3.820 20 0 CHADHO CC1CC[NH+](CCCCNc2ccnc3ccccc32)CC1 ZINC000520324437 1123075472 /nfs/dbraw/zinc/07/54/72/1123075472.db2.gz WYPLQCCEWVFFSU-UHFFFAOYSA-N 1 3 297.446 3.581 20 0 CHADHO C[C@@H]1CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)[C@@H]1C ZINC001167995456 1123106716 /nfs/dbraw/zinc/10/67/16/1123106716.db2.gz GGICYWNGBWVFPM-SUQXETJPSA-N 1 3 276.468 3.512 20 0 CHADHO C[C@@H]1CCC[N@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)[C@@H]1C ZINC001167995456 1123106719 /nfs/dbraw/zinc/10/67/19/1123106719.db2.gz GGICYWNGBWVFPM-SUQXETJPSA-N 1 3 276.468 3.512 20 0 CHADHO C[C@@H]1CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)[C@H]1C ZINC001167995457 1123107109 /nfs/dbraw/zinc/10/71/09/1123107109.db2.gz GGICYWNGBWVFPM-ULHQQGCDSA-N 1 3 276.468 3.512 20 0 CHADHO C[C@@H]1CCC[N@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)[C@H]1C ZINC001167995457 1123107112 /nfs/dbraw/zinc/10/71/12/1123107112.db2.gz GGICYWNGBWVFPM-ULHQQGCDSA-N 1 3 276.468 3.512 20 0 CHADHO C[C@@H](CC[NH+](C)C)N[C@@H](C)c1cc2ccccc2s1 ZINC000157180651 1123111805 /nfs/dbraw/zinc/11/18/05/1123111805.db2.gz ZQFWSNKSSNKYRQ-STQMWFEESA-N 1 3 276.449 3.892 20 0 CHADHO CCC(CC)C[N@@H+]1CCCC[C@@H]1C[C@@H]1CCCN1C ZINC001201536326 1123115533 /nfs/dbraw/zinc/11/55/33/1123115533.db2.gz YHCAKYOHHDKTDN-DLBZAZTESA-N 1 3 266.473 3.761 20 0 CHADHO CCC(CC)C[N@H+]1CCCC[C@@H]1C[C@@H]1CCCN1C ZINC001201536326 1123115535 /nfs/dbraw/zinc/11/55/35/1123115535.db2.gz YHCAKYOHHDKTDN-DLBZAZTESA-N 1 3 266.473 3.761 20 0 CHADHO CC[C@H](C)C[N@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001201521627 1123121504 /nfs/dbraw/zinc/12/15/04/1123121504.db2.gz WNVNEOPSJLVIRH-HNNXBMFYSA-N 1 3 266.473 3.761 20 0 CHADHO CCC(CC)C[N@@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001201531769 1123122302 /nfs/dbraw/zinc/12/23/02/1123122302.db2.gz VLLSUCYLAJNXRI-KRWDZBQOSA-N 1 3 266.473 3.763 20 0 CHADHO CCCCCN1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001201737579 1123143305 /nfs/dbraw/zinc/14/33/05/1123143305.db2.gz VQEMYFSOEJKNEJ-OALUTQOASA-N 1 3 286.463 3.631 20 0 CHADHO CCCCCN1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001201737579 1123143306 /nfs/dbraw/zinc/14/33/06/1123143306.db2.gz VQEMYFSOEJKNEJ-OALUTQOASA-N 1 3 286.463 3.631 20 0 CHADHO Cc1sc2ccccc2c1C[N@@H+]1CCCC[C@@H](N)C1 ZINC001205933111 1123173597 /nfs/dbraw/zinc/17/35/97/1123173597.db2.gz YJBKCQKPUCFCEW-CYBMUJFWSA-N 1 3 274.433 3.523 20 0 CHADHO Cc1sc2ccccc2c1C[N@H+]1CCCC[C@@H](N)C1 ZINC001205933111 1123173601 /nfs/dbraw/zinc/17/36/01/1123173601.db2.gz YJBKCQKPUCFCEW-CYBMUJFWSA-N 1 3 274.433 3.523 20 0 CHADHO C[C@H]1CC[C@H]([N@H+](C)C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001168005215 1123196097 /nfs/dbraw/zinc/19/60/97/1123196097.db2.gz IAJVHBYYRRXCQE-JROWMXPESA-N 1 3 290.495 3.902 20 0 CHADHO C[C@H]1CC[C@H]([N@@H+](C)C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001168005215 1123196100 /nfs/dbraw/zinc/19/61/00/1123196100.db2.gz IAJVHBYYRRXCQE-JROWMXPESA-N 1 3 290.495 3.902 20 0 CHADHO C[C@@H]([NH2+]CC1(N)CCCC1)c1cc2ccccc2s1 ZINC000665247856 1123256869 /nfs/dbraw/zinc/25/68/69/1123256869.db2.gz KYERZRPBAXDIRE-GFCCVEGCSA-N 1 3 274.433 3.823 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+][C@@H]1CCC12CCCC2 ZINC000474031313 1123304149 /nfs/dbraw/zinc/30/41/49/1123304149.db2.gz IHHLPERERZQQID-HZPDHXFCSA-N 1 3 264.457 3.563 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@H]1CC[C@H](C)c2ccsc21 ZINC000665282501 1123316965 /nfs/dbraw/zinc/31/69/65/1123316965.db2.gz ZGMIYHLZATYXSK-YUTCNCBUSA-N 1 3 266.454 3.650 20 0 CHADHO CC(C)(CN[C@@H]1C[C@H]([NH3+])c2ccccc21)CC(F)(F)F ZINC000665301095 1123350347 /nfs/dbraw/zinc/35/03/47/1123350347.db2.gz OCSBKMGFILUBIP-QWHCGFSZSA-N 1 3 286.341 3.699 20 0 CHADHO F[C@@H]1CCC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000335383568 1123367077 /nfs/dbraw/zinc/36/70/77/1123367077.db2.gz AZVFNWDFPWNFGP-ZBFHGGJFSA-N 1 3 282.447 3.654 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](C[C@H]2C(C)=CCC[C@H]2C)C1 ZINC000443641379 1123456942 /nfs/dbraw/zinc/45/69/42/1123456942.db2.gz PHFTXZKWDVBWQH-SQNIBIBYSA-N 1 3 278.484 3.643 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](C[C@H]2C(C)=CCC[C@H]2C)C1 ZINC000443641379 1123456944 /nfs/dbraw/zinc/45/69/44/1123456944.db2.gz PHFTXZKWDVBWQH-SQNIBIBYSA-N 1 3 278.484 3.643 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1NCc1ccc2ccccc2c1 ZINC000157307364 1129126684 /nfs/dbraw/zinc/12/66/84/1129126684.db2.gz DDKLNRFRMRWSHR-CLCXKQKWSA-N 1 3 282.431 3.658 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1NCc1ccc2ccccc2c1 ZINC000157307364 1129126685 /nfs/dbraw/zinc/12/66/85/1129126685.db2.gz DDKLNRFRMRWSHR-CLCXKQKWSA-N 1 3 282.431 3.658 20 0 CHADHO Cc1ccc([C@H](C)N[C@H]2CC[N@H+](C)C(C)(C)C2)s1 ZINC000858106882 1123631867 /nfs/dbraw/zinc/63/18/67/1123631867.db2.gz CICXDQKOTPINGE-STQMWFEESA-N 1 3 266.454 3.580 20 0 CHADHO Cc1ccc([C@H](C)N[C@H]2CC[N@@H+](C)C(C)(C)C2)s1 ZINC000858106882 1123631870 /nfs/dbraw/zinc/63/18/70/1123631870.db2.gz CICXDQKOTPINGE-STQMWFEESA-N 1 3 266.454 3.580 20 0 CHADHO CC(C)[C@@H]([NH3+])CCN(C)Cc1cccc(-c2cccnc2)c1 ZINC000346692906 1123706820 /nfs/dbraw/zinc/70/68/20/1123706820.db2.gz JRRQVRLEUOPGQQ-IBGZPJMESA-N 1 3 297.446 3.554 20 0 CHADHO CN(C)[C@H]1CCC[N@H+](CCCc2ccc(Cl)cc2)CC1 ZINC000429547357 1123726616 /nfs/dbraw/zinc/72/66/16/1123726616.db2.gz LEOFQULWZKBZEI-KRWDZBQOSA-N 1 3 294.870 3.689 20 0 CHADHO CN(C)[C@H]1CCC[N@@H+](CCCc2ccc(Cl)cc2)CC1 ZINC000429547357 1123726617 /nfs/dbraw/zinc/72/66/17/1123726617.db2.gz LEOFQULWZKBZEI-KRWDZBQOSA-N 1 3 294.870 3.689 20 0 CHADHO C[NH+](C)[C@H]1CCCN(CCCc2ccc(Cl)cc2)CC1 ZINC000429547357 1123726619 /nfs/dbraw/zinc/72/66/19/1123726619.db2.gz LEOFQULWZKBZEI-KRWDZBQOSA-N 1 3 294.870 3.689 20 0 CHADHO CC[NH+]1CCC(N[C@@H](C)c2ccc3c(c2)CCCC3)CC1 ZINC000035011804 1124022813 /nfs/dbraw/zinc/02/28/13/1124022813.db2.gz PQUHCAYNXZCWBH-HNNXBMFYSA-N 1 3 286.463 3.700 20 0 CHADHO Cc1cc2c(c(C)c1)[C@H](NC1CC[NH+](C(C)C)CC1)CC2 ZINC000655724991 1124108512 /nfs/dbraw/zinc/10/85/12/1124108512.db2.gz KBYQIDQXGAWDIP-GOSISDBHSA-N 1 3 286.463 3.753 20 0 CHADHO CC1(C)C[NH2+]CC[C@H](N[C@@H](c2ccccc2)C2CC2)C1 ZINC000635008479 1129169996 /nfs/dbraw/zinc/16/99/96/1129169996.db2.gz DXDQOXZEZPXDSU-IRXDYDNUSA-N 1 3 272.436 3.506 20 0 CHADHO C[C@@H](C[NH2+]CC[C@@H](C)N1CCCCC1)c1ccc(F)cc1 ZINC000526116308 1124511165 /nfs/dbraw/zinc/51/11/65/1124511165.db2.gz VBOIHYLIIOKTHY-JKSUJKDBSA-N 1 3 292.442 3.783 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H](C)CC(C)(C)C)C1 ZINC000449129831 1124653305 /nfs/dbraw/zinc/65/33/05/1124653305.db2.gz DRVBQLVPOUGJNB-HUUCEWRRSA-N 1 3 254.462 3.521 20 0 CHADHO C[NH+]1CCC(N[C@H]2CC(C)(C)Sc3ccccc32)CC1 ZINC000872018113 1124657283 /nfs/dbraw/zinc/65/72/83/1124657283.db2.gz INUBFINFIYUDCU-HNNXBMFYSA-N 1 3 290.476 3.686 20 0 CHADHO CC/C=C/CNC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449463653 1124759395 /nfs/dbraw/zinc/75/93/95/1124759395.db2.gz XDZZGIBDOGJRFA-AUNFYEFLSA-N 1 3 286.463 3.638 20 0 CHADHO C[C@H](CSc1ccc(Cl)cc1)N[C@H]1CCC[NH2+]CC1 ZINC001246099897 1131317498 /nfs/dbraw/zinc/31/74/98/1131317498.db2.gz YZAZSEAQHGRRTJ-OCCSQVGLSA-N 1 3 298.883 3.552 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H](C)CSC(C)(C)C)C1 ZINC000125850222 1124934492 /nfs/dbraw/zinc/93/44/92/1124934492.db2.gz VKPFGLUHCRMCTH-LSDHHAIUSA-N 1 3 286.529 3.617 20 0 CHADHO CSC(C)(C)CC[NH2+]C1CCN(CC2CCCC2)CC1 ZINC000876989799 1124994459 /nfs/dbraw/zinc/99/44/59/1124994459.db2.gz GGIITWGYSUTTPH-UHFFFAOYSA-N 1 3 298.540 3.762 20 0 CHADHO C(=C/c1ccccc1)\CCN1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000450437944 1125027368 /nfs/dbraw/zinc/02/73/68/1125027368.db2.gz LQNHEUVIEPBHOJ-XGHQVWIYSA-N 1 3 298.474 3.898 20 0 CHADHO C[N@H+](CC1CC1)C[C@@H]1CCN(CC/C=C/c2ccccc2)C1 ZINC000450459108 1125037024 /nfs/dbraw/zinc/03/70/24/1125037024.db2.gz ZRGCURRDFKBSFK-MRSBXDGLSA-N 1 3 298.474 3.754 20 0 CHADHO C[N@@H+](CC1CC1)C[C@@H]1CCN(CC/C=C/c2ccccc2)C1 ZINC000450459108 1125037033 /nfs/dbraw/zinc/03/70/33/1125037033.db2.gz ZRGCURRDFKBSFK-MRSBXDGLSA-N 1 3 298.474 3.754 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)C[C@H]2CCCCC2(F)F)C[C@@H]1C ZINC000450471567 1125039731 /nfs/dbraw/zinc/03/97/31/1125039731.db2.gz WFYGGSOBCWDXMJ-ZNMIVQPWSA-N 1 3 288.426 3.617 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)C[C@H]2CCCCC2(F)F)C[C@@H]1C ZINC000450471567 1125039735 /nfs/dbraw/zinc/03/97/35/1125039735.db2.gz WFYGGSOBCWDXMJ-ZNMIVQPWSA-N 1 3 288.426 3.617 20 0 CHADHO CC1(N2CCC2)CC[NH+](Cc2ccccc2C2CC2)CC1 ZINC000880474929 1125276712 /nfs/dbraw/zinc/27/67/12/1125276712.db2.gz OIGXMVPPDCBQAW-UHFFFAOYSA-N 1 3 284.447 3.624 20 0 CHADHO Cc1cccc(CC[C@@H](C)[NH2+]C[C@H]2CCN(C(C)C)C2)c1 ZINC000040623595 1125388925 /nfs/dbraw/zinc/38/89/25/1125388925.db2.gz UJQWKOAPZJAMAY-IEBWSBKVSA-N 1 3 288.479 3.636 20 0 CHADHO Cc1ccc(C2CC([NH2+]C[C@H]3CCN(C(C)C)C3)C2)cc1 ZINC000040622721 1125389078 /nfs/dbraw/zinc/38/90/78/1125389078.db2.gz KVRJMOIGGGVMSM-IPJUCJBFSA-N 1 3 286.463 3.561 20 0 CHADHO C[NH2+]C[C@H]1CCCN([C@@H](C)c2cccc3ccccc32)C1 ZINC000040592192 1125389372 /nfs/dbraw/zinc/38/93/72/1125389372.db2.gz ZZFPDOUWXUFXDS-JKSUJKDBSA-N 1 3 282.431 3.832 20 0 CHADHO Cc1cc(C)c(C[N@@H+]2CC[C@@H]3[C@@H](CCCN3C)C2)c(C)c1 ZINC000532538402 1125409887 /nfs/dbraw/zinc/40/98/87/1125409887.db2.gz YRGWQLKGTCHGAJ-PKOBYXMFSA-N 1 3 286.463 3.528 20 0 CHADHO Cc1cc(C)c(C[N@H+]2CC[C@@H]3[C@@H](CCCN3C)C2)c(C)c1 ZINC000532538402 1125409889 /nfs/dbraw/zinc/40/98/89/1125409889.db2.gz YRGWQLKGTCHGAJ-PKOBYXMFSA-N 1 3 286.463 3.528 20 0 CHADHO CCc1oc2ccccc2c1C[NH2+]CC(C)(C)CN(C)C ZINC000035017839 1125422512 /nfs/dbraw/zinc/42/25/12/1125422512.db2.gz FXXLUMMBSGZTLC-UHFFFAOYSA-N 1 3 288.435 3.673 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+]C[C@@]2(C)C[C@@H]2c2ccccc2)C1 ZINC000639169107 1129288275 /nfs/dbraw/zinc/28/82/75/1129288275.db2.gz CFNQXOHVZQGVRM-QXAKKESOSA-N 1 3 286.463 3.500 20 0 CHADHO CCCc1ccc(CNCc2cccc(C[NH+](C)C)c2)cc1 ZINC000642196076 1129409616 /nfs/dbraw/zinc/40/96/16/1129409616.db2.gz SSTNMFBUFLXOGJ-UHFFFAOYSA-N 1 3 296.458 3.991 20 0 CHADHO [NH3+][C@H]1C[C@@H](NCCCCc2ccccc2)c2ccccc21 ZINC000643458340 1129442401 /nfs/dbraw/zinc/44/24/01/1129442401.db2.gz NTTUMECJVJFHQK-RBUKOAKNSA-N 1 3 280.415 3.744 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCCCN1)c1cc2ccccc2s1 ZINC000643502299 1129442904 /nfs/dbraw/zinc/44/29/04/1129442904.db2.gz CDWSMIWQBRZLSU-OCCSQVGLSA-N 1 3 274.433 3.694 20 0 CHADHO Cc1ccc([C@@H](N[C@@H]2CCC[NH2+]CC2)C2CCC2)cc1 ZINC000643523163 1129443880 /nfs/dbraw/zinc/44/38/80/1129443880.db2.gz XAMOLLPCJPBSPJ-MSOLQXFVSA-N 1 3 272.436 3.568 20 0 CHADHO CCC[C@H]([NH2+]C[C@@H](C)N)c1ccc(Cl)c(Cl)c1 ZINC000643528910 1129444457 /nfs/dbraw/zinc/44/44/57/1129444457.db2.gz QUBVXDZCIJBUKA-RNCFNFMXSA-N 1 3 275.223 3.771 20 0 CHADHO c1ccc([C@@H](CC2CC2)N[C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000643546017 1129445407 /nfs/dbraw/zinc/44/54/07/1129445407.db2.gz HAYCSKQGBPAMIE-QZTJIDSGSA-N 1 3 284.447 3.792 20 0 CHADHO Cc1nc2ccc(Nc3cccc(C[NH+](C)C)c3)cc2[nH]1 ZINC001213073123 1129461257 /nfs/dbraw/zinc/46/12/57/1129461257.db2.gz FKMBZOHQGLFMRJ-UHFFFAOYSA-N 1 3 280.375 3.677 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN(CC(C)(C)c2ccccc2)C1 ZINC000180524116 1129487423 /nfs/dbraw/zinc/48/74/23/1129487423.db2.gz SQQYUUSPFWKDPT-QGZVFWFLSA-N 1 3 288.479 3.628 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN(CC(C)(C)c2ccccc2)C1 ZINC000180524116 1129487424 /nfs/dbraw/zinc/48/74/24/1129487424.db2.gz SQQYUUSPFWKDPT-QGZVFWFLSA-N 1 3 288.479 3.628 20 0 CHADHO CCN(C)C1CC[NH+]([C@H]2C[C@H](C)CC(C)(C)C2)CC1 ZINC001258705721 1129537308 /nfs/dbraw/zinc/53/73/08/1129537308.db2.gz YIIKRFXBEBCQEB-HOCLYGCPSA-N 1 3 266.473 3.617 20 0 CHADHO C1[C@@H]2CC[C@@H]([NH2+]C3CCN(C4CCCCC4)CC3)C[C@H]12 ZINC000647257522 1129561746 /nfs/dbraw/zinc/56/17/46/1129561746.db2.gz JPJCGEJFIGOXQG-YQQAZPJKSA-N 1 3 276.468 3.562 20 0 CHADHO CC(C)C[C@@H]([NH2+]CCCN1CCCCC1)c1ccncc1 ZINC000647281540 1129563120 /nfs/dbraw/zinc/56/31/20/1129563120.db2.gz UWEWNIMZMYAVCK-GOSISDBHSA-N 1 3 289.467 3.634 20 0 CHADHO [NH3+][C@H]1C[C@@H](NC[C@H]2C[C@@H]2c2ccccc2)c2ccccc21 ZINC000647800500 1129584945 /nfs/dbraw/zinc/58/49/45/1129584945.db2.gz CTGYCMXSMAKNAX-DQEVTTJGSA-N 1 3 278.399 3.525 20 0 CHADHO Clc1cccc([C@@H](NC[C@H]2CC[NH2+]C2)C2CCCC2)c1 ZINC000647992100 1129591427 /nfs/dbraw/zinc/59/14/27/1129591427.db2.gz FLBUNXRSRDOKGF-GUYCJALGSA-N 1 3 292.854 3.770 20 0 CHADHO C[C@H](N[C@@H](c1ccco1)c1ccccc1)C1CC[NH+](C)CC1 ZINC000387341335 1129654333 /nfs/dbraw/zinc/65/43/33/1129654333.db2.gz WFWYTUXPFIHUOE-HNAYVOBHSA-N 1 3 298.430 3.689 20 0 CHADHO CSC1CCC(CN[C@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC000720556665 1129657832 /nfs/dbraw/zinc/65/78/32/1129657832.db2.gz JPSZCZFNSUHKDJ-YCUKKYJWSA-N 1 3 290.476 3.643 20 0 CHADHO CC(CN1CCC12CCCC2)C[N@@H+]1CCC12CCCC2 ZINC000649657584 1129666502 /nfs/dbraw/zinc/66/65/02/1129666502.db2.gz FNGYRWRSNVMRNC-UHFFFAOYSA-N 1 3 276.468 3.660 20 0 CHADHO CC(CN1CCC12CCCC2)C[N@H+]1CCC12CCCC2 ZINC000649657584 1129666506 /nfs/dbraw/zinc/66/65/06/1129666506.db2.gz FNGYRWRSNVMRNC-UHFFFAOYSA-N 1 3 276.468 3.660 20 0 CHADHO CC(C)C[C@@H](Cc1ccccc1)[NH2+]CCCN1CCCC1 ZINC001169049964 1129692104 /nfs/dbraw/zinc/69/21/04/1129692104.db2.gz MQPKBKLGFNEPLZ-IBGZPJMESA-N 1 3 288.479 3.719 20 0 CHADHO CC(C)C[C@H](Cc1ccccc1)[NH2+]CC[C@H]1CCCN1C ZINC001169058173 1129693973 /nfs/dbraw/zinc/69/39/73/1129693973.db2.gz DIIPOHIJPVOJEQ-RTBURBONSA-N 1 3 288.479 3.718 20 0 CHADHO CN1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1(c3cccc(Cl)c3)CC1)C2 ZINC001169098417 1129696364 /nfs/dbraw/zinc/69/63/64/1129696364.db2.gz HVDMBKLLBFSTBZ-MUJYYYPQSA-N 1 3 290.838 3.544 20 0 CHADHO CN1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccc(Cl)c(Cl)c1)C2 ZINC001169092134 1129700158 /nfs/dbraw/zinc/70/01/58/1129700158.db2.gz YFCAZPAIZJDWAN-CLLJXQQHSA-N 1 3 299.245 3.708 20 0 CHADHO CS[C@@H]1CC[C@H]1NC1CC[NH+](CC2CCCCC2)CC1 ZINC000766602002 1129701446 /nfs/dbraw/zinc/70/14/46/1129701446.db2.gz KPKVYVABESTBAW-IAGOWNOFSA-N 1 3 296.524 3.515 20 0 CHADHO CS[C@@H]1CC[C@H]1[NH2+]C1CCN(CC2CCCCC2)CC1 ZINC000766602002 1129701448 /nfs/dbraw/zinc/70/14/48/1129701448.db2.gz KPKVYVABESTBAW-IAGOWNOFSA-N 1 3 296.524 3.515 20 0 CHADHO CC1(C)C[C@@H](Nc2c[nH]cc3ccnc2-3)C[C@@](C)(C[NH3+])C1 ZINC001169142515 1129704036 /nfs/dbraw/zinc/70/40/36/1129704036.db2.gz HCBJSJZXTJRQTP-CXAGYDPISA-N 1 3 286.423 3.519 20 0 CHADHO CC1(C)C[C@@H](Nc2cncc3cc[nH]c32)C[C@@](C)(C[NH3+])C1 ZINC001169142515 1129704040 /nfs/dbraw/zinc/70/40/40/1129704040.db2.gz HCBJSJZXTJRQTP-CXAGYDPISA-N 1 3 286.423 3.519 20 0 CHADHO CCN(Cc1cccc(Cl)c1)C1CC[NH+](CC)CC1 ZINC001169261854 1129711468 /nfs/dbraw/zinc/71/14/68/1129711468.db2.gz OTICFALZQUKVAQ-UHFFFAOYSA-N 1 3 280.843 3.646 20 0 CHADHO C[NH2+]Cc1ccccc1CNCc1ccccc1C1CC1 ZINC000650719542 1129720660 /nfs/dbraw/zinc/72/06/60/1129720660.db2.gz UBUQONIRZZHWIB-UHFFFAOYSA-N 1 3 280.415 3.573 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@@H](C)c1ccc(F)c(F)c1 ZINC000650758514 1129721949 /nfs/dbraw/zinc/72/19/49/1129721949.db2.gz RBTPGAIOMLYUDC-LBPRGKRZSA-N 1 3 290.357 3.535 20 0 CHADHO CC(C)[C@@H]([NH2+]CCCN1CCCCC1)c1ccc(F)cc1 ZINC001169754110 1129754124 /nfs/dbraw/zinc/75/41/24/1129754124.db2.gz GKOONIISSFIBLB-GOSISDBHSA-N 1 3 292.442 3.988 20 0 CHADHO CC(C)[C@@H](NCCC[NH+]1CCCCC1)c1ccc(F)cc1 ZINC001169754110 1129754126 /nfs/dbraw/zinc/75/41/26/1129754126.db2.gz GKOONIISSFIBLB-GOSISDBHSA-N 1 3 292.442 3.988 20 0 CHADHO C[C@@H](NCCCCCCC[NH+]1CCCC1)c1cscn1 ZINC000768102084 1129831677 /nfs/dbraw/zinc/83/16/77/1129831677.db2.gz MYTSSUWKLLHXRE-OAHLLOKOSA-N 1 3 295.496 3.840 20 0 CHADHO CN(Cc1ccc(C[NH+](C)C)cc1)Cc1cccc(F)c1 ZINC000768160035 1129838137 /nfs/dbraw/zinc/83/81/37/1129838137.db2.gz LOSVFWGCYPGVSY-UHFFFAOYSA-N 1 3 286.394 3.519 20 0 CHADHO C(C1CCCCC1)N1CCC([NH2+][C@@H]2CCC23CCC3)CC1 ZINC000800475858 1129876595 /nfs/dbraw/zinc/87/65/95/1129876595.db2.gz ZVFIWFABAISZGX-GOSISDBHSA-N 1 3 290.495 3.953 20 0 CHADHO Cc1ccc(CN(C)Cc2ccc(C[NH+](C)C)cc2)s1 ZINC000769316642 1129902014 /nfs/dbraw/zinc/90/20/14/1129902014.db2.gz MTCZJDJCYFAJPN-UHFFFAOYSA-N 1 3 288.460 3.750 20 0 CHADHO CC1(C)C[NH2+]CC[C@H](N[C@H](c2cccs2)C2CC2)C1 ZINC000902336117 1130000661 /nfs/dbraw/zinc/00/06/61/1130000661.db2.gz YGQOLTNHOFHAMU-ZFWWWQNUSA-N 1 3 278.465 3.567 20 0 CHADHO C[C@@H]1[C@H]([NH+]2CCCC2)CCN1CC1CCC2(CC2)CC1 ZINC001170039420 1130008146 /nfs/dbraw/zinc/00/81/46/1130008146.db2.gz ONOAMIUTQDJSRZ-NVXWUHKLSA-N 1 3 276.468 3.515 20 0 CHADHO FC1(F)CCCC[C@@H]1CNC1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903177100 1130125073 /nfs/dbraw/zinc/12/50/73/1130125073.db2.gz HNFYBJHJGUQDAU-WPXLMEDKSA-N 1 3 298.421 3.559 20 0 CHADHO FC1(F)CCCC[C@@H]1CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1 ZINC000903177100 1130125075 /nfs/dbraw/zinc/12/50/75/1130125075.db2.gz HNFYBJHJGUQDAU-WPXLMEDKSA-N 1 3 298.421 3.559 20 0 CHADHO CC[C@]1(C)CCC[C@H]1N[C@@H](CC[NH+](C)C)c1cccnc1 ZINC000903378135 1130168115 /nfs/dbraw/zinc/16/81/15/1130168115.db2.gz OSJGJHXTKLSABQ-RCCFBDPRSA-N 1 3 289.467 3.633 20 0 CHADHO CCC[C@H](N[C@@H](CC[NH+](C)C)c1cccnc1)C1CCC1 ZINC000903376334 1130168270 /nfs/dbraw/zinc/16/82/70/1130168270.db2.gz BUTILFIIIAPDOY-ROUUACIJSA-N 1 3 289.467 3.633 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H]2c3ccccc3CC[C@H]2C)C1 ZINC000678767554 1130450928 /nfs/dbraw/zinc/45/09/28/1130450928.db2.gz NEEZRWRRDITVCO-MDZRGWNJSA-N 1 3 286.463 3.632 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H]2c3ccccc3CC[C@H]2C)C1 ZINC000678767554 1130450930 /nfs/dbraw/zinc/45/09/30/1130450930.db2.gz NEEZRWRRDITVCO-MDZRGWNJSA-N 1 3 286.463 3.632 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2c3ccccc3CC[C@H]2C)C1 ZINC000678767554 1130450934 /nfs/dbraw/zinc/45/09/34/1130450934.db2.gz NEEZRWRRDITVCO-MDZRGWNJSA-N 1 3 286.463 3.632 20 0 CHADHO CCN(CCC[NH+](C)C)[C@@H](C)Cc1ccccc1Cl ZINC001170290353 1130480543 /nfs/dbraw/zinc/48/05/43/1130480543.db2.gz AJXMIEZIUHHGDT-AWEZNQCLSA-N 1 3 282.859 3.545 20 0 CHADHO Cc1ccc(CN2CCC[C@]3(CC[NH2+]C3)C2)c2ccccc12 ZINC001234995320 1130700805 /nfs/dbraw/zinc/70/08/05/1130700805.db2.gz ZUAAEFUFGRVDGT-HXUWFJFHSA-N 1 3 294.442 3.724 20 0 CHADHO CC/C=C\CCCCCCN1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001234995109 1130700986 /nfs/dbraw/zinc/70/09/86/1130700986.db2.gz XNQOZFBDJORYGM-JXCVUKRWSA-N 1 3 278.484 3.979 20 0 CHADHO c1ccc(C2CC2)c(CN2CCC[C@@]3(CCC[NH2+]3)CC2)c1 ZINC001235046503 1130706175 /nfs/dbraw/zinc/70/61/75/1130706175.db2.gz QTZMQCAMBSZZAV-IBGZPJMESA-N 1 3 284.447 3.672 20 0 CHADHO c1cc(C[N@@H+]2CCCCC23CCNCC3)c2cccccc1-2 ZINC001235189965 1130720699 /nfs/dbraw/zinc/72/06/99/1130720699.db2.gz BFMMIWPLGPGKQZ-UHFFFAOYSA-N 1 3 294.442 3.900 20 0 CHADHO c1cc(C[N@H+]2CCCCC23CCNCC3)c2cccccc1-2 ZINC001235189965 1130720702 /nfs/dbraw/zinc/72/07/02/1130720702.db2.gz BFMMIWPLGPGKQZ-UHFFFAOYSA-N 1 3 294.442 3.900 20 0 CHADHO Cc1c(CN2C[C@@H]3C[C@H]2C[C@@H]3[NH3+])cccc1-c1ccccc1 ZINC001235257008 1130729429 /nfs/dbraw/zinc/72/94/29/1130729429.db2.gz WGHXRPFBZVZWPN-BJLQDIEVSA-N 1 3 292.426 3.584 20 0 CHADHO CN(Cc1cccc2c3ccccc3oc21)C1CC[NH2+]CC1 ZINC001235465982 1130747393 /nfs/dbraw/zinc/74/73/93/1130747393.db2.gz MRCLFIYHIVQEBU-UHFFFAOYSA-N 1 3 294.398 3.770 20 0 CHADHO C[N@H+](Cc1cccc2c3ccccc3oc21)C1CCNCC1 ZINC001235465982 1130747398 /nfs/dbraw/zinc/74/73/98/1130747398.db2.gz MRCLFIYHIVQEBU-UHFFFAOYSA-N 1 3 294.398 3.770 20 0 CHADHO C[N@@H+](Cc1cccc2c3ccccc3oc21)C1CCNCC1 ZINC001235465982 1130747403 /nfs/dbraw/zinc/74/74/03/1130747403.db2.gz MRCLFIYHIVQEBU-UHFFFAOYSA-N 1 3 294.398 3.770 20 0 CHADHO c1ccc([C@@H]2CCC[N@@H+](Cc3ccc4c(c3)CNC4)C2)cc1 ZINC001235663368 1130763364 /nfs/dbraw/zinc/76/33/64/1130763364.db2.gz GYJOOGKVAIRZDM-LJQANCHMSA-N 1 3 292.426 3.669 20 0 CHADHO c1ccc([C@@H]2CCC[N@H+](Cc3ccc4c(c3)CNC4)C2)cc1 ZINC001235663368 1130763367 /nfs/dbraw/zinc/76/33/67/1130763367.db2.gz GYJOOGKVAIRZDM-LJQANCHMSA-N 1 3 292.426 3.669 20 0 CHADHO CCC(C)(C)c1ccc(CN2CCC[C@@H](C[NH3+])C2)cc1 ZINC001235676232 1130766492 /nfs/dbraw/zinc/76/64/92/1130766492.db2.gz PNDNSSIFNSVQQD-INIZCTEOSA-N 1 3 274.452 3.545 20 0 CHADHO [NH3+]Cc1cccc(CN2CCC[C@H]2c2cccc(F)c2)c1 ZINC001235713556 1130772235 /nfs/dbraw/zinc/77/22/35/1130772235.db2.gz CUMPWDVCYPIXQB-SFHVURJKSA-N 1 3 284.378 3.622 20 0 CHADHO Cc1c(C)c(C)c(C[N@H+]2C[C@@H](N)CC[C@H]2C)c(C)c1C ZINC001235905054 1130801951 /nfs/dbraw/zinc/80/19/51/1130801951.db2.gz KPAJBFSCOJQOMK-DIFFPNOSSA-N 1 3 274.452 3.540 20 0 CHADHO Cc1c(C)c(C)c(C[N@@H+]2C[C@@H](N)CC[C@H]2C)c(C)c1C ZINC001235905054 1130801957 /nfs/dbraw/zinc/80/19/57/1130801957.db2.gz KPAJBFSCOJQOMK-DIFFPNOSSA-N 1 3 274.452 3.540 20 0 CHADHO CC[C@H](c1ccccc1)N(C)CC[C@@H]1CCCC[NH2+]1 ZINC001235960669 1130818646 /nfs/dbraw/zinc/81/86/46/1130818646.db2.gz WTYMWAJISIBTCF-DLBZAZTESA-N 1 3 260.425 3.602 20 0 CHADHO CC(C)(C)c1cccc(CN2CC3(C2)CCC[NH2+]CC3)c1 ZINC001236009737 1130831073 /nfs/dbraw/zinc/83/10/73/1130831073.db2.gz QHSPJOXMYHYPGL-UHFFFAOYSA-N 1 3 286.463 3.560 20 0 CHADHO COc1ccc2cc(C[N@H+](C)[C@H]3CCCC[C@@H]3N)ccc2c1 ZINC001236210667 1130887692 /nfs/dbraw/zinc/88/76/92/1130887692.db2.gz DWRPIMUWTUXGBT-OALUTQOASA-N 1 3 298.430 3.550 20 0 CHADHO COc1ccc2cc(C[N@@H+](C)[C@H]3CCCC[C@@H]3N)ccc2c1 ZINC001236210667 1130887701 /nfs/dbraw/zinc/88/77/01/1130887701.db2.gz DWRPIMUWTUXGBT-OALUTQOASA-N 1 3 298.430 3.550 20 0 CHADHO Cc1c2ccccc2sc1C[N@@H+](C)[C@@H]1CCCC[C@@H]1N ZINC001236218191 1130893803 /nfs/dbraw/zinc/89/38/03/1130893803.db2.gz RNANEDGEKBVAPA-LSDHHAIUSA-N 1 3 288.460 3.911 20 0 CHADHO Cc1c2ccccc2sc1C[N@H+](C)[C@@H]1CCCC[C@@H]1N ZINC001236218191 1130893807 /nfs/dbraw/zinc/89/38/07/1130893807.db2.gz RNANEDGEKBVAPA-LSDHHAIUSA-N 1 3 288.460 3.911 20 0 CHADHO CC(C)CCC[N@H+](Cc1ccccc1)C1CCNCC1 ZINC001236287401 1130911246 /nfs/dbraw/zinc/91/12/46/1130911246.db2.gz SUSRAPYLMSAYKA-UHFFFAOYSA-N 1 3 274.452 3.677 20 0 CHADHO CC(C)CCC[N@@H+](Cc1ccccc1)C1CCNCC1 ZINC001236287401 1130911249 /nfs/dbraw/zinc/91/12/49/1130911249.db2.gz SUSRAPYLMSAYKA-UHFFFAOYSA-N 1 3 274.452 3.677 20 0 CHADHO CC(C)CCCN(Cc1ccccc1)C1CC[NH2+]CC1 ZINC001236287401 1130911252 /nfs/dbraw/zinc/91/12/52/1130911252.db2.gz SUSRAPYLMSAYKA-UHFFFAOYSA-N 1 3 274.452 3.677 20 0 CHADHO Cc1cccc(C[N@H+](C[C@@H]2CCCNC2)C2CCCC2)c1 ZINC001236372167 1130922210 /nfs/dbraw/zinc/92/22/10/1130922210.db2.gz BBRFOUXGUOLXMV-GOSISDBHSA-N 1 3 286.463 3.739 20 0 CHADHO Cc1cccc(C[N@@H+](C[C@@H]2CCCNC2)C2CCCC2)c1 ZINC001236372167 1130922212 /nfs/dbraw/zinc/92/22/12/1130922212.db2.gz BBRFOUXGUOLXMV-GOSISDBHSA-N 1 3 286.463 3.739 20 0 CHADHO CCCCCC[N@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236371788 1130922466 /nfs/dbraw/zinc/92/24/66/1130922466.db2.gz NESKGMPGUFKZOL-MRXNPFEDSA-N 1 3 266.473 3.811 20 0 CHADHO CCCCCC[N@@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236371788 1130922468 /nfs/dbraw/zinc/92/24/68/1130922468.db2.gz NESKGMPGUFKZOL-MRXNPFEDSA-N 1 3 266.473 3.811 20 0 CHADHO Cc1cc(CN(C[C@H]2CCC[NH2+]C2)C2CCCC2)cs1 ZINC001236376777 1130923100 /nfs/dbraw/zinc/92/31/00/1130923100.db2.gz VKAKZBDNXOWDSM-HNNXBMFYSA-N 1 3 292.492 3.801 20 0 CHADHO Cc1sccc1CN(C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236376478 1130923667 /nfs/dbraw/zinc/92/36/67/1130923667.db2.gz SMDXKMNKPUIUQC-OAHLLOKOSA-N 1 3 292.492 3.801 20 0 CHADHO CCN(Cc1c(C)ccc2ccccc21)C[C@H]1CC[NH2+]C1 ZINC001236407724 1130931248 /nfs/dbraw/zinc/93/12/48/1130931248.db2.gz GVUGBBBRWRWCKE-INIZCTEOSA-N 1 3 282.431 3.580 20 0 CHADHO CCN(Cc1sc2ccccc2c1C)C[C@H]1CC[NH2+]C1 ZINC001236409835 1130931535 /nfs/dbraw/zinc/93/15/35/1130931535.db2.gz XMSIPORPSQHNBV-AWEZNQCLSA-N 1 3 288.460 3.641 20 0 CHADHO C[NH+](C)Cc1cccc(-c2cccc(C3=NCCC3)c2)c1 ZINC001236426316 1130938830 /nfs/dbraw/zinc/93/88/30/1130938830.db2.gz MLMUZQIFCACCPJ-UHFFFAOYSA-N 1 3 278.399 3.998 20 0 CHADHO Clc1ccc(C[N@H+](CC2CCC2)C2CCNCC2)cc1 ZINC001236453023 1130945124 /nfs/dbraw/zinc/94/51/24/1130945124.db2.gz NCSOKTDJBQMPFO-UHFFFAOYSA-N 1 3 292.854 3.694 20 0 CHADHO Clc1ccc(C[N@@H+](CC2CCC2)C2CCNCC2)cc1 ZINC001236453023 1130945127 /nfs/dbraw/zinc/94/51/27/1130945127.db2.gz NCSOKTDJBQMPFO-UHFFFAOYSA-N 1 3 292.854 3.694 20 0 CHADHO Clc1ccc(CN(CC2CCC2)C2CC[NH2+]CC2)cc1 ZINC001236453023 1130945130 /nfs/dbraw/zinc/94/51/30/1130945130.db2.gz NCSOKTDJBQMPFO-UHFFFAOYSA-N 1 3 292.854 3.694 20 0 CHADHO Cc1cc(C[N@H+](CC(C)(C)C)C2CCNCC2)cs1 ZINC001236459617 1130946148 /nfs/dbraw/zinc/94/61/48/1130946148.db2.gz WCSWXYIKQJNXBA-UHFFFAOYSA-N 1 3 280.481 3.657 20 0 CHADHO Cc1cc(C[N@@H+](CC(C)(C)C)C2CCNCC2)cs1 ZINC001236459617 1130946149 /nfs/dbraw/zinc/94/61/49/1130946149.db2.gz WCSWXYIKQJNXBA-UHFFFAOYSA-N 1 3 280.481 3.657 20 0 CHADHO Cc1cc(F)cc(C[N@H+](CC(C)(C)C)C2CCNCC2)c1 ZINC001236458046 1130946558 /nfs/dbraw/zinc/94/65/58/1130946558.db2.gz TVGLUGHFDCVHQW-UHFFFAOYSA-N 1 3 292.442 3.734 20 0 CHADHO Cc1cc(F)cc(C[N@@H+](CC(C)(C)C)C2CCNCC2)c1 ZINC001236458046 1130946561 /nfs/dbraw/zinc/94/65/61/1130946561.db2.gz TVGLUGHFDCVHQW-UHFFFAOYSA-N 1 3 292.442 3.734 20 0 CHADHO C[C@@]1(C[NH3+])CCN(Cc2ccc(C3CCCCC3)cc2)C1 ZINC001236617390 1130985434 /nfs/dbraw/zinc/98/54/34/1130985434.db2.gz VBBIVTOMQFCLJJ-IBGZPJMESA-N 1 3 286.463 3.905 20 0 CHADHO Cc1cc(F)ccc1[C@@H](C)[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000815576589 1131001573 /nfs/dbraw/zinc/00/15/73/1131001573.db2.gz UHMCHBRDCLGUTE-CVEARBPZSA-N 1 3 292.442 3.905 20 0 CHADHO CCCN(Cc1cc2ccccc2s1)C[C@@H]1CC[NH2+]C1 ZINC001236835352 1131019065 /nfs/dbraw/zinc/01/90/65/1131019065.db2.gz LUUSPMCBSIXFNG-CQSZACIVSA-N 1 3 288.460 3.723 20 0 CHADHO CCC(C)(C)c1ccc(CN2CCC[C@@](C)(C[NH3+])C2)cc1 ZINC001237080152 1131047567 /nfs/dbraw/zinc/04/75/67/1131047567.db2.gz DESLULZCWGPKSQ-IBGZPJMESA-N 1 3 288.479 3.935 20 0 CHADHO CC/C=C\CCCN1CCC2(CC1)[NH2+]CCc1ccccc12 ZINC001237274457 1131077644 /nfs/dbraw/zinc/07/76/44/1131077644.db2.gz CVDLZGOYTGERPI-ARJAWSKDSA-N 1 3 298.474 3.870 20 0 CHADHO CCN1CCC[C@@H](C[NH2+][C@@H]2CC(C)(C)Cc3occc32)C1 ZINC001116293567 1131140224 /nfs/dbraw/zinc/14/02/24/1131140224.db2.gz SGOLPDYPYRLKCA-GOEBONIOSA-N 1 3 290.451 3.615 20 0 CHADHO CCCCCC[C@@H](C)[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000817893194 1131187002 /nfs/dbraw/zinc/18/70/02/1131187002.db2.gz QMIAJQPGTGWKTR-KGLIPLIRSA-N 1 3 277.456 3.858 20 0 CHADHO C[C@@H](NCc1ccc(CC[NH3+])cc1)c1cc2ccccc2o1 ZINC000817947094 1131188974 /nfs/dbraw/zinc/18/89/74/1131188974.db2.gz JXEHHVLHSMQXPI-CQSZACIVSA-N 1 3 294.398 3.785 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@@H](C)Cc2ccccc2Cl)C1 ZINC001117639459 1131189565 /nfs/dbraw/zinc/18/95/65/1131189565.db2.gz HTGVJGDJBWJOCD-GJZGRUSLSA-N 1 3 294.870 3.591 20 0 CHADHO CCCCC[C@H]([NH2+][C@H]1CCN[C@@H](C)C1)C(C)(C)C ZINC000817970780 1131193966 /nfs/dbraw/zinc/19/39/66/1131193966.db2.gz FCHAEWJUWACVIT-KKUMJFAQSA-N 1 3 254.462 3.712 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H]1CCc2cccc(Cl)c2C1 ZINC001170890900 1131204122 /nfs/dbraw/zinc/20/41/22/1131204122.db2.gz XUXFKZXQNSVJFG-OAHLLOKOSA-N 1 3 294.870 3.519 20 0 CHADHO CC[N@H+]1C[C@H]2CN(Cc3ccc(C)c4ccccc34)C[C@H]2C1 ZINC001138017986 1131451475 /nfs/dbraw/zinc/45/14/75/1131451475.db2.gz DOVZLDMIWBYUPH-HDICACEKSA-N 1 3 294.442 3.532 20 0 CHADHO CC[N@@H+]1C[C@H]2CN(Cc3ccc(C)c4ccccc34)C[C@H]2C1 ZINC001138017986 1131451476 /nfs/dbraw/zinc/45/14/76/1131451476.db2.gz DOVZLDMIWBYUPH-HDICACEKSA-N 1 3 294.442 3.532 20 0 CHADHO CCN(CCC[NH+](C)C)Cc1ccc(C)c2ccccc12 ZINC001138018412 1131452174 /nfs/dbraw/zinc/45/21/74/1131452174.db2.gz WSWHTQUXDFRTFE-UHFFFAOYSA-N 1 3 284.447 3.922 20 0 CHADHO CC(C)(C)[C@H]1C[C@H]([NH2+]C2CCC(C)(C)CC2)CCN1 ZINC001246313366 1131461970 /nfs/dbraw/zinc/46/19/70/1131461970.db2.gz YSHRFFVBJXOZFU-HUUCEWRRSA-N 1 3 266.473 3.712 20 0 CHADHO CCCN(CCC[NH+](C)C)Cc1ccccc1C1CC1 ZINC001139883258 1131645281 /nfs/dbraw/zinc/64/52/81/1131645281.db2.gz KHDLBRAJLOCKTJ-UHFFFAOYSA-N 1 3 274.452 3.728 20 0 CHADHO [NH3+]CCCCCCN1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000846217624 1131700591 /nfs/dbraw/zinc/70/05/91/1131700591.db2.gz GAONBLFLJUOIPT-MRXNPFEDSA-N 1 3 282.378 3.621 20 0 CHADHO CC(C)(C)[C@@H]1C[C@@H]([NH+]2CCCCCCCC2)CCN1 ZINC001246920299 1131817813 /nfs/dbraw/zinc/81/78/13/1131817813.db2.gz MEKIOXYNERZKIJ-HOTGVXAUSA-N 1 3 266.473 3.809 20 0 CHADHO CN1C(C)(C)CC([NH+]2CCCCCC2)CC1(C)C ZINC001171632372 1132063776 /nfs/dbraw/zinc/06/37/76/1132063776.db2.gz YRLPMDUDVOEARO-UHFFFAOYSA-N 1 3 252.446 3.514 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@H]2CCc3ccccc32)CC1(C)C ZINC001171619491 1132065191 /nfs/dbraw/zinc/06/51/91/1132065191.db2.gz MSXZHGCXBAYRQT-KRWDZBQOSA-N 1 3 286.463 3.915 20 0 CHADHO C[C@H]1CC[C@@H]([NH2+]C2CC(C)(C)N(C)C(C)(C)C2)CC1 ZINC001171625483 1132068117 /nfs/dbraw/zinc/06/81/17/1132068117.db2.gz JOKMSKCBEQGRNO-OKILXGFUSA-N 1 3 266.473 3.806 20 0 CHADHO C[C@H]1CCN1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172070355 1132121361 /nfs/dbraw/zinc/12/13/61/1132121361.db2.gz ZNTOODNQLPJTFK-KANFNMMFSA-N 1 3 284.447 3.666 20 0 CHADHO C[C@H]1CCN1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172070355 1132121364 /nfs/dbraw/zinc/12/13/64/1132121364.db2.gz ZNTOODNQLPJTFK-KANFNMMFSA-N 1 3 284.447 3.666 20 0 CHADHO Cc1cc(C)c(CN[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c(C)c1 ZINC001172101900 1132122870 /nfs/dbraw/zinc/12/28/70/1132122870.db2.gz ICILBGVJABUHNG-NNZMDNLPSA-N 1 3 286.463 3.717 20 0 CHADHO Cc1cc(C)c(CN[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c(C)c1 ZINC001172101900 1132122874 /nfs/dbraw/zinc/12/28/74/1132122874.db2.gz ICILBGVJABUHNG-NNZMDNLPSA-N 1 3 286.463 3.717 20 0 CHADHO CC[C@H](C)OCC[C@@H](C)[NH2+]C1CCN(C2CCCC2)CC1 ZINC001172343742 1132177880 /nfs/dbraw/zinc/17/78/80/1132177880.db2.gz RKCLJFXNPNJLNX-CVEARBPZSA-N 1 3 296.499 3.577 20 0 CHADHO CN1CC[C@@H]2C[N@@H+]([C@H]3CCC[C@@H](c4ccccc4)C3)C[C@@H]2C1 ZINC001172540522 1132276210 /nfs/dbraw/zinc/27/62/10/1132276210.db2.gz ILMUPLKDLOPEKG-ZRNYENFQSA-N 1 3 298.474 3.596 20 0 CHADHO CN1CC[C@@H]2C[N@H+]([C@H]3CCC[C@@H](c4ccccc4)C3)C[C@@H]2C1 ZINC001172540522 1132276217 /nfs/dbraw/zinc/27/62/17/1132276217.db2.gz ILMUPLKDLOPEKG-ZRNYENFQSA-N 1 3 298.474 3.596 20 0 CHADHO CN1CC2(C1)CC[NH+](C1CCC3(CCCC3)CC1)CC2 ZINC001172731452 1132305283 /nfs/dbraw/zinc/30/52/83/1132305283.db2.gz ZVRLTEDYUMRKPD-UHFFFAOYSA-N 1 3 276.468 3.517 20 0 CHADHO CCCCc1ccc(CN2CC3(C2)CC[NH+](C)CC3)cc1 ZINC001231783201 1132361448 /nfs/dbraw/zinc/36/14/48/1132361448.db2.gz YYMWULOKQUVPES-UHFFFAOYSA-N 1 3 286.463 3.557 20 0 CHADHO CC[NH+](CC)C1CCC(N[C@H](C)c2csc(C)n2)CC1 ZINC001173101989 1132390566 /nfs/dbraw/zinc/39/05/66/1132390566.db2.gz RQMHEAVUXWQHDI-LRVUVFPRSA-N 1 3 295.496 3.755 20 0 CHADHO C[C@H](CC(c1ccccc1)c1ccccc1)NC1(C[NH3+])CC1 ZINC001173213269 1132416394 /nfs/dbraw/zinc/41/63/94/1132416394.db2.gz DYCWGUVOGMKUAH-MRXNPFEDSA-N 1 3 294.442 3.678 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)c1 ZINC001232146713 1132428240 /nfs/dbraw/zinc/42/82/40/1132428240.db2.gz ZWEDBQNMIHHUAE-FUHWJXTLSA-N 1 3 290.426 3.652 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)c1 ZINC001232146713 1132428244 /nfs/dbraw/zinc/42/82/44/1132428244.db2.gz ZWEDBQNMIHHUAE-FUHWJXTLSA-N 1 3 290.426 3.652 20 0 CHADHO CC[C@@H]1CC[C@@H]([NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC001173266464 1132433004 /nfs/dbraw/zinc/43/30/04/1132433004.db2.gz FSMKRSAKZKJQPS-GDBMZVCRSA-N 1 3 264.457 3.562 20 0 CHADHO [NH3+]CCCCCCCN(Cc1ccccc1F)C1CC1 ZINC000842471640 1132433623 /nfs/dbraw/zinc/43/36/23/1132433623.db2.gz OBAGZWAOGHBBHN-UHFFFAOYSA-N 1 3 278.415 3.699 20 0 CHADHO CCCN(CCC[NH+](C)C)Cc1ccccc1-n1cccc1 ZINC001232911975 1132541407 /nfs/dbraw/zinc/54/14/07/1132541407.db2.gz GVLCMDAVUXPCCJ-UHFFFAOYSA-N 1 3 299.462 3.641 20 0 CHADHO [NH3+]C[C@@H]1CCCCN(Cc2ccc(-c3ccccc3)o2)C1 ZINC001206633104 1132551798 /nfs/dbraw/zinc/55/17/98/1132551798.db2.gz SYWJIUFUVVKPLU-HNNXBMFYSA-N 1 3 284.403 3.507 20 0 CHADHO Cc1cc2cc(NCC[C@@H]3CCC[N@@H+](C)C3)ccc2cn1 ZINC001165300720 1133238496 /nfs/dbraw/zinc/23/84/96/1133238496.db2.gz RNZVMHUOJYAEFL-HNNXBMFYSA-N 1 3 283.419 3.687 20 0 CHADHO Cc1cc2cc(NCC[C@@H]3CCC[N@H+](C)C3)ccc2cn1 ZINC001165300720 1133238498 /nfs/dbraw/zinc/23/84/98/1133238498.db2.gz RNZVMHUOJYAEFL-HNNXBMFYSA-N 1 3 283.419 3.687 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](CN2CC[C@](C)([NH3+])C2)CC1 ZINC001204763186 1133482291 /nfs/dbraw/zinc/48/22/91/1133482291.db2.gz HUIJEJVLZDPZDD-MSOLQXFVSA-N 1 3 276.468 3.882 20 0 CHADHO C[C@@H]1c2ccccc2CCN1Cc1cc2c(s1)C[NH2+]CC2 ZINC001205164631 1133539357 /nfs/dbraw/zinc/53/93/57/1133539357.db2.gz JXQQRCPLUQCDEL-CYBMUJFWSA-N 1 3 298.455 3.513 20 0 CHADHO Cc1ccc(-c2ccc(CN3CC[C@H](C)[C@H](C[NH3+])C3)cc2)o1 ZINC001205303599 1133556471 /nfs/dbraw/zinc/55/64/71/1133556471.db2.gz IJGITNAXGOGKKA-KBXCAEBGSA-N 1 3 298.430 3.672 20 0 CHADHO C[C@H]1CCNCC[N@@H+]1Cc1ccccc1-c1ccccc1 ZINC001205332551 1133563691 /nfs/dbraw/zinc/56/36/91/1133563691.db2.gz RQMBRENQIHZGIK-INIZCTEOSA-N 1 3 280.415 3.537 20 0 CHADHO C[C@H]1CCNCC[N@H+]1Cc1ccccc1-c1ccccc1 ZINC001205332551 1133563695 /nfs/dbraw/zinc/56/36/95/1133563695.db2.gz RQMBRENQIHZGIK-INIZCTEOSA-N 1 3 280.415 3.537 20 0 CHADHO CC1CCN(CCC[NH2+][C@@H]2CC[C@@H](C)[C@H](C)C2)CC1 ZINC000084982627 1133582563 /nfs/dbraw/zinc/58/25/63/1133582563.db2.gz JXGMPWGWCOOPPO-BRWVUGGUSA-N 1 3 266.473 3.523 20 0 CHADHO Cc1ccc(Cl)c(CN2CC[C@@H](C)[C@H](C[NH3+])CC2)c1F ZINC001205618930 1133596688 /nfs/dbraw/zinc/59/66/88/1133596688.db2.gz ZGRIFBCSPOAFGM-YPMHNXCESA-N 1 3 298.833 3.594 20 0 CHADHO CCN(CCC[NH+](C)C)CCc1ccc(C(C)C)cc1 ZINC001205693365 1133603655 /nfs/dbraw/zinc/60/36/55/1133603655.db2.gz VEXXWPUUMKGCGW-UHFFFAOYSA-N 1 3 276.468 3.626 20 0 CHADHO Cc1c(C[N@@H+]2CCCC[C@@H](N)C2)cccc1-c1ccccc1 ZINC001205939610 1133632530 /nfs/dbraw/zinc/63/25/30/1133632530.db2.gz SLBGCWGCUVEMOY-LJQANCHMSA-N 1 3 294.442 3.975 20 0 CHADHO Cc1c(C[N@H+]2CCCC[C@@H](N)C2)cccc1-c1ccccc1 ZINC001205939610 1133632533 /nfs/dbraw/zinc/63/25/33/1133632533.db2.gz SLBGCWGCUVEMOY-LJQANCHMSA-N 1 3 294.442 3.975 20 0 CHADHO Fc1ccc([C@@H]2CCCN2Cc2ccc3c(c2)C[NH2+]C3)cc1 ZINC001206050034 1133649227 /nfs/dbraw/zinc/64/92/27/1133649227.db2.gz YOGDJSAKTVNCJN-IBGZPJMESA-N 1 3 296.389 3.766 20 0 CHADHO CCC(C)(C)c1ccc(CN2CC[C@@H](F)[C@@H]([NH3+])CC2)cc1 ZINC001206188843 1133669202 /nfs/dbraw/zinc/66/92/02/1133669202.db2.gz VZVAGOMCYCUIMZ-SJORKVTESA-N 1 3 292.442 3.635 20 0 CHADHO CCc1cccc2c(CN3CCCC[C@@](C)(C[NH3+])C3)c[nH]c21 ZINC001206547122 1133715748 /nfs/dbraw/zinc/71/57/48/1133715748.db2.gz BVZYRBFHZVBVKR-IBGZPJMESA-N 1 3 299.462 3.681 20 0 CHADHO CC(C)[N@H+](CC1(C)CCCCC1)[C@@H]1CCCNCC1 ZINC001206580072 1133722021 /nfs/dbraw/zinc/72/20/21/1133722021.db2.gz BXWFGMSHJKGTNI-MRXNPFEDSA-N 1 3 266.473 3.809 20 0 CHADHO CC(C)[N@@H+](CC1(C)CCCCC1)[C@@H]1CCCNCC1 ZINC001206580072 1133722023 /nfs/dbraw/zinc/72/20/23/1133722023.db2.gz BXWFGMSHJKGTNI-MRXNPFEDSA-N 1 3 266.473 3.809 20 0 CHADHO CC/C=C\CCCCC[N@@H+]1CCCC[C@@H](CN)C1 ZINC001206606558 1133727079 /nfs/dbraw/zinc/72/70/79/1133727079.db2.gz PGBZSSLSALYBKQ-QGZUEGPWSA-N 1 3 252.446 3.574 20 0 CHADHO CC/C=C\CCCCC[N@H+]1CCCC[C@@H](CN)C1 ZINC001206606558 1133727085 /nfs/dbraw/zinc/72/70/85/1133727085.db2.gz PGBZSSLSALYBKQ-QGZUEGPWSA-N 1 3 252.446 3.574 20 0 CHADHO NC[C@@H]1CCCC[N@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001206623857 1133729143 /nfs/dbraw/zinc/72/91/43/1133729143.db2.gz PORJTHMFKCKLBU-KRWDZBQOSA-N 1 3 294.442 3.914 20 0 CHADHO NC[C@@H]1CCCC[N@@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001206623857 1133729147 /nfs/dbraw/zinc/72/91/47/1133729147.db2.gz PORJTHMFKCKLBU-KRWDZBQOSA-N 1 3 294.442 3.914 20 0 CHADHO C[C@@H]1CC[C@H](CN)C[N@@H+]1C[C@H]1C[C@H]1c1ccc(Cl)cc1 ZINC001206761158 1133743126 /nfs/dbraw/zinc/74/31/26/1133743126.db2.gz VDYWENKSBOMRBF-SMKXDYDZSA-N 1 3 292.854 3.503 20 0 CHADHO C[C@@H]1CC[C@H](CN)C[N@H+]1C[C@H]1C[C@H]1c1ccc(Cl)cc1 ZINC001206761158 1133743127 /nfs/dbraw/zinc/74/31/27/1133743127.db2.gz VDYWENKSBOMRBF-SMKXDYDZSA-N 1 3 292.854 3.503 20 0 CHADHO C[C@H](CC[N@@H+]1C[C@@H](CN)CC[C@@H]1C)CC(C)(C)C ZINC001206760925 1133743244 /nfs/dbraw/zinc/74/32/44/1133743244.db2.gz OGMNEGGPDVROSS-QLFBSQMISA-N 1 3 254.462 3.508 20 0 CHADHO C[C@H](CC[N@H+]1C[C@@H](CN)CC[C@@H]1C)CC(C)(C)C ZINC001206760925 1133743246 /nfs/dbraw/zinc/74/32/46/1133743246.db2.gz OGMNEGGPDVROSS-QLFBSQMISA-N 1 3 254.462 3.508 20 0 CHADHO C[C@@H]1CC[C@@H](C[NH3+])CN1Cc1cccc2c(F)cccc12 ZINC001206811441 1133751775 /nfs/dbraw/zinc/75/17/75/1133751775.db2.gz UPSZZBCVTAQHJT-KGLIPLIRSA-N 1 3 286.394 3.538 20 0 CHADHO c1cc(N2CCN(CCCC3CCCCC3)CC2)cc[nH+]1 ZINC001207606047 1133829189 /nfs/dbraw/zinc/82/91/89/1133829189.db2.gz AIKYILDKMJTLPA-UHFFFAOYSA-N 1 3 287.451 3.564 20 0 CHADHO CN(C1CC1)C1CC[NH+](CCCCc2ccccc2)CC1 ZINC001207614878 1133833175 /nfs/dbraw/zinc/83/31/75/1133833175.db2.gz IJSRNOZDEORTIG-UHFFFAOYSA-N 1 3 286.463 3.568 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@H](C)CC1CCCC1 ZINC001207858542 1133854609 /nfs/dbraw/zinc/85/46/09/1133854609.db2.gz UDPAKOOZYURBOH-LSDHHAIUSA-N 1 3 254.462 3.665 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@@H]1CC(C)(C)C[C@H]1C ZINC001207857995 1133854961 /nfs/dbraw/zinc/85/49/61/1133854961.db2.gz AGYWAZYUQYBPCW-QLFBSQMISA-N 1 3 254.462 3.521 20 0 CHADHO CC1([NH+]2CCCC2)CCN(CCC2CCCC2)CC1 ZINC001208695728 1133929779 /nfs/dbraw/zinc/92/97/79/1133929779.db2.gz CZYWMXGRODCTGH-UHFFFAOYSA-N 1 3 264.457 3.517 20 0 CHADHO c1ccc(C2(CN3CCC([NH+]4CCC4)CC3)CCCC2)cc1 ZINC001208779348 1133945053 /nfs/dbraw/zinc/94/50/53/1133945053.db2.gz HLZPKNHOPYUCKB-UHFFFAOYSA-N 1 3 298.474 3.669 20 0 CHADHO Cc1nc2ccc(Nc3ccccc3C[NH+](C)C)cc2[nH]1 ZINC001213075119 1134420555 /nfs/dbraw/zinc/42/05/55/1134420555.db2.gz DXYAJNKVIPABEG-UHFFFAOYSA-N 1 3 280.375 3.677 20 0 CHADHO C[NH2+]Cc1cccc(Nc2ccnc(C3CC3)c2)c1F ZINC001216222967 1134811009 /nfs/dbraw/zinc/81/10/09/1134811009.db2.gz GAXLXNVARSDWKM-UHFFFAOYSA-N 1 3 271.339 3.561 20 0 CHADHO CC1=CC[C@H](CC[N@@H+]2CCC[C@@]23CCCNC3)C1(C)C ZINC001222230724 1135211853 /nfs/dbraw/zinc/21/18/53/1135211853.db2.gz CLCSMWHVEIMCFS-SJLPKXTDSA-N 1 3 276.468 3.587 20 0 CHADHO CC1=CC[C@H](CC[N@H+]2CCC[C@@]23CCCNC3)C1(C)C ZINC001222230724 1135211856 /nfs/dbraw/zinc/21/18/56/1135211856.db2.gz CLCSMWHVEIMCFS-SJLPKXTDSA-N 1 3 276.468 3.587 20 0 CHADHO c1c2ccccc2oc1CN1CCC[C@@]12CCC[NH2+]CC2 ZINC001222316429 1135224951 /nfs/dbraw/zinc/22/49/51/1135224951.db2.gz WDVBNZUPKDRAQU-GOSISDBHSA-N 1 3 284.403 3.541 20 0 CHADHO Cc1csc(CN2CCC3(CCC[NH2+]C3)CC2)c1Cl ZINC001222452446 1135244361 /nfs/dbraw/zinc/24/43/61/1135244361.db2.gz FTUQSXPFCMOSIO-UHFFFAOYSA-N 1 3 298.883 3.676 20 0 CHADHO CC1(CNCc2csc(Cl)c2Cl)CC[NH2+]CC1 ZINC000414896460 263104288 /nfs/dbraw/zinc/10/42/88/263104288.db2.gz BXDVXPCUWCXOOS-UHFFFAOYSA-N 1 3 293.263 3.534 20 0 CHADHO Cc1ccc(C)c([C@@H](C)NC2CC[NH+](C(C)C)CC2)c1 ZINC000020189245 171054772 /nfs/dbraw/zinc/05/47/72/171054772.db2.gz IIWXIWHQEWVPOU-MRXNPFEDSA-N 1 3 274.452 3.827 20 0 CHADHO CC[C@@H]([NH2+]CCCN1CCCC1)c1ccc(Cl)cc1 ZINC000020547288 171244823 /nfs/dbraw/zinc/24/48/23/171244823.db2.gz NHBFZXBOMMGDKE-MRXNPFEDSA-N 1 3 280.843 3.867 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)NCc1cccc(F)c1F ZINC000035223577 172068073 /nfs/dbraw/zinc/06/80/73/172068073.db2.gz LYGCSANMLFKYGR-CYBMUJFWSA-N 1 3 284.394 3.565 20 0 CHADHO Cc1ccccc1[C@H](C)[NH2+]C[C@H](C)CN1CCCCC1 ZINC000038041723 174042696 /nfs/dbraw/zinc/04/26/96/174042696.db2.gz CULGSRINXPTZGF-RDJZCZTQSA-N 1 3 274.452 3.768 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)c1cccc(F)c1)CN1CCCCC1 ZINC000038041854 174044606 /nfs/dbraw/zinc/04/46/06/174044606.db2.gz JHPQZGMGIGCPPT-GJZGRUSLSA-N 1 3 278.415 3.598 20 0 CHADHO C[NH+](C)C1CCC(N[C@H](c2ccco2)c2ccccc2)CC1 ZINC000353451694 228104682 /nfs/dbraw/zinc/10/46/82/228104682.db2.gz WXCURQHBGBPVQE-TVPLGVNVSA-N 1 3 298.430 3.831 20 0 CHADHO CC[NH+]1CCC(N[C@H]2CCC(C)(C)c3ccccc32)CC1 ZINC000038098032 260125639 /nfs/dbraw/zinc/12/56/39/260125639.db2.gz QYMHCJSGSNBIQH-SFHVURJKSA-N 1 3 286.463 3.873 20 0 CHADHO C1CCC2(C1)CCCC[C@H]2[NH2+][C@@H]1CCN2CCC[C@H]2C1 ZINC000312510718 260136034 /nfs/dbraw/zinc/13/60/34/260136034.db2.gz GQUPAMMYNXXQBC-IXDOHACOSA-N 1 3 276.468 3.706 20 0 CHADHO CC[C@@H](NC[C@H](C)C[NH+]1CCCC1)c1cccc(C)c1 ZINC000312830818 260209515 /nfs/dbraw/zinc/20/95/15/260209515.db2.gz UPMFFSXHEQJOEL-FUHWJXTLSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@@H]([NH2+]C[C@H](C)CN1CCCC1)c1cccc(C)c1 ZINC000312830818 260209516 /nfs/dbraw/zinc/20/95/16/260209516.db2.gz UPMFFSXHEQJOEL-FUHWJXTLSA-N 1 3 274.452 3.768 20 0 CHADHO C[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1cccc(C(F)(F)F)c1 ZINC000093213061 260273009 /nfs/dbraw/zinc/27/30/09/260273009.db2.gz MKFOVKFKLLIALN-BPNCWPANSA-N 1 3 286.341 3.626 20 0 CHADHO C[C@H]1CC[C@@H](NC[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc21 ZINC000126541025 260353960 /nfs/dbraw/zinc/35/39/60/260353960.db2.gz OVBOQTJATACSEQ-YZVOILCLSA-N 1 3 284.447 3.699 20 0 CHADHO C[C@H]1CC[C@@H](NC[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc21 ZINC000126541025 260353961 /nfs/dbraw/zinc/35/39/61/260353961.db2.gz OVBOQTJATACSEQ-YZVOILCLSA-N 1 3 284.447 3.699 20 0 CHADHO CCCC[C@H](CCC)[NH2+][C@H]1CCN2CCC[C@@H]2C1 ZINC000161610379 261098753 /nfs/dbraw/zinc/09/87/53/261098753.db2.gz BHKFMHSGXPIIIX-HRCADAONSA-N 1 3 252.446 3.562 20 0 CHADHO C[C@H](NCCCCC[NH+]1CCCCC1)c1ccco1 ZINC000164634901 261356166 /nfs/dbraw/zinc/35/61/66/261356166.db2.gz WQSHKTNRBHCLSJ-HNNXBMFYSA-N 1 3 264.413 3.586 20 0 CHADHO CN1CCC[C@@H]2C[N@H+](Cc3ccc(C(F)F)cc3)CC[C@@H]21 ZINC000183961106 262001713 /nfs/dbraw/zinc/00/17/13/262001713.db2.gz FETYAAXHJZPKBY-CVEARBPZSA-N 1 3 294.389 3.540 20 0 CHADHO CN1CCC[C@@H]2C[N@@H+](Cc3ccc(C(F)F)cc3)CC[C@@H]21 ZINC000183961106 262001714 /nfs/dbraw/zinc/00/17/14/262001714.db2.gz FETYAAXHJZPKBY-CVEARBPZSA-N 1 3 294.389 3.540 20 0 CHADHO CC(C)C[C@H](C)C[NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000499627020 262204475 /nfs/dbraw/zinc/20/44/75/262204475.db2.gz RETPPRISYJQMIG-GVDBMIGSSA-N 1 3 280.500 3.911 20 0 CHADHO CC(C)=CCN[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000188443829 262296856 /nfs/dbraw/zinc/29/68/56/262296856.db2.gz FAPVVGIBZKFGJF-AEFFLSMTSA-N 1 3 272.436 3.595 20 0 CHADHO CC(C)=CCN[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000188443829 262296857 /nfs/dbraw/zinc/29/68/57/262296857.db2.gz FAPVVGIBZKFGJF-AEFFLSMTSA-N 1 3 272.436 3.595 20 0 CHADHO CCC[C@H](NCCC[NH+]1CCCC1)c1ccccc1 ZINC000020555216 262301866 /nfs/dbraw/zinc/30/18/66/262301866.db2.gz BMZXKQMQXSPFEQ-KRWDZBQOSA-N 1 3 260.425 3.603 20 0 CHADHO CCC[C@H]([NH2+]CCCN1CCCC1)c1ccccc1 ZINC000020555216 262301867 /nfs/dbraw/zinc/30/18/67/262301867.db2.gz BMZXKQMQXSPFEQ-KRWDZBQOSA-N 1 3 260.425 3.603 20 0 CHADHO CC(C)[C@@H](C)[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000390782844 262346120 /nfs/dbraw/zinc/34/61/20/262346120.db2.gz UGKACKAREGMKCS-IEBWSBKVSA-N 1 3 288.479 3.923 20 0 CHADHO C[C@@H]1C[N@H+](C)CC[C@@H]1NCc1ccc(-c2ccccc2)cc1 ZINC000319700965 262350940 /nfs/dbraw/zinc/35/09/40/262350940.db2.gz TWZTVUHRUZIFTK-UZLBHIALSA-N 1 3 294.442 3.783 20 0 CHADHO C[C@@H]1C[N@@H+](C)CC[C@@H]1NCc1ccc(-c2ccccc2)cc1 ZINC000319700965 262350941 /nfs/dbraw/zinc/35/09/41/262350941.db2.gz TWZTVUHRUZIFTK-UZLBHIALSA-N 1 3 294.442 3.783 20 0 CHADHO Cc1ccc([C@@H]2CCC[N@H+]2C[C@@H](N)CC(C)C)s1 ZINC000414685985 263032394 /nfs/dbraw/zinc/03/23/94/263032394.db2.gz ADMRAPHIJKUZLQ-KBPBESRZSA-N 1 3 266.454 3.567 20 0 CHADHO Cc1ccc([C@@H]2CCC[N@@H+]2C[C@@H](N)CC(C)C)s1 ZINC000414685985 263032395 /nfs/dbraw/zinc/03/23/95/263032395.db2.gz ADMRAPHIJKUZLQ-KBPBESRZSA-N 1 3 266.454 3.567 20 0 CHADHO CCN(Cc1ccc(C2CC2)cc1)[C@@H]1CCC[NH2+]CC1 ZINC000414711272 263033785 /nfs/dbraw/zinc/03/37/85/263033785.db2.gz HMZQDTITBUBAOU-GOSISDBHSA-N 1 3 272.436 3.528 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2CN)C[C@@H](c2ccccc2)C1 ZINC000414794863 263049748 /nfs/dbraw/zinc/04/97/48/263049748.db2.gz FYTZWUWLTKZVOO-YCVVXREPSA-N 1 3 286.463 3.676 20 0 CHADHO Cc1ccc(CNCc2ccc([C@H](C)[NH3+])cc2)cc1C ZINC000414804056 263051752 /nfs/dbraw/zinc/05/17/52/263051752.db2.gz DRVPAEFKMCGXGZ-HNNXBMFYSA-N 1 3 268.404 3.613 20 0 CHADHO CC1(c2ccccc2)CCC([NH2+][C@H]2CCC[C@@H]2CN)CC1 ZINC000414807067 263052170 /nfs/dbraw/zinc/05/21/70/263052170.db2.gz QRJLICGQVIIAEB-IZIZEDOESA-N 1 3 286.463 3.604 20 0 CHADHO C[C@H](N)CC[NH2+][C@H](CCc1ccccc1)Cc1ccccc1 ZINC000414817312 263054085 /nfs/dbraw/zinc/05/40/85/263054085.db2.gz AOSOAVFBQDISQE-FXAWDEMLSA-N 1 3 296.458 3.557 20 0 CHADHO c1ccc([C@@H]2CCCC[C@H]([NH2+]C[C@H]3CCCNC3)C2)cc1 ZINC000414825741 263055723 /nfs/dbraw/zinc/05/57/23/263055723.db2.gz HPDHGNGXQUAZEM-UHOSZYNNSA-N 1 3 286.463 3.692 20 0 CHADHO CC1(CNCc2c(Cl)oc3ccccc32)CC[NH2+]CC1 ZINC000414895992 263104231 /nfs/dbraw/zinc/10/42/31/263104231.db2.gz AINPGSBFLGWSQU-UHFFFAOYSA-N 1 3 292.810 3.566 20 0 CHADHO CCC[C@H](C[NH2+]C[C@@]1(C)CCCNC1)c1ccccc1 ZINC000414903797 263111393 /nfs/dbraw/zinc/11/13/93/263111393.db2.gz MFLAODPAZXKJMM-MSOLQXFVSA-N 1 3 274.452 3.550 20 0 CHADHO C[C@@H](CC(C)(C)c1ccccc1)[NH2+]C[C@@]1(C)CCCNC1 ZINC000414906058 263112969 /nfs/dbraw/zinc/11/29/69/263112969.db2.gz LYFVHWNHYHCROA-LPHOPBHVSA-N 1 3 288.479 3.722 20 0 CHADHO C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@@H]2CCCNCC2)C1 ZINC000414910698 263117219 /nfs/dbraw/zinc/11/72/19/263117219.db2.gz FXKIRCRTTZYGMD-AITUJVMLSA-N 1 3 286.463 3.691 20 0 CHADHO CCSc1cccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)c1 ZINC000293606904 263144146 /nfs/dbraw/zinc/14/41/46/263144146.db2.gz JBNYRYBAOBRFDL-MQVJKMGUSA-N 1 3 290.476 3.513 20 0 CHADHO CCC[C@H](C)C[NH2+]C[C@@H]1CNCC[C@@H]1c1ccc(F)cc1 ZINC000415010451 263244840 /nfs/dbraw/zinc/24/48/40/263244840.db2.gz UWGULFXSWFIFHP-QILLFSRXSA-N 1 3 292.442 3.545 20 0 CHADHO C[C@H](CCCC[NH3+])NCc1ccc(Cl)cc1Cl ZINC000415013822 263254879 /nfs/dbraw/zinc/25/48/79/263254879.db2.gz LEERWCKOXRYXGQ-SNVBAGLBSA-N 1 3 275.223 3.601 20 0 CHADHO C[C@H](CCCC[NH3+])NCc1c(Cl)cccc1Cl ZINC000415013816 263254952 /nfs/dbraw/zinc/25/49/52/263254952.db2.gz LCSSFQVFINAMHQ-SNVBAGLBSA-N 1 3 275.223 3.601 20 0 CHADHO C[C@@H](CCCC[NH3+])NCc1c(Cl)oc2ccccc21 ZINC000415016446 263255693 /nfs/dbraw/zinc/25/56/93/263255693.db2.gz PRIJFCYMDXOWGX-NSHDSACASA-N 1 3 280.799 3.693 20 0 CHADHO [NH3+]C[C@H]1CC[C@@H](NCc2ccc(-c3ccccc3)cc2F)C1 ZINC000415029149 263256378 /nfs/dbraw/zinc/25/63/78/263256378.db2.gz DJCNOHGSFJOPCJ-KBXCAEBGSA-N 1 3 298.405 3.710 20 0 CHADHO c1cc(C2CC2)ccc1CN1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000415041068 263257340 /nfs/dbraw/zinc/25/73/40/263257340.db2.gz KVFUGSVVCPMQFV-OALUTQOASA-N 1 3 284.447 3.528 20 0 CHADHO CCOc1cccc(CN[C@H](CCC[NH3+])c2ccccc2)c1 ZINC000415044751 263257853 /nfs/dbraw/zinc/25/78/53/263257853.db2.gz BVEOEKFGZXBWNK-LJQANCHMSA-N 1 3 298.430 3.655 20 0 CHADHO Clc1ccc([C@@H]2CCC[C@@H]2[NH2+]CCCNC2CC2)cc1 ZINC000415064642 263259676 /nfs/dbraw/zinc/25/96/76/263259676.db2.gz DFSDOSIQBHRNAF-IRXDYDNUSA-N 1 3 292.854 3.708 20 0 CHADHO CC[C@H](N[C@@H]1CCC[C@H]1C[NH3+])c1ccc(Cl)cc1 ZINC000251112342 264270652 /nfs/dbraw/zinc/27/06/52/264270652.db2.gz UNFMLHQVANSRCL-AEGPPILISA-N 1 3 266.816 3.508 20 0 CHADHO C[NH+](C)C1CCN([C@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC000189696440 264322830 /nfs/dbraw/zinc/32/28/30/264322830.db2.gz UBGHWNPLZIJGBQ-RBUKOAKNSA-N 1 3 286.463 3.523 20 0 CHADHO CC(C)CN1CCC[C@@H](C[NH2+]C2CCC3(CC3)CC2)C1 ZINC000362928553 267062669 /nfs/dbraw/zinc/06/26/69/267062669.db2.gz UFGHPAMNAAWHAC-INIZCTEOSA-N 1 3 278.484 3.667 20 0 CHADHO Cc1ccccc1C[C@H]([NH2+][C@@H]1CCN2CCC[C@H]2C1)C1CC1 ZINC000370534158 267326735 /nfs/dbraw/zinc/32/67/35/267326735.db2.gz RFULLVQBNROCHS-AABGKKOBSA-N 1 3 298.474 3.533 20 0 CHADHO Cc1ccccc1C[C@H](N[C@@H]1CC[N@@H+]2CCC[C@H]2C1)C1CC1 ZINC000370534158 267326737 /nfs/dbraw/zinc/32/67/37/267326737.db2.gz RFULLVQBNROCHS-AABGKKOBSA-N 1 3 298.474 3.533 20 0 CHADHO Cc1ccccc1C[C@H](N[C@@H]1CC[N@H+]2CCC[C@H]2C1)C1CC1 ZINC000370534158 267326740 /nfs/dbraw/zinc/32/67/40/267326740.db2.gz RFULLVQBNROCHS-AABGKKOBSA-N 1 3 298.474 3.533 20 0 CHADHO CC[C@H](C)[C@@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000580226045 327740676 /nfs/dbraw/zinc/74/06/76/327740676.db2.gz MCHFVVOWTRKWCL-LSDHHAIUSA-N 1 3 266.473 3.808 20 0 CHADHO CC[N@@H+]1CC[C@H](NCc2cc3ccccc3s2)[C@@H](C)C1 ZINC000571304574 328101250 /nfs/dbraw/zinc/10/12/50/328101250.db2.gz SMMXWYZKPIEGMN-BBRMVZONSA-N 1 3 288.460 3.721 20 0 CHADHO CC[N@H+]1CC[C@H](NCc2cc3ccccc3s2)[C@@H](C)C1 ZINC000571304574 328101251 /nfs/dbraw/zinc/10/12/51/328101251.db2.gz SMMXWYZKPIEGMN-BBRMVZONSA-N 1 3 288.460 3.721 20 0 CHADHO CC[NH+]1CCC(CNCc2ccc(-c3ccccc3)o2)CC1 ZINC000571308612 328102999 /nfs/dbraw/zinc/10/29/99/328102999.db2.gz OEMOTHXCCAOZQH-UHFFFAOYSA-N 1 3 298.430 3.768 20 0 CHADHO CC(C)[C@H]([NH3+])CN[C@@H]1CCC[C@H]1c1ccccc1Cl ZINC000414789137 328225706 /nfs/dbraw/zinc/22/57/06/328225706.db2.gz FBKWTFCMBGRBPM-NUEKZKHPSA-N 1 3 280.843 3.549 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@H](C)c1cccc(C2CC2)c1 ZINC000340208693 328247878 /nfs/dbraw/zinc/24/78/78/328247878.db2.gz FYQHBKVCUNDEMK-ZIAGYGMSSA-N 1 3 260.425 3.555 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](CNCc2c(Cl)oc3ccccc32)C1 ZINC000414995357 328290644 /nfs/dbraw/zinc/29/06/44/328290644.db2.gz FLKAVNQHRMWJEU-NWDGAFQWSA-N 1 3 292.810 3.693 20 0 CHADHO C[C@@H]1C[C@H](N[C@@H]2CCCc3ccc(Cl)cc32)CC[N@@H+]1C ZINC000534972179 328372245 /nfs/dbraw/zinc/37/22/45/328372245.db2.gz LIZKAWCPXGJDBL-SRCQZFHVSA-N 1 3 292.854 3.790 20 0 CHADHO C[C@@H]1C[C@H](N[C@@H]2CCCc3ccc(Cl)cc32)CC[N@H+]1C ZINC000534972179 328372246 /nfs/dbraw/zinc/37/22/46/328372246.db2.gz LIZKAWCPXGJDBL-SRCQZFHVSA-N 1 3 292.854 3.790 20 0 CHADHO C[C@@H](CC(C)(C)C)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000394997301 328590265 /nfs/dbraw/zinc/59/02/65/328590265.db2.gz DLPCUUVBWGIJBG-LBPRGKRZSA-N 1 3 254.462 3.710 20 0 CHADHO CC(C)c1ccc([C@H](C)N2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)cc1 ZINC000261721555 327035198 /nfs/dbraw/zinc/03/51/98/327035198.db2.gz KGSXJCNNIYCPGI-VIBAHUMZSA-N 1 3 272.436 3.540 20 0 CHADHO COc1ccccc1[C@H](CC(C)C)N[C@@H]1CCC[C@H]([NH3+])C1 ZINC000565843267 327035580 /nfs/dbraw/zinc/03/55/80/327035580.db2.gz LWSLUZGUCUWSEO-UXLLHSPISA-N 1 3 290.451 3.642 20 0 CHADHO CC[C@@H]([NH2+]CC1CCN(C)CC1)c1ccc(Cl)s1 ZINC000126376884 327104995 /nfs/dbraw/zinc/10/49/95/327104995.db2.gz XVHLBCGAGUUZBL-GFCCVEGCSA-N 1 3 286.872 3.784 20 0 CHADHO CC[NH+](CC)C[C@H]1CCN([C@@H]2C=CCCCCC2)C1 ZINC000559105653 327141348 /nfs/dbraw/zinc/14/13/48/327141348.db2.gz GGYKWJKXNQANIX-IAGOWNOFSA-N 1 3 264.457 3.539 20 0 CHADHO CCN(CC)C[C@H]1CC[N@@H+]([C@@H]2C=CCCCCC2)C1 ZINC000559105653 327141350 /nfs/dbraw/zinc/14/13/50/327141350.db2.gz GGYKWJKXNQANIX-IAGOWNOFSA-N 1 3 264.457 3.539 20 0 CHADHO CCN(CC)C[C@H]1CC[N@H+]([C@@H]2C=CCCCCC2)C1 ZINC000559105653 327141352 /nfs/dbraw/zinc/14/13/52/327141352.db2.gz GGYKWJKXNQANIX-IAGOWNOFSA-N 1 3 264.457 3.539 20 0 CHADHO C[C@@H](c1ccccc1Cl)N(C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000261567164 327142477 /nfs/dbraw/zinc/14/24/77/327142477.db2.gz HPUOHNFHOKPNHY-HZSPNIEDSA-N 1 3 280.843 3.721 20 0 CHADHO CC(C)(C)CCC[N@@H+]1CC[C@H](CN2CCCCC2)C1 ZINC000410388805 327190824 /nfs/dbraw/zinc/19/08/24/327190824.db2.gz SGUXFKFLNHIRRF-MRXNPFEDSA-N 1 3 266.473 3.621 20 0 CHADHO CC(C)(C)CCC[N@H+]1CC[C@H](CN2CCCCC2)C1 ZINC000410388805 327190826 /nfs/dbraw/zinc/19/08/26/327190826.db2.gz SGUXFKFLNHIRRF-MRXNPFEDSA-N 1 3 266.473 3.621 20 0 CHADHO CC(C)(C)CCCN1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000410388805 327190827 /nfs/dbraw/zinc/19/08/27/327190827.db2.gz SGUXFKFLNHIRRF-MRXNPFEDSA-N 1 3 266.473 3.621 20 0 CHADHO C[NH+](C)CCCC1CCN(CCCCC(F)(F)F)CC1 ZINC000123525376 327243191 /nfs/dbraw/zinc/24/31/91/327243191.db2.gz WMAMLKKVIMTIGK-UHFFFAOYSA-N 1 3 294.405 3.773 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@@H]1N[C@@H](CC(C)(C)C)c1ccccc1 ZINC000261807159 327352950 /nfs/dbraw/zinc/35/29/50/327352950.db2.gz RWULJKZPYOXVNA-PVAVHDDUSA-N 1 3 274.452 3.752 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H](CC(C)(C)C)c1ccccc1 ZINC000261807159 327352952 /nfs/dbraw/zinc/35/29/52/327352952.db2.gz RWULJKZPYOXVNA-PVAVHDDUSA-N 1 3 274.452 3.752 20 0 CHADHO CC(C)CN1CCC([NH2+][C@H](C)c2ccsc2)CC1 ZINC000177836939 329192882 /nfs/dbraw/zinc/19/28/82/329192882.db2.gz SOUVSRJLNXJQGZ-CYBMUJFWSA-N 1 3 266.454 3.519 20 0 CHADHO CSCCCCC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000186782665 329348700 /nfs/dbraw/zinc/34/87/00/329348700.db2.gz NVTBFOFTQOXOFP-UHFFFAOYSA-N 1 3 298.540 3.906 20 0 CHADHO CC[C@@H]([NH2+]C[C@H](C)CN1CCCCC1)c1cccs1 ZINC000038041905 329354843 /nfs/dbraw/zinc/35/48/43/329354843.db2.gz FUZITBBRBCARQU-LSDHHAIUSA-N 1 3 280.481 3.911 20 0 CHADHO CC[C@H]([NH2+]C[C@@H](C)CN1CCCCC1)c1cccs1 ZINC000038041902 329354939 /nfs/dbraw/zinc/35/49/39/329354939.db2.gz FUZITBBRBCARQU-CABCVRRESA-N 1 3 280.481 3.911 20 0 CHADHO CSc1ccc(CN2CCC(CC[NH+](C)C)CC2)cc1 ZINC000056524103 329676360 /nfs/dbraw/zinc/67/63/60/329676360.db2.gz GTAVAPANIHYPTR-UHFFFAOYSA-N 1 3 292.492 3.572 20 0 CHADHO Clc1ccc([C@H](NC[C@@H]2CC[NH2+]C2)C2CCCC2)cc1 ZINC000420406850 329764180 /nfs/dbraw/zinc/76/41/80/329764180.db2.gz OCICXRYFYIDPQV-CXAGYDPISA-N 1 3 292.854 3.770 20 0 CHADHO C[NH2+]CCC1CCN(C[C@H](C)c2cccc(Cl)c2)CC1 ZINC000261799860 329984143 /nfs/dbraw/zinc/98/41/43/329984143.db2.gz GWMWIGRVNOKBEC-AWEZNQCLSA-N 1 3 294.870 3.765 20 0 CHADHO CC1CCN(CCC[NH2+][C@H]2CC[C@@H]2C(C)(C)C)CC1 ZINC000580479791 330146957 /nfs/dbraw/zinc/14/69/57/330146957.db2.gz HUYYPKZFUJNTLL-HOTGVXAUSA-N 1 3 266.473 3.523 20 0 CHADHO CC[C@H](N[C@@H](C)C[C@@H](C)[NH3+])c1cccc(Cl)c1 ZINC000422853785 330157524 /nfs/dbraw/zinc/15/75/24/330157524.db2.gz CGSRYKIIPPFYLQ-SUNKGSAMSA-N 1 3 254.805 3.507 20 0 CHADHO c1cc(CN2CCCC[C@H]2[C@@H]2CC[NH2+]C2)cc(C2CC2)c1 ZINC000422550834 330148990 /nfs/dbraw/zinc/14/89/90/330148990.db2.gz BZTDUNDNWPOYME-MOPGFXCFSA-N 1 3 284.447 3.528 20 0 CHADHO CC(C)(CCN)[NH2+]CC1CCC(c2ccccc2)CC1 ZINC000422554430 330149112 /nfs/dbraw/zinc/14/91/12/330149112.db2.gz MLWKOVNBEWRCRK-UHFFFAOYSA-N 1 3 274.452 3.677 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@@H]1CCCC[C@@H]1Cc1ccccc1 ZINC000422710417 330151394 /nfs/dbraw/zinc/15/13/94/330151394.db2.gz LFRNFSVKAUSAAO-CWLKWCNXSA-N 1 3 274.452 3.503 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H]1CCCC[C@@H]1C(C)C ZINC000422708668 330151506 /nfs/dbraw/zinc/15/15/06/330151506.db2.gz CEWSQDCMCVLUIG-LESCRADOSA-N 1 3 289.467 3.714 20 0 CHADHO CC[C@H](CN[C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1)c1ccccc1 ZINC000422716502 330151741 /nfs/dbraw/zinc/15/17/41/330151741.db2.gz NHVCXZNQUJBSGI-NXWXRZEISA-N 1 3 286.463 3.691 20 0 CHADHO CC[C@H](Cc1ccccc1)N[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422713897 330151837 /nfs/dbraw/zinc/15/18/37/330151837.db2.gz QCPGGXJQSHCQPV-MNEFBYGVSA-N 1 3 280.415 3.742 20 0 CHADHO CC[C@H](CN[C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1)c1ccccc1 ZINC000422716504 330151925 /nfs/dbraw/zinc/15/19/25/330151925.db2.gz NHVCXZNQUJBSGI-OQIJWPOYSA-N 1 3 286.463 3.691 20 0 CHADHO C[C@H](CN[C@@H]1C[C@H]([NH3+])c2ccccc21)c1ccc(F)cc1 ZINC000422739820 330152894 /nfs/dbraw/zinc/15/28/94/330152894.db2.gz LXMGZKJQMNSKOO-OCBCSQNSSA-N 1 3 284.378 3.664 20 0 CHADHO C[C@H](N[C@@H](c1ccc(Cl)cc1)C1CCCC1)C1C[NH2+]C1 ZINC000422746913 330153052 /nfs/dbraw/zinc/15/30/52/330153052.db2.gz XNBPABYFHONOKZ-YVEFUNNKSA-N 1 3 292.854 3.769 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@H](C)CCC(C)(C)C ZINC000422749881 330153311 /nfs/dbraw/zinc/15/33/11/330153311.db2.gz BHZYQFRUYOMGIK-CHWSQXEVSA-N 1 3 277.456 3.714 20 0 CHADHO [NH3+][C@H]1CCCCC[C@@H]1NCC1(c2cccc(Cl)c2)CC1 ZINC000422757997 330153570 /nfs/dbraw/zinc/15/35/70/330153570.db2.gz DMBVTDWNOAZGFY-HOTGVXAUSA-N 1 3 292.854 3.621 20 0 CHADHO Cc1ccc([C@H](C)CN[C@@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000422756277 330153664 /nfs/dbraw/zinc/15/36/64/330153664.db2.gz GSTPSQQHCKQJCC-NIKGAXFTSA-N 1 3 280.415 3.833 20 0 CHADHO C[C@@H](N)C[C@@H](C)[NH2+]CC1(c2ccc(F)cc2)CCCCC1 ZINC000422761000 330153698 /nfs/dbraw/zinc/15/36/98/330153698.db2.gz MDKTYAWMWHPZRK-HUUCEWRRSA-N 1 3 292.442 3.743 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCC1(c2ccc(F)cc2)CCCCC1 ZINC000422761000 330153700 /nfs/dbraw/zinc/15/37/00/330153700.db2.gz MDKTYAWMWHPZRK-HUUCEWRRSA-N 1 3 292.442 3.743 20 0 CHADHO C[C@H](CCC[NH3+])N[C@@H](C)c1cccc(Cl)c1Cl ZINC000422756312 330153756 /nfs/dbraw/zinc/15/37/56/330153756.db2.gz HUNFVJFCDVAAFJ-ZJUUUORDSA-N 1 3 275.223 3.771 20 0 CHADHO Clc1ccc([C@@H](N[C@H]2CCC[NH2+]CC2)C2CC2)cc1 ZINC000422761693 330154009 /nfs/dbraw/zinc/15/40/09/330154009.db2.gz MCDXQLAFRCRDOI-HOTGVXAUSA-N 1 3 278.827 3.523 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@H](c1ccccc1)C1CCCC1 ZINC000422777752 330154488 /nfs/dbraw/zinc/15/44/88/330154488.db2.gz GLVISXKGVXGUEP-GRDNDAEWSA-N 1 3 260.425 3.633 20 0 CHADHO Cc1cccc([C@H](C)CN[C@@H]2C[C@@H]([NH3+])c3ccccc32)c1 ZINC000422778824 330154730 /nfs/dbraw/zinc/15/47/30/330154730.db2.gz HUVHBDIIIAZSPY-NIKGAXFTSA-N 1 3 280.415 3.833 20 0 CHADHO Cc1cccc([C@H](C)CN[C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)c1 ZINC000422786747 330155359 /nfs/dbraw/zinc/15/53/59/330155359.db2.gz QQFGRVNYTHPARA-QXCFHYIPSA-N 1 3 286.463 3.609 20 0 CHADHO Cc1cccc(CN[C@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC000422810150 330156217 /nfs/dbraw/zinc/15/62/17/330156217.db2.gz SVUIWHPJCHEZHY-OALUTQOASA-N 1 3 280.415 3.578 20 0 CHADHO CCCC[C@H](CCC)[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000422841003 330157152 /nfs/dbraw/zinc/15/71/52/330157152.db2.gz UZUBBECBQPXECF-ZFWWWQNUSA-N 1 3 277.456 3.858 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]C[C@@H](Cc1ccccc1)c1ccccc1 ZINC000422839984 330157268 /nfs/dbraw/zinc/15/72/68/330157268.db2.gz RTLQRGXJSUUSSQ-ABSDTBQOSA-N 1 3 296.458 3.728 20 0 CHADHO CC(C)(C[NH2+][C@@H]1CCC[C@H]1CN)Cc1cccc(Cl)c1 ZINC000422872562 330158351 /nfs/dbraw/zinc/15/83/51/330158351.db2.gz HOWQBFQYVOKHBA-GOEBONIOSA-N 1 3 294.870 3.626 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC(C)(C)CC(C)C ZINC000422917400 330160298 /nfs/dbraw/zinc/16/02/98/330160298.db2.gz DQOYQTVPNQBMTR-ZDUSSCGKSA-N 1 3 277.456 3.572 20 0 CHADHO [NH3+][C@H]1CCCCC[C@@H]1NCCc1ccc2ccccc2c1 ZINC000422950981 330163829 /nfs/dbraw/zinc/16/38/29/330163829.db2.gz ZHDZWLVNSQIWHU-OALUTQOASA-N 1 3 282.431 3.632 20 0 CHADHO c1ccc([C@H]2C[C@H](N[C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)C2)cc1 ZINC000422968666 330164440 /nfs/dbraw/zinc/16/44/40/330164440.db2.gz RTRBKUSCIKASKP-LTFPLMDUSA-N 1 3 298.474 3.833 20 0 CHADHO C[C@H](N[C@H]1CC[C@@H](C)c2ccccc21)[C@H]1CCC[NH2+]C1 ZINC000423005412 330164927 /nfs/dbraw/zinc/16/49/27/330164927.db2.gz RZTCMMGZRKFMHP-LLDVTBCESA-N 1 3 272.436 3.603 20 0 CHADHO C[C@H]([NH2+][C@H]1CC[C@@H](C)c2ccccc21)[C@H]1CCCNC1 ZINC000423005412 330164928 /nfs/dbraw/zinc/16/49/28/330164928.db2.gz RZTCMMGZRKFMHP-LLDVTBCESA-N 1 3 272.436 3.603 20 0 CHADHO [NH3+][C@@H]1C[C@H](NCCC2Cc3ccccc3C2)c2ccccc21 ZINC000423017752 330165332 /nfs/dbraw/zinc/16/53/32/330165332.db2.gz WZXYFQBRDKSCFD-UXHICEINSA-N 1 3 292.426 3.526 20 0 CHADHO CC1(CN[C@H]2C[C@H]([NH3+])c3ccccc32)Cc2ccccc2C1 ZINC000423019001 330165812 /nfs/dbraw/zinc/16/58/12/330165812.db2.gz STHSLPCRMIXBDD-OALUTQOASA-N 1 3 292.426 3.526 20 0 CHADHO C[C@@H]([NH2+]C1CCC(c2ccc(F)cc2)CC1)[C@@H]1CCCN1 ZINC000423027069 330165943 /nfs/dbraw/zinc/16/59/43/330165943.db2.gz CVCSWZTZZDUXJM-YPCVUPECSA-N 1 3 290.426 3.582 20 0 CHADHO C[C@H]([NH2+]C1CCC(c2ccc(F)cc2)CC1)[C@@H]1CCCN1 ZINC000423027066 330165968 /nfs/dbraw/zinc/16/59/68/330165968.db2.gz CVCSWZTZZDUXJM-HKFAYQRXSA-N 1 3 290.426 3.582 20 0 CHADHO C[C@@H]([NH2+]C1CCC(c2ccc(F)cc2)CC1)[C@H]1CCCN1 ZINC000423027068 330166098 /nfs/dbraw/zinc/16/60/98/330166098.db2.gz CVCSWZTZZDUXJM-WGDNJCCTSA-N 1 3 290.426 3.582 20 0 CHADHO c1ccc(-c2ccc3c(c2)[C@@H]([NH2+]C2CCNCC2)CC3)cc1 ZINC000423064183 330167999 /nfs/dbraw/zinc/16/79/99/330167999.db2.gz QUVUQHLUXSHRHQ-FQEVSTJZSA-N 1 3 292.426 3.683 20 0 CHADHO C[C@@H](N[C@@H](C)c1cc2ccccc2s1)[C@@H]1CCC[NH2+]C1 ZINC000423063221 330168025 /nfs/dbraw/zinc/16/80/25/330168025.db2.gz WAHNGQMGLQRNDK-VNHYZAJKSA-N 1 3 288.460 3.940 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)c1cc2ccccc2s1)[C@@H]1CCCNC1 ZINC000423063221 330168026 /nfs/dbraw/zinc/16/80/26/330168026.db2.gz WAHNGQMGLQRNDK-VNHYZAJKSA-N 1 3 288.460 3.940 20 0 CHADHO C[C@H]1CCNCC[C@H]1[NH2+]CCCCCc1ccc(F)cc1 ZINC000423064561 330168040 /nfs/dbraw/zinc/16/80/40/330168040.db2.gz RSIPLRNHGMVKAN-MAUKXSAKSA-N 1 3 292.442 3.516 20 0 CHADHO C[C@@H](C[C@H]1CCCCC[NH2+]1)NCCc1ccc2[nH]ccc2c1 ZINC000423096654 330169761 /nfs/dbraw/zinc/16/97/61/330169761.db2.gz HXCLIBGKTHLOSW-MAUKXSAKSA-N 1 3 299.462 3.611 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H]1N[C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000423100586 330170126 /nfs/dbraw/zinc/17/01/26/330170126.db2.gz MYUBHDWBKQKRKO-FKGLVLAHSA-N 1 3 299.245 3.709 20 0 CHADHO NC[C@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423099405 330170263 /nfs/dbraw/zinc/17/02/63/330170263.db2.gz UCXFKMOWZMYLLY-SRABZTEZSA-N 1 3 292.854 3.693 20 0 CHADHO CC1(c2ccccc2)CC(N[C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)C1 ZINC000423102167 330170371 /nfs/dbraw/zinc/17/03/71/330170371.db2.gz OEFXCLGWBSTMJX-HWRPDCHHSA-N 1 3 298.474 3.617 20 0 CHADHO c1ccc([C@H](CN[C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)C2CC2)cc1 ZINC000423122790 330171342 /nfs/dbraw/zinc/17/13/42/330171342.db2.gz CZULOODJUZLJSF-VNTMZGSJSA-N 1 3 298.474 3.691 20 0 CHADHO C[C@H](N[C@@H](C)[C@H]1CC[NH2+]C1)c1ccc(F)c2ccccc21 ZINC000423123682 330171366 /nfs/dbraw/zinc/17/13/66/330171366.db2.gz LOLJCFCTIQFQIE-IHRRRGAJSA-N 1 3 286.394 3.628 20 0 CHADHO C[C@@H](N[C@@H](C)c1ccc(F)c2ccccc21)[C@H]1CC[NH2+]C1 ZINC000423123684 330171420 /nfs/dbraw/zinc/17/14/20/330171420.db2.gz LOLJCFCTIQFQIE-RDBSUJKOSA-N 1 3 286.394 3.628 20 0 CHADHO c1ccc([C@@H]2C[C@H]2C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCCN2)cc1 ZINC000423138455 330172356 /nfs/dbraw/zinc/17/23/56/330172356.db2.gz STYZJRVKVNKCIL-WKWVNEEDSA-N 1 3 298.474 3.691 20 0 CHADHO c1ccc([C@@H]2CCCC[C@H]2CNC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000423153590 330173079 /nfs/dbraw/zinc/17/30/79/330173079.db2.gz HZNODBMRWLHLGL-BYDNXPSSSA-N 1 3 298.474 3.833 20 0 CHADHO Clc1cccc([C@@H]2CC[C@H]([NH2+][C@H]3CCCNCC3)C2)c1 ZINC000423165820 330173992 /nfs/dbraw/zinc/17/39/92/330173992.db2.gz QJVMJPYPRYTHHE-PVAVHDDUSA-N 1 3 292.854 3.708 20 0 CHADHO NC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000423170962 330174478 /nfs/dbraw/zinc/17/44/78/330174478.db2.gz ZCFFOLYRRNUVEG-OTRWWLKZSA-N 1 3 292.854 3.693 20 0 CHADHO C[C@H](N[C@@H]1CC[C@H](c2ccc(Cl)cc2)C1)[C@H]1CC[NH2+]C1 ZINC000423175854 330174726 /nfs/dbraw/zinc/17/47/26/330174726.db2.gz FKVHMTXMFYOIRR-NZUILWFCSA-N 1 3 292.854 3.564 20 0 CHADHO CC[C@@H]([NH2+]CC1(N)CCCCC1)c1ccc(F)cc1 ZINC000423176802 330175076 /nfs/dbraw/zinc/17/50/76/330175076.db2.gz HXAOFGIZGRYBSA-OAHLLOKOSA-N 1 3 264.388 3.528 20 0 CHADHO C[C@H](CCc1ccc(F)cc1F)NCC1([NH3+])CCCCC1 ZINC000423187248 330175728 /nfs/dbraw/zinc/17/57/28/330175728.db2.gz XPPPYQIUJDZPBQ-CYBMUJFWSA-N 1 3 296.405 3.537 20 0 CHADHO CC(C)[C@@H]1C[C@H](N[C@H](C)[C@H]2CCC[NH2+]C2)c2ccccc21 ZINC000423206299 330177318 /nfs/dbraw/zinc/17/73/18/330177318.db2.gz BRWQXPMFISCLDO-PDWMJMLSSA-N 1 3 286.463 3.849 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2N[C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000423211850 330178095 /nfs/dbraw/zinc/17/80/95/330178095.db2.gz HLBFDCNLNUOJNU-DLTWYDFYSA-N 1 3 272.436 3.521 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+][C@@H](C)[C@@H]1CCCNC1 ZINC000423211850 330178097 /nfs/dbraw/zinc/17/80/97/330178097.db2.gz HLBFDCNLNUOJNU-DLTWYDFYSA-N 1 3 272.436 3.521 20 0 CHADHO Fc1ccc([C@@H](NC[C@@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC000423212724 330178232 /nfs/dbraw/zinc/17/82/32/330178232.db2.gz MEPRFVCUHALLFP-KDOFPFPSSA-N 1 3 290.426 3.646 20 0 CHADHO Fc1ccc([C@@H]([NH2+]C[C@@H]2CCCNC2)C2CCCC2)cc1 ZINC000423212724 330178233 /nfs/dbraw/zinc/17/82/33/330178233.db2.gz MEPRFVCUHALLFP-KDOFPFPSSA-N 1 3 290.426 3.646 20 0 CHADHO CC(C)[C@@H](CCc1ccc(Cl)cc1)[NH2+]CC[C@H](C)N ZINC000423223068 330179935 /nfs/dbraw/zinc/17/99/35/330179935.db2.gz DREYZZYAPXXQIH-XJKSGUPXSA-N 1 3 282.859 3.624 20 0 CHADHO C[C@H]([NH3+])CCN[C@@H](C)c1ccc(-c2cccs2)cc1 ZINC000423224862 330179939 /nfs/dbraw/zinc/17/99/39/330179939.db2.gz CYEBHTGNQJMXRC-STQMWFEESA-N 1 3 274.433 3.803 20 0 CHADHO C[C@@H]([NH3+])CCN[C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423224628 330180103 /nfs/dbraw/zinc/18/01/03/330180103.db2.gz JQHLXEASRDPOKZ-ABAIWWIYSA-N 1 3 266.816 3.508 20 0 CHADHO C[C@H]([NH3+])CCN[C@@H](C)c1ccc(-c2ccccc2)s1 ZINC000423227413 330180357 /nfs/dbraw/zinc/18/03/57/330180357.db2.gz VPBIRUYWBQSDNE-STQMWFEESA-N 1 3 274.433 3.803 20 0 CHADHO C[C@@H](NCC[C@H](C)[NH3+])c1cccc(OCc2ccccc2)c1 ZINC000423225841 330180511 /nfs/dbraw/zinc/18/05/11/330180511.db2.gz OKWWPFBFDFJMQX-JKSUJKDBSA-N 1 3 298.430 3.654 20 0 CHADHO CC(C)[C@H]([NH2+]CC(C)(C)N)c1cccc(C(F)(F)F)c1 ZINC000423281367 330185310 /nfs/dbraw/zinc/18/53/10/330185310.db2.gz BCFMLUBALHJURN-ZDUSSCGKSA-N 1 3 288.357 3.729 20 0 CHADHO C[C@H]([NH2+]CC(C)(C)N)c1ccc(-c2ccccc2F)s1 ZINC000423287473 330185963 /nfs/dbraw/zinc/18/59/63/330185963.db2.gz MNBRWUUAYVAPCY-NSHDSACASA-N 1 3 292.423 3.942 20 0 CHADHO CCC(N)(CC)C[NH2+][C@@H](C)c1cc(C)sc1C ZINC000423287012 330186046 /nfs/dbraw/zinc/18/60/46/330186046.db2.gz JWEQFRFEKBMBHF-NSHDSACASA-N 1 3 254.443 3.533 20 0 CHADHO CCC(N)(CC)C[NH2+][C@@H](C)c1ccc(SC)cc1 ZINC000423289531 330186468 /nfs/dbraw/zinc/18/64/68/330186468.db2.gz XKHDJQBARIYYHH-LBPRGKRZSA-N 1 3 266.454 3.577 20 0 CHADHO Cc1ccc([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)s1 ZINC000423290525 330186800 /nfs/dbraw/zinc/18/68/00/330186800.db2.gz DINJSDCUVPLYOA-CHWSQXEVSA-N 1 3 274.433 3.927 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@H]2c3cc(F)ccc3C[C@H]2C)cc1 ZINC000423291683 330187256 /nfs/dbraw/zinc/18/72/56/330187256.db2.gz JKVZRHSQFQWKIN-QHRIQVFBSA-N 1 3 298.405 3.869 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2CCCNc3ccccc32)cc1 ZINC000423292673 330187790 /nfs/dbraw/zinc/18/77/90/330187790.db2.gz NVLXWGZRNQEWDO-IFXJQAMLSA-N 1 3 295.430 3.743 20 0 CHADHO Cc1ccc2c(c1)[C@@H](NCc1ccc([C@@H](C)[NH3+])cc1)CC2 ZINC000423292862 330187798 /nfs/dbraw/zinc/18/77/98/330187798.db2.gz ORVGPTWPWBWQSB-KUHUBIRLSA-N 1 3 280.415 3.792 20 0 CHADHO CCCC[C@H](CN)[NH2+][C@@H](C)c1cc2cccc(OC)c2o1 ZINC000423297040 330188589 /nfs/dbraw/zinc/18/85/89/330188589.db2.gz IMTROVPGDQJSPE-GXTWGEPZSA-N 1 3 290.407 3.610 20 0 CHADHO CC(C)[C@H](NC[C@@H](C)C[NH3+])c1cccc(C(F)(F)F)c1 ZINC000423300910 330189137 /nfs/dbraw/zinc/18/91/37/330189137.db2.gz SMOGTBUACZRWJJ-FZMZJTMJSA-N 1 3 288.357 3.587 20 0 CHADHO C[C@@H](NC[C@@H](C)C[NH3+])c1ccc(-c2ccccc2F)s1 ZINC000423298263 330189152 /nfs/dbraw/zinc/18/91/52/330189152.db2.gz NVCQVYFLWPFSMS-NWDGAFQWSA-N 1 3 292.423 3.800 20 0 CHADHO C[C@H](C[NH3+])CN[C@@H](C)c1ccc(-c2ccc(F)cc2)s1 ZINC000423304369 330189230 /nfs/dbraw/zinc/18/92/30/330189230.db2.gz YLSSJAATZJJAAR-NEPJUHHUSA-N 1 3 292.423 3.800 20 0 CHADHO C[C@@H]([NH2+]C[C@@H](N)C1CC1)c1ccc(-c2ccccc2)s1 ZINC000423314444 330189747 /nfs/dbraw/zinc/18/97/47/330189747.db2.gz HGTWBMVXYHFZMS-IUODEOHRSA-N 1 3 286.444 3.803 20 0 CHADHO C[C@@H]([NH2+]C[C@H](N)C1CC1)c1ccc(-c2ccccc2)s1 ZINC000423314443 330189877 /nfs/dbraw/zinc/18/98/77/330189877.db2.gz HGTWBMVXYHFZMS-DOMZBBRYSA-N 1 3 286.444 3.803 20 0 CHADHO CC(C)C[C@@H](NC[C@]1(C)CCC[NH2+]C1)c1cccs1 ZINC000423318673 330190000 /nfs/dbraw/zinc/19/00/00/330190000.db2.gz CVXCLISFZMBJBV-GDBMZVCRSA-N 1 3 280.481 3.815 20 0 CHADHO CC(C)C[C@@H]([NH2+]C[C@]1(C)CCCNC1)c1cccs1 ZINC000423318673 330190001 /nfs/dbraw/zinc/19/00/01/330190001.db2.gz CVXCLISFZMBJBV-GDBMZVCRSA-N 1 3 280.481 3.815 20 0 CHADHO CC(C)C[C@@H](NC[C@@]1(C)CCC[NH2+]C1)c1cccs1 ZINC000423318676 330190141 /nfs/dbraw/zinc/19/01/41/330190141.db2.gz CVXCLISFZMBJBV-ZBFHGGJFSA-N 1 3 280.481 3.815 20 0 CHADHO CC(C)C[C@@H]([NH2+]C[C@@]1(C)CCCNC1)c1cccs1 ZINC000423318676 330190143 /nfs/dbraw/zinc/19/01/43/330190143.db2.gz CVXCLISFZMBJBV-ZBFHGGJFSA-N 1 3 280.481 3.815 20 0 CHADHO C[C@H](CC(C)(C)c1c[nH]c2ccccc21)NC[C@H]([NH3+])C1CC1 ZINC000423322195 330190333 /nfs/dbraw/zinc/19/03/33/330190333.db2.gz NVDVOAQMLGCRRF-DYVFJYSZSA-N 1 3 299.462 3.551 20 0 CHADHO [NH3+]CCCCN[C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000423320005 330190407 /nfs/dbraw/zinc/19/04/07/330190407.db2.gz GAJYWHAJKSFEAU-KRWDZBQOSA-N 1 3 288.822 3.758 20 0 CHADHO CCC[C@@H](NC[C@@]1(C)CCC[NH2+]C1)c1ccc(OC)cc1 ZINC000423331398 330191180 /nfs/dbraw/zinc/19/11/80/330191180.db2.gz OEOJRZVSAPXRJP-MSOLQXFVSA-N 1 3 290.451 3.516 20 0 CHADHO CCC[C@@H]([NH2+]C[C@@]1(C)CCCNC1)c1ccc(OC)cc1 ZINC000423331398 330191182 /nfs/dbraw/zinc/19/11/82/330191182.db2.gz OEOJRZVSAPXRJP-MSOLQXFVSA-N 1 3 290.451 3.516 20 0 CHADHO C[C@@H]([NH2+]C[C@H](N)C1CC1)c1cccc(-c2ccccc2)c1 ZINC000423330082 330191205 /nfs/dbraw/zinc/19/12/05/330191205.db2.gz TVXKNCLCSNHFHP-KUHUBIRLSA-N 1 3 280.415 3.742 20 0 CHADHO C[C@H]([NH2+]C[C@@]1(C)CCCNC1)[C@@H](C)c1ccc(Cl)cc1 ZINC000423333596 330191565 /nfs/dbraw/zinc/19/15/65/330191565.db2.gz HWDYVQZRLXCNQF-KEYYUXOJSA-N 1 3 294.870 3.811 20 0 CHADHO Clc1ccc([C@H]2CCCCC[C@H]2[NH2+]CC2CNC2)cc1 ZINC000423336615 330191876 /nfs/dbraw/zinc/19/18/76/330191876.db2.gz XWLARWRSIGNFJW-IAGOWNOFSA-N 1 3 292.854 3.565 20 0 CHADHO C[C@]1(CN[C@H]2CCCc3c4ccccc4[nH]c32)CCC[NH2+]C1 ZINC000423343016 330191969 /nfs/dbraw/zinc/19/19/69/330191969.db2.gz NILBPYYBWJGXTP-HKUYNNGSSA-N 1 3 297.446 3.525 20 0 CHADHO C[C@]1(C[NH2+][C@H]2CCCc3c4ccccc4[nH]c32)CCCNC1 ZINC000423343016 330191971 /nfs/dbraw/zinc/19/19/71/330191971.db2.gz NILBPYYBWJGXTP-HKUYNNGSSA-N 1 3 297.446 3.525 20 0 CHADHO [NH3+]CCCCN[C@@H]1CCCc2c(Cl)sc(Cl)c21 ZINC000423343960 330192257 /nfs/dbraw/zinc/19/22/57/330192257.db2.gz WOPOUSUTUSHMLB-SECBINFHSA-N 1 3 293.263 3.761 20 0 CHADHO CC(C)[C@@H](NCC1=CC[NH2+]CC1)c1cc2ccccc2o1 ZINC000423347391 330192655 /nfs/dbraw/zinc/19/26/55/330192655.db2.gz QHNSXFNZKXZLQY-GOSISDBHSA-N 1 3 284.403 3.639 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1ccccc1C(C)(C)C ZINC000423363001 330193876 /nfs/dbraw/zinc/19/38/76/330193876.db2.gz AEFDIHZLLXPAIZ-RBSFLKMASA-N 1 3 274.452 3.775 20 0 CHADHO CC(C)[C@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CNC3)C1 ZINC000423364500 330194439 /nfs/dbraw/zinc/19/44/39/330194439.db2.gz AULXNIPPYBPDAF-YJBOKZPZSA-N 1 3 272.436 3.594 20 0 CHADHO CC[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1cccs1 ZINC000423366176 330194694 /nfs/dbraw/zinc/19/46/94/330194694.db2.gz XKONBXXAJMZQHX-OAHLLOKOSA-N 1 3 272.417 3.592 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H](Cc2ccccc2)c2ccccc2)CCN1 ZINC000423366375 330194771 /nfs/dbraw/zinc/19/47/71/330194771.db2.gz COLPQIUCRSKXOC-AHRSYUTCSA-N 1 3 294.442 3.701 20 0 CHADHO CC(C)[C@H]1CCCC[C@H]1[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423371497 330195229 /nfs/dbraw/zinc/19/52/29/330195229.db2.gz GJEMTMFKBZZEMG-QZTJIDSGSA-N 1 3 272.436 3.594 20 0 CHADHO C[C@H](CCc1ccc(F)cc1)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423403701 330196380 /nfs/dbraw/zinc/19/63/80/330196380.db2.gz XCXHFFWJEYMJPF-CQSZACIVSA-N 1 3 298.405 3.540 20 0 CHADHO CC(C)COc1ccc([C@H](C)N[C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000423405475 330196865 /nfs/dbraw/zinc/19/68/65/330196865.db2.gz YAFTWRUIJRAQGK-UAGQMJEPSA-N 1 3 290.451 3.642 20 0 CHADHO CC[C@@H]([NH2+]Cc1ccc2c(c1)CNC2)C1CCCCC1 ZINC000423406602 330196909 /nfs/dbraw/zinc/19/69/09/330196909.db2.gz ZBSLWWLSVHVXOO-GOSISDBHSA-N 1 3 272.436 3.738 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](N[C@@H]2CCSc3c(Cl)cccc32)C1 ZINC000423406824 330197073 /nfs/dbraw/zinc/19/70/73/330197073.db2.gz ZERSRTKJZLTXMN-JTNHKYCSSA-N 1 3 296.867 3.736 20 0 CHADHO COc1ccc2cc([C@H](C)[NH2+][C@@H]3CCN[C@H](C)C3)ccc2c1 ZINC000423374353 330198669 /nfs/dbraw/zinc/19/86/69/330198669.db2.gz JUHKTGGXGJNNMA-QWQRMKEZSA-N 1 3 298.430 3.640 20 0 CHADHO CC(C)[C@@H](Cc1ccccc1)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423381960 330199322 /nfs/dbraw/zinc/19/93/22/330199322.db2.gz JQHZJWYITDMJCU-HXUWFJFHSA-N 1 3 294.442 3.647 20 0 CHADHO C[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)c1ccccc1C(F)(F)F ZINC000423381951 330199431 /nfs/dbraw/zinc/19/94/31/330199431.db2.gz JQBTXGAULWWFKS-TUAOUCFPSA-N 1 3 286.341 3.626 20 0 CHADHO CC(C)[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1ccc(Cl)cc1 ZINC000423384934 330199757 /nfs/dbraw/zinc/19/97/57/330199757.db2.gz QOGLLJVFLYTFAP-WQVCFCJDSA-N 1 3 280.843 3.767 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)CCN1 ZINC000423387595 330200129 /nfs/dbraw/zinc/20/01/29/330200129.db2.gz SOJLORXZLHIULR-JWZBEHFJSA-N 1 3 292.854 3.706 20 0 CHADHO CC(C)[C@H](CSc1ccccc1)N[C@H]1CCC[C@@H]([NH3+])C1 ZINC000423391108 330200321 /nfs/dbraw/zinc/20/03/21/330200321.db2.gz PIBGTSCQBMEPIE-VYDXJSESSA-N 1 3 292.492 3.663 20 0 CHADHO CC(C)[C@H](CSc1ccccc1)[NH2+][C@H]1CCC[C@@H](N)C1 ZINC000423391108 330200323 /nfs/dbraw/zinc/20/03/23/330200323.db2.gz PIBGTSCQBMEPIE-VYDXJSESSA-N 1 3 292.492 3.663 20 0 CHADHO C[C@@H]([NH2+]Cc1ccc2c(c1)CNC2)C1CCC(F)(F)CC1 ZINC000423389854 330200428 /nfs/dbraw/zinc/20/04/28/330200428.db2.gz OOFUSQXMVPULRC-GFCCVEGCSA-N 1 3 294.389 3.593 20 0 CHADHO CCc1ccc([C@@H](C)NCc2ccc3c(c2)C[NH2+]C3)s1 ZINC000423391695 330200438 /nfs/dbraw/zinc/20/04/38/330200438.db2.gz PORYABMCRMQDHB-GFCCVEGCSA-N 1 3 286.444 3.765 20 0 CHADHO COc1ccccc1-c1ccc([C@H](C)[NH2+][C@@H](C)[C@H](C)N)cc1 ZINC000423436613 330201420 /nfs/dbraw/zinc/20/14/20/330201420.db2.gz FKHVSCRAOZTZRS-KKUMJFAQSA-N 1 3 298.430 3.749 20 0 CHADHO C[C@@H]([NH2+][C@@H](c1ccc(Cl)c(Cl)c1)C1CC1)[C@H](C)N ZINC000423437087 330201501 /nfs/dbraw/zinc/20/15/01/330201501.db2.gz FWELDSOYEOEGOY-ATEUNZGCSA-N 1 3 287.234 3.770 20 0 CHADHO C[C@H]([NH3+])[C@H](C)N[C@@H](C)C(c1ccccc1)c1ccccc1 ZINC000423446104 330202291 /nfs/dbraw/zinc/20/22/91/330202291.db2.gz NUCLVLXZEUMQHG-JYJNAYRXSA-N 1 3 282.431 3.532 20 0 CHADHO CCCCCOc1ccc([C@H](C)[NH2+][C@H](C)[C@H](C)N)cc1 ZINC000423450697 330202925 /nfs/dbraw/zinc/20/29/25/330202925.db2.gz UAAWCTJZJIEXNH-ZNMIVQPWSA-N 1 3 278.440 3.642 20 0 CHADHO Cc1ccc2cc([C@@H](C)N[C@@H]3C[C@H]3C3CC[NH2+]CC3)oc2c1 ZINC000423450733 330202958 /nfs/dbraw/zinc/20/29/58/330202958.db2.gz XLFGVRPJGMNHGM-XOKHGSTOSA-N 1 3 298.430 3.780 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1)[C@H](C)N ZINC000423453507 330203138 /nfs/dbraw/zinc/20/31/38/330203138.db2.gz XSVBKBFLGZOWAP-ZNMIVQPWSA-N 1 3 268.404 3.740 20 0 CHADHO CC[C@H]([NH2+][C@H](C)[C@H](C)N)c1ccc(Cl)c(Cl)c1 ZINC000423454761 330203425 /nfs/dbraw/zinc/20/34/25/330203425.db2.gz ZNQHNWFFUQZVJR-RWEMILLDSA-N 1 3 275.223 3.770 20 0 CHADHO CC[C@H](N)C[NH2+][C@@H](C)c1ccc(-c2ccccc2)s1 ZINC000423456985 330203535 /nfs/dbraw/zinc/20/35/35/330203535.db2.gz FCHYRJGZBTVZBH-JSGCOSHPSA-N 1 3 274.433 3.803 20 0 CHADHO CC[C@@H]([NH3+])CN[C@@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000423459145 330203719 /nfs/dbraw/zinc/20/37/19/330203719.db2.gz HSRKWIXMSZYLPE-UONOGXRCSA-N 1 3 287.451 3.551 20 0 CHADHO CC(C)Oc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H](C)N)cc1Cl ZINC000423466338 330204563 /nfs/dbraw/zinc/20/45/63/330204563.db2.gz NKSRGEKWOJSCEU-WOPDTQHZSA-N 1 3 284.831 3.514 20 0 CHADHO CC(C)Oc1ccc([C@H](C)[NH2+][C@H](C)[C@@H](C)N)cc1Cl ZINC000423466337 330204589 /nfs/dbraw/zinc/20/45/89/330204589.db2.gz NKSRGEKWOJSCEU-UTUOFQBUSA-N 1 3 284.831 3.514 20 0 CHADHO CC[C@H](NCCC[C@H]1CCC[NH2+]1)c1cc(F)ccc1F ZINC000423490677 330207383 /nfs/dbraw/zinc/20/73/83/330207383.db2.gz XYDBOGVXNSRFBG-CJNGLKHVSA-N 1 3 282.378 3.538 20 0 CHADHO [NH3+]CCC[C@@H](N[C@H]1CCc2ccccc21)c1ccccc1 ZINC000423495304 330207618 /nfs/dbraw/zinc/20/76/18/330207618.db2.gz BQFSQRIUHQTGJL-MOPGFXCFSA-N 1 3 280.415 3.744 20 0 CHADHO C[C@H](N[C@@H](CCC[NH3+])c1ccccc1)c1ccc(F)cc1 ZINC000423496883 330207814 /nfs/dbraw/zinc/20/78/14/330207814.db2.gz FRZGMDMNUJKTMU-KSSFIOAISA-N 1 3 286.394 3.957 20 0 CHADHO C[C@@H](N[C@@H](CCC[NH3+])c1ccccc1)c1ccc(F)cc1 ZINC000423496882 330207843 /nfs/dbraw/zinc/20/78/43/330207843.db2.gz FRZGMDMNUJKTMU-KDOFPFPSSA-N 1 3 286.394 3.957 20 0 CHADHO C[C@H]([NH2+][C@@H]1CNC[C@H]1c1ccccc1)[C@@H](C)c1ccccc1 ZINC000423501364 330208500 /nfs/dbraw/zinc/20/85/00/330208500.db2.gz DIVBDVNAHUEETE-GIYDNNGJSA-N 1 3 294.442 3.524 20 0 CHADHO CCc1ccc([C@H](C)N[C@@H](CCC[NH3+])c2ccccc2)o1 ZINC000423506720 330208806 /nfs/dbraw/zinc/20/88/06/330208806.db2.gz PGCVVRHZHXNYOK-YOEHRIQHSA-N 1 3 286.419 3.973 20 0 CHADHO [NH3+]CCC[C@H](N[C@@H]1CCCc2occc21)c1ccccc1 ZINC000423521037 330209934 /nfs/dbraw/zinc/20/99/34/330209934.db2.gz RXGDYBKSVRBBPQ-DLBZAZTESA-N 1 3 284.403 3.727 20 0 CHADHO C[C@H](CC(C)(C)C)[NH2+]CC1(N)C2CC3CC(C2)CC1C3 ZINC000423527054 330210357 /nfs/dbraw/zinc/21/03/57/330210357.db2.gz LZCZITUWEVVHLG-XKMJEZSVSA-N 1 3 278.484 3.554 20 0 CHADHO C[C@H](N[C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc(F)cc1Cl ZINC000423538728 330210848 /nfs/dbraw/zinc/21/08/48/330210848.db2.gz HABGUHQXBLCKLJ-ZJQBRPOHSA-N 1 3 296.817 3.518 20 0 CHADHO C[C@H]([NH2+]CCCNC1CC1)c1ccc(F)c2ccccc21 ZINC000423543839 330211102 /nfs/dbraw/zinc/21/11/02/330211102.db2.gz CFMHVHLUJBWUEK-ZDUSSCGKSA-N 1 3 286.394 3.772 20 0 CHADHO Clc1ccc([C@H]2CC[C@@H]([NH2+]CCCNC3CC3)C2)cc1 ZINC000423542844 330211216 /nfs/dbraw/zinc/21/12/16/330211216.db2.gz BDVKPMYTMNBUGD-WMLDXEAASA-N 1 3 292.854 3.708 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC000527227747 330238963 /nfs/dbraw/zinc/23/89/63/330238963.db2.gz XLBDBOPNYCBHNO-HNNXBMFYSA-N 1 3 296.405 3.834 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](C)c2cccc(C(C)C)c2)C1 ZINC000527844247 330287464 /nfs/dbraw/zinc/28/74/64/330287464.db2.gz AJMWGYPYGPFQOF-HZPDHXFCSA-N 1 3 274.452 3.802 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](C)c2cccc(C(C)C)c2)C1 ZINC000527844247 330287465 /nfs/dbraw/zinc/28/74/65/330287465.db2.gz AJMWGYPYGPFQOF-HZPDHXFCSA-N 1 3 274.452 3.802 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](C)c2cccc(C(C)C)c2)C1 ZINC000527844247 330287466 /nfs/dbraw/zinc/28/74/66/330287466.db2.gz AJMWGYPYGPFQOF-HZPDHXFCSA-N 1 3 274.452 3.802 20 0 CHADHO CC[C@@H](NC[C@@H]1CCC[N@H+](C)C1)c1cccc(Cl)c1 ZINC000044534438 330329742 /nfs/dbraw/zinc/32/97/42/330329742.db2.gz IJKIHVIUJMJNFI-XJKSGUPXSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@@H](NC[C@@H]1CCC[N@@H+](C)C1)c1cccc(Cl)c1 ZINC000044534438 330329743 /nfs/dbraw/zinc/32/97/43/330329743.db2.gz IJKIHVIUJMJNFI-XJKSGUPXSA-N 1 3 280.843 3.723 20 0 CHADHO CC[NH+]1CCC(CCN[C@H](C)c2ccc(F)cc2F)CC1 ZINC000121686678 330404727 /nfs/dbraw/zinc/40/47/27/330404727.db2.gz HLEHRPOPXUWHKD-CYBMUJFWSA-N 1 3 296.405 3.737 20 0 CHADHO CCC[NH+]1CCC(CN[C@H](C)c2ccc(F)cc2F)CC1 ZINC000122683923 330427315 /nfs/dbraw/zinc/42/73/15/330427315.db2.gz VEFKFCRZXXSJRT-CYBMUJFWSA-N 1 3 296.405 3.737 20 0 CHADHO N[C@@H]1CCC[C@@H]([NH2+]CCCCc2ccc(Cl)s2)C1 ZINC000514799603 330465550 /nfs/dbraw/zinc/46/55/50/330465550.db2.gz YVHNGTBIQQXXCO-VXGBXAGGSA-N 1 3 286.872 3.584 20 0 CHADHO C[C@H](C[NH2+][C@H](C)[C@H](C)c1ccc(Cl)cc1)CN(C)C ZINC000425938110 330498665 /nfs/dbraw/zinc/49/86/65/330498665.db2.gz VTLGQPCNAVCFJA-HZSPNIEDSA-N 1 3 282.859 3.619 20 0 CHADHO CC1(C)CC([NH2+]CC2CCN(Cc3cccs3)CC2)C1 ZINC000433169875 330618651 /nfs/dbraw/zinc/61/86/51/330618651.db2.gz YUIWNUITQXZTSY-UHFFFAOYSA-N 1 3 292.492 3.738 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@@H]1CC[C@H](C)c2ccsc21 ZINC000453083313 331087495 /nfs/dbraw/zinc/08/74/95/331087495.db2.gz IDHOQTXFPCPBOV-OUCADQQQSA-N 1 3 266.454 3.616 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@@H]1CC[C@@H](C)c2ccsc21 ZINC000453083317 331087533 /nfs/dbraw/zinc/08/75/33/331087533.db2.gz IDHOQTXFPCPBOV-YRGRVCCFSA-N 1 3 266.454 3.616 20 0 CHADHO CSc1ccccc1[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)N2C ZINC000453371861 331124127 /nfs/dbraw/zinc/12/41/27/331124127.db2.gz VXSSDZXUVUGKOE-FFHGMXDLSA-N 1 3 290.476 3.684 20 0 CHADHO CC[C@H](NCCCC[N@H+](C)C1CC1)c1cc(F)ccc1F ZINC000453410020 331129867 /nfs/dbraw/zinc/12/98/67/331129867.db2.gz UPDWYEGCXUSYSF-KRWDZBQOSA-N 1 3 296.405 3.880 20 0 CHADHO CC[C@H](NCCCC[N@@H+](C)C1CC1)c1cc(F)ccc1F ZINC000453410020 331129868 /nfs/dbraw/zinc/12/98/68/331129868.db2.gz UPDWYEGCXUSYSF-KRWDZBQOSA-N 1 3 296.405 3.880 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)CCc2cccc(Cl)c2)[C@@H](C)C1 ZINC000459376898 331279094 /nfs/dbraw/zinc/27/90/94/331279094.db2.gz ODGGLXJCQYDQLE-YOEHRIQHSA-N 1 3 294.870 3.545 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)CCc2cccc(Cl)c2)[C@@H](C)C1 ZINC000459376898 331279095 /nfs/dbraw/zinc/27/90/95/331279095.db2.gz ODGGLXJCQYDQLE-YOEHRIQHSA-N 1 3 294.870 3.545 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]C2CC(C(C)(C)C)C2)C1 ZINC000459420544 331280637 /nfs/dbraw/zinc/28/06/37/331280637.db2.gz CSUPEOZCTOKSOE-QQFBHYJXSA-N 1 3 266.473 3.521 20 0 CHADHO C[N@@H+]1CCC[C@@H](CCNCc2ccc(-c3ccccc3)o2)C1 ZINC000459725168 331295976 /nfs/dbraw/zinc/29/59/76/331295976.db2.gz FQIOBJWNRXQDQK-INIZCTEOSA-N 1 3 298.430 3.768 20 0 CHADHO C[N@H+]1CCC[C@@H](CCNCc2ccc(-c3ccccc3)o2)C1 ZINC000459725168 331295977 /nfs/dbraw/zinc/29/59/77/331295977.db2.gz FQIOBJWNRXQDQK-INIZCTEOSA-N 1 3 298.430 3.768 20 0 CHADHO CN(CC[C@H]1CCCC[N@@H+]1C)C[C@@H]1C[C@H]1c1ccccc1 ZINC000463110807 331340663 /nfs/dbraw/zinc/34/06/63/331340663.db2.gz WGXKSFZPMIXDHW-OTWHNJEPSA-N 1 3 286.463 3.596 20 0 CHADHO CN(CC[C@H]1CCCC[N@H+]1C)C[C@@H]1C[C@H]1c1ccccc1 ZINC000463110807 331340664 /nfs/dbraw/zinc/34/06/64/331340664.db2.gz WGXKSFZPMIXDHW-OTWHNJEPSA-N 1 3 286.463 3.596 20 0 CHADHO C1CC([C@@H]2CC[C@H]2[NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000510747590 332915130 /nfs/dbraw/zinc/91/51/30/332915130.db2.gz GKPDURRZGMWSPY-ZWKOTPCHSA-N 1 3 276.468 3.562 20 0 CHADHO C[C@@H]([NH2+]C1CCN(C2CCCCC2)CC1)[C@@H]1CC1(C)C ZINC000487275466 331962127 /nfs/dbraw/zinc/96/21/27/331962127.db2.gz PFSQUBINSIQHME-PBHICJAKSA-N 1 3 278.484 3.808 20 0 CHADHO CC(C)(C[NH2+][C@H]1CS[C@@H](C(C)(C)C)C1)CN1CCCC1 ZINC000488531952 332015962 /nfs/dbraw/zinc/01/59/62/332015962.db2.gz FSTIOVRZASIHLV-HUUCEWRRSA-N 1 3 298.540 3.618 20 0 CHADHO CC(C)(CN[C@H]1CS[C@@H](C(C)(C)C)C1)C[NH+]1CCCC1 ZINC000488531952 332015963 /nfs/dbraw/zinc/01/59/63/332015963.db2.gz FSTIOVRZASIHLV-HUUCEWRRSA-N 1 3 298.540 3.618 20 0 CHADHO CN(C[C@@H]1CCC[N@H+](C)C1)[C@@H]1CCc2c1cccc2Cl ZINC000489839734 332069939 /nfs/dbraw/zinc/06/99/39/332069939.db2.gz UWZBWUQRUGSDPK-CXAGYDPISA-N 1 3 292.854 3.601 20 0 CHADHO CN(C[C@@H]1CCC[N@@H+](C)C1)[C@@H]1CCc2c1cccc2Cl ZINC000489839734 332069940 /nfs/dbraw/zinc/06/99/40/332069940.db2.gz UWZBWUQRUGSDPK-CXAGYDPISA-N 1 3 292.854 3.601 20 0 CHADHO CC(C)(C)N1CCC([NH2+]C[C@H]2CCCC(F)(F)C2)CC1 ZINC000502330581 332653990 /nfs/dbraw/zinc/65/39/90/332653990.db2.gz GBJKKPMARJAWKX-ZDUSSCGKSA-N 1 3 288.426 3.664 20 0 CHADHO CC[C@H](C)C[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000309878671 333050645 /nfs/dbraw/zinc/05/06/45/333050645.db2.gz VDLVGKRSNXWFRE-HKUYNNGSSA-N 1 3 288.479 3.924 20 0 CHADHO C(C[NH2+][C@@H]1CCCCC12CCCC2)CN1CCCC1 ZINC000311455440 333068743 /nfs/dbraw/zinc/06/87/43/333068743.db2.gz KKLKWCIUVRXASI-MRXNPFEDSA-N 1 3 264.457 3.565 20 0 CHADHO CC(C)CC[C@@H]([NH2+]C[C@H](C)CN1CCCC1)C1CC1 ZINC000311551833 333069893 /nfs/dbraw/zinc/06/98/93/333069893.db2.gz LDFAEZFEHMVWDZ-DOTOQJQBSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccccc1)CN1CCCC1 ZINC000516880650 333085371 /nfs/dbraw/zinc/08/53/71/333085371.db2.gz ZFHMTRYCNYZVBT-NEPXVJNWSA-N 1 3 286.463 3.500 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+](C[C@H]2CC(C)=C[C@@H](C)C2)C1 ZINC000520904360 333107573 /nfs/dbraw/zinc/10/75/73/333107573.db2.gz IFKGARGEQJPPAS-BPQIPLTHSA-N 1 3 278.484 3.643 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+](C[C@H]2CC(C)=C[C@@H](C)C2)C1 ZINC000520904360 333107575 /nfs/dbraw/zinc/10/75/75/333107575.db2.gz IFKGARGEQJPPAS-BPQIPLTHSA-N 1 3 278.484 3.643 20 0 CHADHO Cc1cccc([C@H]2CCN(CC[C@@H]3CCCC[N@H+]3C)C2)c1 ZINC000564157468 333124823 /nfs/dbraw/zinc/12/48/23/333124823.db2.gz OYHINVOFYJFREF-OALUTQOASA-N 1 3 286.463 3.659 20 0 CHADHO Cc1cccc([C@H]2CCN(CC[C@@H]3CCCC[N@@H+]3C)C2)c1 ZINC000564157468 333124824 /nfs/dbraw/zinc/12/48/24/333124824.db2.gz OYHINVOFYJFREF-OALUTQOASA-N 1 3 286.463 3.659 20 0 CHADHO CC/C=C/CC[NH2+][C@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000185437173 333140510 /nfs/dbraw/zinc/14/05/10/333140510.db2.gz SJFIIVHANRBROK-SGFLJFKBSA-N 1 3 264.457 3.585 20 0 CHADHO Cc1cc(Cl)ccc1CN1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000219569531 333152689 /nfs/dbraw/zinc/15/26/89/333152689.db2.gz DNVBRRWFSSFVBV-QGZVFWFLSA-N 1 3 292.854 3.612 20 0 CHADHO C[C@H](CCC1CC1)[NH2+]C1CCN(CC2CCCC2)CC1 ZINC000186295776 333158240 /nfs/dbraw/zinc/15/82/40/333158240.db2.gz ZJJVRESWDHWNCV-OAHLLOKOSA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+][C@@H](C)CCC2CC2)C1 ZINC000186425932 333160347 /nfs/dbraw/zinc/16/03/47/333160347.db2.gz LHCAPZSCEDURTJ-DOTOQJQBSA-N 1 3 266.473 3.523 20 0 CHADHO CC1(C)CC([NH2+][C@H]2CCC23CCCC3)CC(C)(C)N1 ZINC000189043884 333178988 /nfs/dbraw/zinc/17/89/88/333178988.db2.gz USYCDLCQNHJJIW-AWEZNQCLSA-N 1 3 264.457 3.608 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC12CCCC2)[C@@H]1CCCN(C2CCC2)C1 ZINC000189217498 333186213 /nfs/dbraw/zinc/18/62/13/333186213.db2.gz SOGJDBMKPTUXFA-LZLYRXPVSA-N 1 3 290.495 3.952 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000222942925 333202648 /nfs/dbraw/zinc/20/26/48/333202648.db2.gz DKEDPEYPSYGBHD-XKQJLSEDSA-N 1 3 260.425 3.731 20 0 CHADHO Cc1ccc([C@@H]([NH2+]CCCN(C)C(C)C)C2CC2)cc1 ZINC000223024113 333203354 /nfs/dbraw/zinc/20/33/54/333203354.db2.gz NOHYGEXNSWRBPF-GOSISDBHSA-N 1 3 274.452 3.766 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@@H](C)Cc1ccc(Cl)cc1 ZINC000223025642 333203502 /nfs/dbraw/zinc/20/35/02/333203502.db2.gz FWXZUNJTZIEPPI-AWEZNQCLSA-N 1 3 282.859 3.591 20 0 CHADHO CC(C)[N@@H+](C)CCCN[C@@H](C)Cc1ccc(Cl)cc1 ZINC000223025642 333203503 /nfs/dbraw/zinc/20/35/03/333203503.db2.gz FWXZUNJTZIEPPI-AWEZNQCLSA-N 1 3 282.859 3.591 20 0 CHADHO CC(C)[N@H+](C)CCCN[C@@H](C)Cc1ccc(Cl)cc1 ZINC000223025642 333203504 /nfs/dbraw/zinc/20/35/04/333203504.db2.gz FWXZUNJTZIEPPI-AWEZNQCLSA-N 1 3 282.859 3.591 20 0 CHADHO C[C@H](CCCC(F)(F)F)[NH2+]CCCN1CCCC[C@@H]1C ZINC000226124003 333250627 /nfs/dbraw/zinc/25/06/27/333250627.db2.gz RRTVLBURTXTRGY-KGLIPLIRSA-N 1 3 294.405 3.962 20 0 CHADHO CC(C)C(C)(C)C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCCN1 ZINC000232773442 333342576 /nfs/dbraw/zinc/34/25/76/333342576.db2.gz WDSFFVVKDRTJKD-HRCADAONSA-N 1 3 266.473 3.569 20 0 CHADHO CCc1ccc(CN[C@H](CC[NH+](C)C)C(C)(C)C)cc1 ZINC000523864094 333348459 /nfs/dbraw/zinc/34/84/59/333348459.db2.gz HMZWYKYCFODIOM-QGZVFWFLSA-N 1 3 276.468 3.705 20 0 CHADHO CC[NH+](CC)C[C@@H]1CCN([C@@H](C)CCc2ccccc2)C1 ZINC000174226822 335150729 /nfs/dbraw/zinc/15/07/29/335150729.db2.gz CZOVFVZLZGVSDF-HKUYNNGSSA-N 1 3 288.479 3.671 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+]([C@@H](C)CCc2ccccc2)C1 ZINC000174226822 335150731 /nfs/dbraw/zinc/15/07/31/335150731.db2.gz CZOVFVZLZGVSDF-HKUYNNGSSA-N 1 3 288.479 3.671 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+]([C@@H](C)CCc2ccccc2)C1 ZINC000174226822 335150733 /nfs/dbraw/zinc/15/07/33/335150733.db2.gz CZOVFVZLZGVSDF-HKUYNNGSSA-N 1 3 288.479 3.671 20 0 CHADHO Cc1ccoc1CNC1CCC([NH+]2CCC(C)CC2)CC1 ZINC000131071376 333897156 /nfs/dbraw/zinc/89/71/56/333897156.db2.gz VYFQCLBVCLVGMZ-UHFFFAOYSA-N 1 3 290.451 3.721 20 0 CHADHO CC[C@H](NCC1(C[NH+](C)C)CCCC1)c1cccs1 ZINC000546224742 334020187 /nfs/dbraw/zinc/02/01/87/334020187.db2.gz MAMYCFBPWAJXOZ-AWEZNQCLSA-N 1 3 280.481 3.911 20 0 CHADHO CCCC[C@H](CC)C[N@@H+]1CC[C@@H]2[C@H](CCCN2C)C1 ZINC000546930632 334055666 /nfs/dbraw/zinc/05/56/66/334055666.db2.gz KQYQNGCBZOSJPC-GVDBMIGSSA-N 1 3 266.473 3.619 20 0 CHADHO CCCC[C@H](CC)C[N@H+]1CC[C@@H]2[C@H](CCCN2C)C1 ZINC000546930632 334055667 /nfs/dbraw/zinc/05/56/67/334055667.db2.gz KQYQNGCBZOSJPC-GVDBMIGSSA-N 1 3 266.473 3.619 20 0 CHADHO c1oc2ccccc2c1CN1CCC(C[NH+]2CCCC2)CC1 ZINC000134199470 334084104 /nfs/dbraw/zinc/08/41/04/334084104.db2.gz QHXAFOZGPZCHDK-UHFFFAOYSA-N 1 3 298.430 3.741 20 0 CHADHO Cc1ccc([C@@H]2CCN(CCC[NH+]3CCCCC3)C2)cc1 ZINC000548073037 334138444 /nfs/dbraw/zinc/13/84/44/334138444.db2.gz RDGPRRBBLXFACL-LJQANCHMSA-N 1 3 286.463 3.660 20 0 CHADHO CCN(CC)CCC[NH2+]C(C)(C)CCc1ccccc1 ZINC000548918322 334180235 /nfs/dbraw/zinc/18/02/35/334180235.db2.gz MPLHNYYHBHGQDH-UHFFFAOYSA-N 1 3 276.468 3.719 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+]([C@@H](C)c2cccc(C)c2)C1 ZINC000081516202 334193674 /nfs/dbraw/zinc/19/36/74/334193674.db2.gz PGBSUJGQNUZRHL-IRXDYDNUSA-N 1 3 274.452 3.720 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+]([C@@H](C)c2cccc(C)c2)C1 ZINC000081516202 334193675 /nfs/dbraw/zinc/19/36/75/334193675.db2.gz PGBSUJGQNUZRHL-IRXDYDNUSA-N 1 3 274.452 3.720 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]C[C@H]2CCC[C@@H](C)C2)C1 ZINC000245513712 334199036 /nfs/dbraw/zinc/19/90/36/334199036.db2.gz DLFCCGNRGGPMMF-IXDOHACOSA-N 1 3 266.473 3.523 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](CC(C)C)c2cccs2)C1 ZINC000246947522 334272469 /nfs/dbraw/zinc/27/24/69/334272469.db2.gz HXWZUZZBHDYOGB-LSDHHAIUSA-N 1 3 280.481 3.767 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](CC(C)C)c2cccs2)C1 ZINC000246947522 334272470 /nfs/dbraw/zinc/27/24/70/334272470.db2.gz HXWZUZZBHDYOGB-LSDHHAIUSA-N 1 3 280.481 3.767 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](CC(C)C)c2cccs2)C1 ZINC000246947522 334272472 /nfs/dbraw/zinc/27/24/72/334272472.db2.gz HXWZUZZBHDYOGB-LSDHHAIUSA-N 1 3 280.481 3.767 20 0 CHADHO CC(C)=CCC[C@@H](C)[NH2+]CCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000246985801 334273433 /nfs/dbraw/zinc/27/34/33/334273433.db2.gz KHQMYOCUKDKFKP-KURKYZTESA-N 1 3 296.499 3.600 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)c1cccc(C2CC2)c1)CN1CCCC1 ZINC000551008504 334236220 /nfs/dbraw/zinc/23/62/20/334236220.db2.gz WNQMQZCHZUBNFJ-CVEARBPZSA-N 1 3 286.463 3.947 20 0 CHADHO C[NH+]1CCC(NCc2ccc(C3CCCCC3)cc2)CC1 ZINC000551203481 334240776 /nfs/dbraw/zinc/24/07/76/334240776.db2.gz UYDWVMJFRPIPBT-UHFFFAOYSA-N 1 3 286.463 3.918 20 0 CHADHO CCc1ccc([C@H](C)NCCCCC[NH+]2CCCC2)o1 ZINC000551263493 334243621 /nfs/dbraw/zinc/24/36/21/334243621.db2.gz ROUQALNAUGKHGB-HNNXBMFYSA-N 1 3 278.440 3.759 20 0 CHADHO CC(C)C(C[NH2+]C1CCN(C2CCCC2)CC1)C(C)C ZINC000551591275 334255561 /nfs/dbraw/zinc/25/55/61/334255561.db2.gz WVQZPSAXMFBUOA-UHFFFAOYSA-N 1 3 280.500 3.911 20 0 CHADHO CC(C)NCCC[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000576386534 335196701 /nfs/dbraw/zinc/19/67/01/335196701.db2.gz SIICAUGYLOEOMS-HSBZDZAISA-N 1 3 294.405 3.721 20 0 CHADHO C[C@H](CCC1CC1)[NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000248971564 334323487 /nfs/dbraw/zinc/32/34/87/334323487.db2.gz GQYDRUHKGQBFHQ-VYDXJSESSA-N 1 3 278.484 3.808 20 0 CHADHO CCCN1CC[C@@H](C[NH2+]CC[C@H](C)c2ccccc2)C1 ZINC000249041517 334325577 /nfs/dbraw/zinc/32/55/77/334325577.db2.gz UVQNXENBKAEVQT-IRXDYDNUSA-N 1 3 274.452 3.502 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](C)c2cc3ccccc3s2)C1 ZINC000249079888 334326871 /nfs/dbraw/zinc/32/68/71/334326871.db2.gz CMYIBNHVVWYMGC-ZIAGYGMSSA-N 1 3 288.460 3.894 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](C)c2cc3ccccc3s2)C1 ZINC000249079888 334326872 /nfs/dbraw/zinc/32/68/72/334326872.db2.gz CMYIBNHVVWYMGC-ZIAGYGMSSA-N 1 3 288.460 3.894 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](C)c2cc3ccccc3s2)C1 ZINC000249079888 334326874 /nfs/dbraw/zinc/32/68/74/334326874.db2.gz CMYIBNHVVWYMGC-ZIAGYGMSSA-N 1 3 288.460 3.894 20 0 CHADHO CC(C)[C@H](N[C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(F)c(F)c1 ZINC000552580089 334337461 /nfs/dbraw/zinc/33/74/61/334337461.db2.gz PJGKDHJRSZDOFX-IFIJOSMWSA-N 1 3 296.405 3.734 20 0 CHADHO CC(C)[C@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(F)c(F)c1 ZINC000552580089 334337463 /nfs/dbraw/zinc/33/74/63/334337463.db2.gz PJGKDHJRSZDOFX-IFIJOSMWSA-N 1 3 296.405 3.734 20 0 CHADHO c1ccc(CCC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCCN2)cc1 ZINC000250825549 334351472 /nfs/dbraw/zinc/35/14/72/334351472.db2.gz WXXZLLQXQZBJPW-GUDVDZBRSA-N 1 3 286.463 3.520 20 0 CHADHO c1ccc(CCCN[C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000250825549 334351474 /nfs/dbraw/zinc/35/14/74/334351474.db2.gz WXXZLLQXQZBJPW-GUDVDZBRSA-N 1 3 286.463 3.520 20 0 CHADHO CC(C)CC1(C[NH2+][C@H]2CCN3CCC[C@H]3C2)CCCC1 ZINC000251433107 334361448 /nfs/dbraw/zinc/36/14/48/334361448.db2.gz SMZVNUGHTXUUIH-IRXDYDNUSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@H]1CCCCN1CCC[NH2+][C@H]1CCCc2sccc21 ZINC000252217838 334377312 /nfs/dbraw/zinc/37/73/12/334377312.db2.gz YFBSIWLQXVZCIZ-HOCLYGCPSA-N 1 3 292.492 3.980 20 0 CHADHO C[C@H](c1ccc(C(C)(C)C)cc1)[N@@H+]1C[C@@H](CN)C[C@H]1C ZINC000252699559 334385865 /nfs/dbraw/zinc/38/58/65/334385865.db2.gz UUGHBUDXMHIMDE-RBSFLKMASA-N 1 3 274.452 3.714 20 0 CHADHO C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1C[C@@H](CN)C[C@H]1C ZINC000252699559 334385866 /nfs/dbraw/zinc/38/58/66/334385866.db2.gz UUGHBUDXMHIMDE-RBSFLKMASA-N 1 3 274.452 3.714 20 0 CHADHO C[C@H](c1ccc(C(C)(C)C)cc1)N1C[C@@H](C[NH3+])C[C@H]1C ZINC000252699559 334385867 /nfs/dbraw/zinc/38/58/67/334385867.db2.gz UUGHBUDXMHIMDE-RBSFLKMASA-N 1 3 274.452 3.714 20 0 CHADHO C[C@H](Cc1ccc(F)cc1)[NH2+]CCCN1CCCC[C@H]1C ZINC000252711108 334385964 /nfs/dbraw/zinc/38/59/64/334385964.db2.gz IOPBIXIKLGPBAE-HZPDHXFCSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@H](Cc1ccc(F)cc1)NCCC[N@@H+]1CCCC[C@H]1C ZINC000252711108 334385965 /nfs/dbraw/zinc/38/59/65/334385965.db2.gz IOPBIXIKLGPBAE-HZPDHXFCSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@H](Cc1ccc(F)cc1)NCCC[N@H+]1CCCC[C@H]1C ZINC000252711108 334385967 /nfs/dbraw/zinc/38/59/67/334385967.db2.gz IOPBIXIKLGPBAE-HZPDHXFCSA-N 1 3 292.442 3.611 20 0 CHADHO CC[C@@H]1CCC[C@H](N[C@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000252763950 334391043 /nfs/dbraw/zinc/39/10/43/334391043.db2.gz FDUKQACTUBBZMR-GFOFROLCSA-N 1 3 258.409 3.690 20 0 CHADHO CC[C@H](NCc1ccc(C[NH3+])cc1)c1ccc(F)cc1 ZINC000566245198 334638153 /nfs/dbraw/zinc/63/81/53/334638153.db2.gz KLCMGAQEZGJZKN-KRWDZBQOSA-N 1 3 272.367 3.525 20 0 CHADHO C[C@H]([NH2+]C1CCN(C2CCCCC2)CC1)C1(C)CC1 ZINC000157547974 334774782 /nfs/dbraw/zinc/77/47/82/334774782.db2.gz WASUJTKKQRATRH-AWEZNQCLSA-N 1 3 264.457 3.562 20 0 CHADHO N[C@@H]1CCC[C@@H]([NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000568412968 334823914 /nfs/dbraw/zinc/82/39/14/334823914.db2.gz OXPCHHFDLSGHEB-FGTMMUONSA-N 1 3 288.410 3.621 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000568412969 334823918 /nfs/dbraw/zinc/82/39/18/334823918.db2.gz OXPCHHFDLSGHEB-KURKYZTESA-N 1 3 288.410 3.621 20 0 CHADHO CC(C)CN1CCC([NH2+]C[C@@H]2C[C@@H]2c2ccccc2)CC1 ZINC000163440681 334868242 /nfs/dbraw/zinc/86/82/42/334868242.db2.gz BDXLQSAWMUYXSG-PKOBYXMFSA-N 1 3 286.463 3.500 20 0 CHADHO C[C@H](CC1CC1)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000164277101 334879471 /nfs/dbraw/zinc/87/94/71/334879471.db2.gz NYVNZFZMBJYFPB-CQSZACIVSA-N 1 3 264.457 3.562 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+]C(C2CCC2)C2CCC2)C1 ZINC000580585777 335292380 /nfs/dbraw/zinc/29/23/80/335292380.db2.gz WBISEUZFOXLKDT-MRXNPFEDSA-N 1 3 292.511 3.913 20 0 CHADHO CC(C)(C)[C@H]1CC[C@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000579872165 335914128 /nfs/dbraw/zinc/91/41/28/335914128.db2.gz OHTRXIAVRYTYTG-DLBZAZTESA-N 1 3 278.484 3.808 20 0 CHADHO CCCC1CCC(C[NH2+]C[C@H]2CCN(C(C)C)C2)CC1 ZINC000581386345 336066630 /nfs/dbraw/zinc/06/66/30/336066630.db2.gz PYSLLDPZAWSGIO-DAWZGUTISA-N 1 3 280.500 3.913 20 0 CHADHO CC(C)C[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000381931678 336078562 /nfs/dbraw/zinc/07/85/62/336078562.db2.gz RXKZUOLDPUHDCS-SFHVURJKSA-N 1 3 274.452 3.534 20 0 CHADHO F[C@H]1CCC[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000335383559 534435748 /nfs/dbraw/zinc/43/57/48/534435748.db2.gz AZVFNWDFPWNFGP-GOEBONIOSA-N 1 3 282.447 3.654 20 0 CHADHO CCC1CCC([NH2+]C2CCN(c3ccncc3)CC2)CC1 ZINC000049117312 519856241 /nfs/dbraw/zinc/85/62/41/519856241.db2.gz RIQAUQZDVQGNOY-UHFFFAOYSA-N 1 3 287.451 3.609 20 0 CHADHO CC1(C)CCC[C@H](N[C@@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000227542673 520356581 /nfs/dbraw/zinc/35/65/81/520356581.db2.gz ZCRDWJINJBTUDJ-APHBMKBZSA-N 1 3 258.409 3.690 20 0 CHADHO CCN1CC[C@H]([N@H+](C)Cc2cnc3ccccc3c2)C[C@@H]1C ZINC000337133583 521720217 /nfs/dbraw/zinc/72/02/17/521720217.db2.gz AZFCAPFYUQYMER-YJBOKZPZSA-N 1 3 297.446 3.539 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)Cc2cnc3ccccc3c2)C[C@@H]1C ZINC000337133583 521720218 /nfs/dbraw/zinc/72/02/18/521720218.db2.gz AZFCAPFYUQYMER-YJBOKZPZSA-N 1 3 297.446 3.539 20 0 CHADHO CN(C)[C@@H]1CCC[N@H+](Cc2csc3ccccc23)CC1 ZINC000277092172 522045373 /nfs/dbraw/zinc/04/53/73/522045373.db2.gz FYTSTYLHINBPQM-OAHLLOKOSA-N 1 3 288.460 3.817 20 0 CHADHO CN(C)[C@@H]1CCC[N@@H+](Cc2csc3ccccc23)CC1 ZINC000277092172 522045379 /nfs/dbraw/zinc/04/53/79/522045379.db2.gz FYTSTYLHINBPQM-OAHLLOKOSA-N 1 3 288.460 3.817 20 0 CHADHO C[NH+]1CCC(NCc2ccc(-c3ccccc3)cc2)CC1 ZINC000037248640 523777739 /nfs/dbraw/zinc/77/77/39/523777739.db2.gz LIPLUWDKVAHJMW-UHFFFAOYSA-N 1 3 280.415 3.537 20 0 CHADHO C[NH+](C)CCCCNCc1ccc(-c2ccc(F)cc2)o1 ZINC000045598341 524052828 /nfs/dbraw/zinc/05/28/28/524052828.db2.gz UVHOPFQQVPTXQB-UHFFFAOYSA-N 1 3 290.382 3.517 20 0 CHADHO C[C@H](CCN[C@H]1C[C@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000157446112 524198336 /nfs/dbraw/zinc/19/83/36/524198336.db2.gz HSFJZLSDYLZSLM-CCKFTAQKSA-N 1 3 280.415 3.915 20 0 CHADHO C[C@H]([NH2+]C/C=C/c1ccccc1)[C@H]1CCCN(C2CCC2)C1 ZINC000299105758 525283538 /nfs/dbraw/zinc/28/35/38/525283538.db2.gz VCMVFYMPGZATAM-HXLFFGMLSA-N 1 3 298.474 3.942 20 0 CHADHO C[C@@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1cccc(F)c1 ZINC000037786242 525402035 /nfs/dbraw/zinc/40/20/35/525402035.db2.gz OEIHPSZYKSQBTO-CYBMUJFWSA-N 1 3 278.415 3.739 20 0 CHADHO Cc1oc2ccccc2c1C[N@H+]1CCC[C@H](N(C)C)CC1 ZINC000277359433 526786471 /nfs/dbraw/zinc/78/64/71/526786471.db2.gz FDLYOOABJDHYOQ-HNNXBMFYSA-N 1 3 286.419 3.657 20 0 CHADHO Cc1oc2ccccc2c1C[N@@H+]1CCC[C@H](N(C)C)CC1 ZINC000277359433 526786475 /nfs/dbraw/zinc/78/64/75/526786475.db2.gz FDLYOOABJDHYOQ-HNNXBMFYSA-N 1 3 286.419 3.657 20 0 CHADHO CC1CC[NH+](CCCCN[C@@H]2CCCc3occc32)CC1 ZINC000192678167 528237053 /nfs/dbraw/zinc/23/70/53/528237053.db2.gz DEOOSNGKLROAAT-QGZVFWFLSA-N 1 3 290.451 3.759 20 0 CHADHO CCN(CC)CCC[N@H+](C)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000583958340 1119441003 /nfs/dbraw/zinc/44/10/03/1119441003.db2.gz KLMAKEAVOFZCNX-OKILXGFUSA-N 1 3 294.405 3.771 20 0 CHADHO CCN(CC)CCC[N@@H+](C)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000583958340 1119441004 /nfs/dbraw/zinc/44/10/04/1119441004.db2.gz KLMAKEAVOFZCNX-OKILXGFUSA-N 1 3 294.405 3.771 20 0 CHADHO C[NH+](C)C[C@@H]1CCN(C2c3ccccc3-c3ccccc32)C1 ZINC000114198571 1125496489 /nfs/dbraw/zinc/49/64/89/1125496489.db2.gz ZUVDZLSLUAGAJY-HNNXBMFYSA-N 1 3 292.426 3.640 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@H](C)C2CCC(F)(F)CC2)C1 ZINC000685455738 1119610542 /nfs/dbraw/zinc/61/05/42/1119610542.db2.gz ZMDNNSCJPUKUDJ-KGLIPLIRSA-N 1 3 288.426 3.520 20 0 CHADHO CCCC[C@@H](CC)C[N@@H+]1CCC[C@@]2(CCCNC2)C1 ZINC000228103261 1120806142 /nfs/dbraw/zinc/80/61/42/1120806142.db2.gz KAYYHDRGNXERAT-IAGOWNOFSA-N 1 3 266.473 3.668 20 0 CHADHO CCCC[C@@H](CC)C[N@H+]1CCC[C@@]2(CCCNC2)C1 ZINC000228103261 1120806144 /nfs/dbraw/zinc/80/61/44/1120806144.db2.gz KAYYHDRGNXERAT-IAGOWNOFSA-N 1 3 266.473 3.668 20 0 CHADHO CCC[C@H](C)N1CCC(CC)([NH+]2CCCC2)CC1 ZINC001196727829 1122930654 /nfs/dbraw/zinc/93/06/54/1122930654.db2.gz LMBBMMVEUHGSIP-HNNXBMFYSA-N 1 3 252.446 3.515 20 0 CHADHO CCCCC[N@@H+]1CCCC[C@H]1C[C@@H]1CCCN1C ZINC001201737467 1123143733 /nfs/dbraw/zinc/14/37/33/1123143733.db2.gz OTYSMZFYSRUQHN-HOTGVXAUSA-N 1 3 252.446 3.515 20 0 CHADHO CCCCC[N@H+]1CCCC[C@H]1C[C@@H]1CCCN1C ZINC001201737467 1123143737 /nfs/dbraw/zinc/14/37/37/1123143737.db2.gz OTYSMZFYSRUQHN-HOTGVXAUSA-N 1 3 252.446 3.515 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)C[C@@H]2CCCCC2(F)F)C[C@H]1C ZINC000450471559 1125037365 /nfs/dbraw/zinc/03/73/65/1125037365.db2.gz WFYGGSOBCWDXMJ-ILXRZTDVSA-N 1 3 288.426 3.617 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)C[C@@H]2CCCCC2(F)F)C[C@H]1C ZINC000450471559 1125037373 /nfs/dbraw/zinc/03/73/73/1125037373.db2.gz WFYGGSOBCWDXMJ-ILXRZTDVSA-N 1 3 288.426 3.617 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)C[C@H]2CCCCC2(F)F)C[C@H]1C ZINC000450471561 1125038617 /nfs/dbraw/zinc/03/86/17/1125038617.db2.gz WFYGGSOBCWDXMJ-KFWWJZLASA-N 1 3 288.426 3.617 20 0 CHADHO CSc1ccc([C@H](C)[NH2+]CC(C)(C)CN(C)C)cc1F ZINC000532188477 1125238349 /nfs/dbraw/zinc/23/83/49/1125238349.db2.gz CQTFRNYEENKDET-LBPRGKRZSA-N 1 3 298.471 3.786 20 0 CHADHO C=C/C=C/CC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000883260443 1125387176 /nfs/dbraw/zinc/38/71/76/1125387176.db2.gz UPBUJTMMOCLRRU-ONEGZZNKSA-N 1 3 262.441 3.505 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[N@@H+]1C[C@H](CF)[C@H](C2(N)CC2)C1 ZINC001246687059 1131780718 /nfs/dbraw/zinc/78/07/18/1131780718.db2.gz CXOZSLRDWOYION-YHUYYLMFSA-N 1 3 284.463 3.600 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[N@H+]1C[C@H](CF)[C@H](C2(N)CC2)C1 ZINC001246687059 1131780723 /nfs/dbraw/zinc/78/07/23/1131780723.db2.gz CXOZSLRDWOYION-YHUYYLMFSA-N 1 3 284.463 3.600 20 0 CHADHO CC[C@@H](CC(C)C)[NH2+]CCCN1CCCC[C@@H]1C ZINC001172390253 1132215046 /nfs/dbraw/zinc/21/50/46/1132215046.db2.gz SIGCFIWFZNPWEU-HOTGVXAUSA-N 1 3 254.462 3.665 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CCC[C@@H](CN)[C@H]1C ZINC001205902001 1133628403 /nfs/dbraw/zinc/62/84/03/1133628403.db2.gz GUTUPTJRPZWDIZ-BBWFWOEESA-N 1 3 266.473 3.818 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CCC[C@@H](CN)[C@H]1C ZINC001205902001 1133628409 /nfs/dbraw/zinc/62/84/09/1133628409.db2.gz GUTUPTJRPZWDIZ-BBWFWOEESA-N 1 3 266.473 3.818 20 0 CHADHO Cc1ccc([C@@H](C)NCCCC[N@@H+]2CCC[C@@H](C)C2)o1 ZINC000246893747 1125650670 /nfs/dbraw/zinc/65/06/70/1125650670.db2.gz FMYMWMCDGNEQMZ-GDBMZVCRSA-N 1 3 278.440 3.751 20 0 CHADHO Cc1ccc([C@@H](C)NCCCC[N@H+]2CCC[C@@H](C)C2)o1 ZINC000246893747 1125650674 /nfs/dbraw/zinc/65/06/74/1125650674.db2.gz FMYMWMCDGNEQMZ-GDBMZVCRSA-N 1 3 278.440 3.751 20 0 CHADHO Clc1ccc(C2CCN(C[C@@H]3CCC[NH2+]C3)CC2)cc1 ZINC000262009377 1125750908 /nfs/dbraw/zinc/75/09/08/1125750908.db2.gz UYYDJMSJLFWOBM-CQSZACIVSA-N 1 3 292.854 3.519 20 0 CHADHO Cc1cc2[nH]c(CN3CCC(C[NH+](C)C)CC3)cc2c(C)c1 ZINC000481910030 1126735064 /nfs/dbraw/zinc/73/50/64/1126735064.db2.gz KSXDRDYNNKSCQQ-UHFFFAOYSA-N 1 3 299.462 3.558 20 0 CHADHO C[C@@H]1CCC[C@@H](C[NH2+]C2CCN(C(C)(C)C)CC2)[C@@H]1C ZINC000481988399 1126736692 /nfs/dbraw/zinc/73/66/92/1126736692.db2.gz FPCILKNWZGMYKM-OAGGEKHMSA-N 1 3 280.500 3.911 20 0 CHADHO CCC[C@H](C)[C@H](CC)[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000482361600 1126752588 /nfs/dbraw/zinc/75/25/88/1126752588.db2.gz REESDXCTJWRJCZ-ULQDDVLXSA-N 1 3 268.489 3.911 20 0 CHADHO Cc1cccc2[nH]c(CN3CCCC34CC[NH+](C)CC4)cc21 ZINC000668027167 1126753762 /nfs/dbraw/zinc/75/37/62/1126753762.db2.gz DWGFJYLJYZFGAT-UHFFFAOYSA-N 1 3 297.446 3.537 20 0 CHADHO CC(C)c1cccc(C[N@@H+]2CCCC23CCN(C)CC3)c1 ZINC000668027879 1126754022 /nfs/dbraw/zinc/75/40/22/1126754022.db2.gz SOMYDNIYPWGMBW-UHFFFAOYSA-N 1 3 286.463 3.870 20 0 CHADHO CC(C)c1cccc(C[N@H+]2CCCC23CCN(C)CC3)c1 ZINC000668027879 1126754024 /nfs/dbraw/zinc/75/40/24/1126754024.db2.gz SOMYDNIYPWGMBW-UHFFFAOYSA-N 1 3 286.463 3.870 20 0 CHADHO COc1ccccc1[C@@H](C)[NH2+][C@H](CCN(C)C)C(C)(C)C ZINC000483179183 1126770928 /nfs/dbraw/zinc/77/09/28/1126770928.db2.gz BOMODMIUIKXZLM-RHSMWYFYSA-N 1 3 292.467 3.712 20 0 CHADHO CCN1CC[C@@H]([N@H+](C)Cc2ccc(Cl)s2)[C@H](C)C1 ZINC000174769819 1126773038 /nfs/dbraw/zinc/77/30/38/1126773038.db2.gz GGCYYGRZRZAVAY-DGCLKSJQSA-N 1 3 286.872 3.564 20 0 CHADHO CCN1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)s2)[C@H](C)C1 ZINC000174769819 1126773041 /nfs/dbraw/zinc/77/30/41/1126773041.db2.gz GGCYYGRZRZAVAY-DGCLKSJQSA-N 1 3 286.872 3.564 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+][C@H]1CCCC[C@H]1c1ccccc1 ZINC000484625115 1126837020 /nfs/dbraw/zinc/83/70/20/1126837020.db2.gz SXDGXSPXRPJMFB-QYZOEREBSA-N 1 3 286.463 3.787 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+][C@H]1CCCC[C@@H]1c1ccccc1 ZINC000484625114 1126837040 /nfs/dbraw/zinc/83/70/40/1126837040.db2.gz SXDGXSPXRPJMFB-QRVBRYPASA-N 1 3 286.463 3.787 20 0 CHADHO C[C@H](NC1CC(C[NH3+])C1)c1cc(Cl)cc(Cl)c1F ZINC000904389810 1126850756 /nfs/dbraw/zinc/85/07/56/1126850756.db2.gz VSPGWUKUDDZTET-JEUQWKINSA-N 1 3 291.197 3.520 20 0 CHADHO CC[N@H+](C)Cc1cccc(CN[C@H](C)c2cccc(O)c2)c1 ZINC000194883541 1126977543 /nfs/dbraw/zinc/97/75/43/1126977543.db2.gz XVVLEMPCCLIWJB-OAHLLOKOSA-N 1 3 298.430 3.695 20 0 CHADHO CC[N@@H+](C)Cc1cccc(CN[C@H](C)c2cccc(O)c2)c1 ZINC000194883541 1126977545 /nfs/dbraw/zinc/97/75/45/1126977545.db2.gz XVVLEMPCCLIWJB-OAHLLOKOSA-N 1 3 298.430 3.695 20 0 CHADHO CC(C)[N@H+](C)CC1CCN(Cc2ccccc2Cl)CC1 ZINC000590786574 1127272628 /nfs/dbraw/zinc/27/26/28/1127272628.db2.gz HSVURYXPCUYWQI-UHFFFAOYSA-N 1 3 294.870 3.892 20 0 CHADHO CC(C)[N@@H+](C)CC1CCN(Cc2ccccc2Cl)CC1 ZINC000590786574 1127272631 /nfs/dbraw/zinc/27/26/31/1127272631.db2.gz HSVURYXPCUYWQI-UHFFFAOYSA-N 1 3 294.870 3.892 20 0 CHADHO CCN1CC[C@@H]([N@H+](C)Cc2ccccc2SC)C[C@@H]1C ZINC000358030281 1127397714 /nfs/dbraw/zinc/39/77/14/1127397714.db2.gz GLSZARZKBRBTER-GOEBONIOSA-N 1 3 292.492 3.713 20 0 CHADHO CCN1CC[C@@H]([N@@H+](C)Cc2ccccc2SC)C[C@@H]1C ZINC000358030281 1127397718 /nfs/dbraw/zinc/39/77/18/1127397718.db2.gz GLSZARZKBRBTER-GOEBONIOSA-N 1 3 292.492 3.713 20 0 CHADHO Cc1cccc2c1CC[C@@H]2NC1CC[NH+](C2CCC2)CC1 ZINC000360510231 1127501190 /nfs/dbraw/zinc/50/11/90/1127501190.db2.gz GRLCCRVSRKIPHM-IBGZPJMESA-N 1 3 284.447 3.589 20 0 CHADHO CC[C@H]([NH2+][C@H](C)CCN(C)C)c1cc(Cl)ccc1OC ZINC000360858989 1127515939 /nfs/dbraw/zinc/51/59/39/1127515939.db2.gz MNQJOUWNOCSTFO-DOMZBBRYSA-N 1 3 298.858 3.730 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@H]2CC[N@H+](C)[C@H](C)C2)c1C ZINC000361080010 1127536206 /nfs/dbraw/zinc/53/62/06/1127536206.db2.gz NVPNLNYOVZYPQL-DYVFJYSZSA-N 1 3 299.462 3.665 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@H]2CC[N@@H+](C)[C@H](C)C2)c1C ZINC000361080010 1127536208 /nfs/dbraw/zinc/53/62/08/1127536208.db2.gz NVPNLNYOVZYPQL-DYVFJYSZSA-N 1 3 299.462 3.665 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1cccc(OC)c1 ZINC000361973448 1127603895 /nfs/dbraw/zinc/60/38/95/1127603895.db2.gz XKEKFNJQADCOCJ-NUJGCVRESA-N 1 3 290.451 3.609 20 0 CHADHO c1ccc2c(c1)nccc2NC1CC[NH+](C2CCC2)CC1 ZINC000295972793 1127659026 /nfs/dbraw/zinc/65/90/26/1127659026.db2.gz KKHNOLCZWUEPGP-UHFFFAOYSA-N 1 3 281.403 3.664 20 0 CHADHO C[N@@H+]1CCC[C@@H]1CCN[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000535468476 1127916585 /nfs/dbraw/zinc/91/65/85/1127916585.db2.gz IXVXBINEZWCZDO-QZTJIDSGSA-N 1 3 290.426 3.741 20 0 CHADHO C[N@H+]1CCC[C@@H]1CCN[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000535468476 1127916588 /nfs/dbraw/zinc/91/65/88/1127916588.db2.gz IXVXBINEZWCZDO-QZTJIDSGSA-N 1 3 290.426 3.741 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+][C@@H](c1ccc(F)cc1)C1CCC1 ZINC000535468476 1127916591 /nfs/dbraw/zinc/91/65/91/1127916591.db2.gz IXVXBINEZWCZDO-QZTJIDSGSA-N 1 3 290.426 3.741 20 0 CHADHO C[N@@H+]1CCC[C@H]1CCN[C@H](c1ccc(F)cc1)C1CCC1 ZINC000535468478 1127917297 /nfs/dbraw/zinc/91/72/97/1127917297.db2.gz IXVXBINEZWCZDO-ROUUACIJSA-N 1 3 290.426 3.741 20 0 CHADHO C[N@H+]1CCC[C@H]1CCN[C@H](c1ccc(F)cc1)C1CCC1 ZINC000535468478 1127917299 /nfs/dbraw/zinc/91/72/99/1127917299.db2.gz IXVXBINEZWCZDO-ROUUACIJSA-N 1 3 290.426 3.741 20 0 CHADHO CN1CCC[C@H]1CC[NH2+][C@H](c1ccc(F)cc1)C1CCC1 ZINC000535468478 1127917300 /nfs/dbraw/zinc/91/73/00/1127917300.db2.gz IXVXBINEZWCZDO-ROUUACIJSA-N 1 3 290.426 3.741 20 0 CHADHO CC(C)[NH+]1CCC(N[C@H](C)c2cc3c(s2)CCC3)CC1 ZINC000540175599 1127966127 /nfs/dbraw/zinc/96/61/27/1127966127.db2.gz IZVSCPAFNPKARL-CYBMUJFWSA-N 1 3 292.492 3.760 20 0 CHADHO Cc1ccccc1[C@@H](C)[NH2+]CC[C@@H](C)N1CCCCC1 ZINC000544374508 1127970811 /nfs/dbraw/zinc/97/08/11/1127970811.db2.gz RVEZLEBRXLLYEY-IAGOWNOFSA-N 1 3 274.452 3.910 20 0 CHADHO CCc1ccc([C@H]([NH2+]C[C@@H]2CCN(CC)C2)C(C)C)cc1 ZINC000540259196 1127971996 /nfs/dbraw/zinc/97/19/96/1127971996.db2.gz ONPUGBHIWUKNPA-PKOBYXMFSA-N 1 3 288.479 3.878 20 0 CHADHO C[C@@H]1C[C@@H](NCc2cccc(-c3ccccc3)c2)CC[N@@H+]1C ZINC000540606902 1127985834 /nfs/dbraw/zinc/98/58/34/1127985834.db2.gz INVUPOGQARTBOV-UZLBHIALSA-N 1 3 294.442 3.926 20 0 CHADHO C[C@@H]1C[C@@H](NCc2cccc(-c3ccccc3)c2)CC[N@H+]1C ZINC000540606902 1127985837 /nfs/dbraw/zinc/98/58/37/1127985837.db2.gz INVUPOGQARTBOV-UZLBHIALSA-N 1 3 294.442 3.926 20 0 CHADHO Cc1cccc(C)c1[C@@H](C)[NH2+]CC[C@H]1CCCCN1C ZINC000545517629 1128019014 /nfs/dbraw/zinc/01/90/14/1128019014.db2.gz RBDGRXFCVKFZNH-IAGOWNOFSA-N 1 3 274.452 3.828 20 0 CHADHO Cc1cccc(C)c1[C@@H](C)NCC[C@H]1CCCC[N@@H+]1C ZINC000545517629 1128019021 /nfs/dbraw/zinc/01/90/21/1128019021.db2.gz RBDGRXFCVKFZNH-IAGOWNOFSA-N 1 3 274.452 3.828 20 0 CHADHO Cc1cccc(C)c1[C@@H](C)NCC[C@H]1CCCC[N@H+]1C ZINC000545517629 1128019024 /nfs/dbraw/zinc/01/90/24/1128019024.db2.gz RBDGRXFCVKFZNH-IAGOWNOFSA-N 1 3 274.452 3.828 20 0 CHADHO CC[C@H](CN[C@@H]1C[C@@H]([NH3+])c2ccccc21)CC(F)(F)F ZINC000402674559 1128022978 /nfs/dbraw/zinc/02/29/78/1128022978.db2.gz PFBOBAVVYCZLNT-ZLKJLUDKSA-N 1 3 286.341 3.699 20 0 CHADHO CC[C@H](c1ccccc1)[C@@H]1CCC[N@@H+]1C[C@H]1CCCNC1 ZINC000469873909 1128056618 /nfs/dbraw/zinc/05/66/18/1128056618.db2.gz OJCKOMXSKLRRCO-UHOSZYNNSA-N 1 3 286.463 3.644 20 0 CHADHO CC[C@H](c1ccccc1)[C@@H]1CCC[N@H+]1C[C@H]1CCCNC1 ZINC000469873909 1128056622 /nfs/dbraw/zinc/05/66/22/1128056622.db2.gz OJCKOMXSKLRRCO-UHOSZYNNSA-N 1 3 286.463 3.644 20 0 CHADHO c1ccc([C@@H]2CCCCC[N@H+]2C[C@@H]2CCCNC2)cc1 ZINC000469873123 1128056822 /nfs/dbraw/zinc/05/68/22/1128056822.db2.gz XUBQYIKVWGDMCM-AEFFLSMTSA-N 1 3 272.436 3.603 20 0 CHADHO c1ccc([C@@H]2CCCCC[N@@H+]2C[C@@H]2CCCNC2)cc1 ZINC000469873123 1128056826 /nfs/dbraw/zinc/05/68/26/1128056826.db2.gz XUBQYIKVWGDMCM-AEFFLSMTSA-N 1 3 272.436 3.603 20 0 CHADHO Cc1ccccc1-c1cccc(CN2CC[C@H]([NH3+])[C@H](C)C2)c1 ZINC000469991653 1128061306 /nfs/dbraw/zinc/06/13/06/1128061306.db2.gz NCGPMTWWBNVFAO-UZLBHIALSA-N 1 3 294.442 3.831 20 0 CHADHO CC(C)CCN1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000303511180 1128070254 /nfs/dbraw/zinc/07/02/54/1128070254.db2.gz BLMMMZXKTCHWJA-DLBZAZTESA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)CCN1CCC[C@@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000303511180 1128070258 /nfs/dbraw/zinc/07/02/58/1128070258.db2.gz BLMMMZXKTCHWJA-DLBZAZTESA-N 1 3 266.473 3.619 20 0 CHADHO CCC[C@H](CC)[NH2+]CCCN1C[C@@H](C)C[C@H](C)C1 ZINC001257245087 1128078542 /nfs/dbraw/zinc/07/85/42/1128078542.db2.gz JTWHGVDOEAAOHG-JYJNAYRXSA-N 1 3 254.462 3.523 20 0 CHADHO CCC[C@H](CC)[NH2+]CCCN1C[C@H](C)C[C@H](C)C1 ZINC001257245096 1128078732 /nfs/dbraw/zinc/07/87/32/1128078732.db2.gz JTWHGVDOEAAOHG-XHSDSOJGSA-N 1 3 254.462 3.523 20 0 CHADHO CCC[C@H](CC)[NH2+]C1CCN(C[C@H]2CC=CCC2)CC1 ZINC001257254300 1128098607 /nfs/dbraw/zinc/09/86/07/1128098607.db2.gz PCYKPBDXFZQGLE-IRXDYDNUSA-N 1 3 278.484 3.975 20 0 CHADHO C[C@H](NCCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccns1 ZINC000924684163 1128109797 /nfs/dbraw/zinc/10/97/97/1128109797.db2.gz JFDHRDSOAKVNKG-ZNMIVQPWSA-N 1 3 295.496 3.552 20 0 CHADHO C[C@H](NCCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccns1 ZINC000924684163 1128109800 /nfs/dbraw/zinc/10/98/00/1128109800.db2.gz JFDHRDSOAKVNKG-ZNMIVQPWSA-N 1 3 295.496 3.552 20 0 CHADHO CCC[C@H](NCCCC[NH+](C)C)c1ncccc1Cl ZINC000924853304 1128114754 /nfs/dbraw/zinc/11/47/54/1128114754.db2.gz JNHGWRWUAJSHHV-AWEZNQCLSA-N 1 3 283.847 3.508 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+][C@H]1CCCC(C)(C)C1 ZINC000252155304 1128121228 /nfs/dbraw/zinc/12/12/28/1128121228.db2.gz NDWCCSVFXITPQB-CVEARBPZSA-N 1 3 266.473 3.809 20 0 CHADHO C[C@@H](Cc1cccc(F)c1)[N@H+](CCCN)C1CCCCC1 ZINC001168456075 1128133797 /nfs/dbraw/zinc/13/37/97/1128133797.db2.gz NOWILDRKUAJLOR-HNNXBMFYSA-N 1 3 292.442 3.740 20 0 CHADHO C[C@@H](Cc1cccc(F)c1)[N@@H+](CCCN)C1CCCCC1 ZINC001168456075 1128133801 /nfs/dbraw/zinc/13/38/01/1128133801.db2.gz NOWILDRKUAJLOR-HNNXBMFYSA-N 1 3 292.442 3.740 20 0 CHADHO [NH3+][C@@H]1C[C@H](NCC[C@H]2CCCC2(F)F)c2ccccc21 ZINC000925734860 1128138747 /nfs/dbraw/zinc/13/87/47/1128138747.db2.gz BZNAONSPXJUKEQ-DFBGVHRSSA-N 1 3 280.362 3.546 20 0 CHADHO CC[C@H](NCCC(C)(C)[NH3+])c1ccc(Cl)s1 ZINC000925739668 1128139921 /nfs/dbraw/zinc/13/99/21/1128139921.db2.gz CHBNZDRNVWCODE-VIFPVBQESA-N 1 3 260.834 3.570 20 0 CHADHO CCC1([NH3+])CCN([C@@H]2CC[C@H](C)c3ccsc32)CC1 ZINC000925760800 1128140995 /nfs/dbraw/zinc/14/09/95/1128140995.db2.gz SESDNGUBTJNLMM-GXTWGEPZSA-N 1 3 278.465 3.890 20 0 CHADHO Cc1ccc2cc([C@@H](C)[NH2+]CC(C)(C)CN(C)C)oc2c1 ZINC000495249377 1128253547 /nfs/dbraw/zinc/25/35/47/1128253547.db2.gz GPKGPVCLDUQCOP-CQSZACIVSA-N 1 3 288.435 3.980 20 0 CHADHO C[C@@H](c1ccc2ccccc2c1)[NH+]1CCC(N(C)C)CC1 ZINC000193413410 1128293095 /nfs/dbraw/zinc/29/30/95/1128293095.db2.gz VFXPCXIKFAHRFJ-HNNXBMFYSA-N 1 3 282.431 3.927 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@@H](C)[C@H]2CCCC[C@H]2C)C1 ZINC000562522488 1128407858 /nfs/dbraw/zinc/40/78/58/1128407858.db2.gz GMIRLWPQSWQHHC-QZWWFDLISA-N 1 3 266.473 3.521 20 0 CHADHO C[C@@H](CC[N@@H+]1CCC[C@@H](N(C)C)CC1)c1ccccc1 ZINC000562580089 1128411742 /nfs/dbraw/zinc/41/17/42/1128411742.db2.gz TWMMKOBAVNNLQG-FUHWJXTLSA-N 1 3 274.452 3.596 20 0 CHADHO C[C@@H](CC[N@H+]1CCC[C@@H](N(C)C)CC1)c1ccccc1 ZINC000562580089 1128411745 /nfs/dbraw/zinc/41/17/45/1128411745.db2.gz TWMMKOBAVNNLQG-FUHWJXTLSA-N 1 3 274.452 3.596 20 0 CHADHO c1ccc([C@@H]2CCCC[C@H]2[NH2+]CCCN2CCCC2)cc1 ZINC000037229536 1128424574 /nfs/dbraw/zinc/42/45/74/1128424574.db2.gz MNJOKIXBDMNIIM-RBUKOAKNSA-N 1 3 286.463 3.788 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)c2cc(C)c(C)cc2C)C1 ZINC000037644187 1128434196 /nfs/dbraw/zinc/43/41/96/1128434196.db2.gz TXXDJRJBDZNRTP-DLBZAZTESA-N 1 3 274.452 3.604 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H](C)c2cc(C)c(C)cc2C)C1 ZINC000037644187 1128434199 /nfs/dbraw/zinc/43/41/99/1128434199.db2.gz TXXDJRJBDZNRTP-DLBZAZTESA-N 1 3 274.452 3.604 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H](C)c2cc(C)c(C)cc2C)C1 ZINC000037644187 1128434201 /nfs/dbraw/zinc/43/42/01/1128434201.db2.gz TXXDJRJBDZNRTP-DLBZAZTESA-N 1 3 274.452 3.604 20 0 CHADHO Cc1ccc([C@H](C)NC[C@@H](C)C[NH+]2CCCC2)c(C)c1 ZINC000062077944 1128436425 /nfs/dbraw/zinc/43/64/25/1128436425.db2.gz JQDRJODACDCIPH-WBVHZDCISA-N 1 3 274.452 3.686 20 0 CHADHO C[C@@H](CN[C@@H](c1ccc(F)cc1)C1CC1)C[NH+]1CCCC1 ZINC000062078860 1128437009 /nfs/dbraw/zinc/43/70/09/1128437009.db2.gz SPELMIRFKKXAJV-KBXCAEBGSA-N 1 3 290.426 3.598 20 0 CHADHO Cc1ccc([C@H](NC[C@@H](C)C[NH+]2CCCC2)C2CC2)cc1 ZINC000062078631 1128437132 /nfs/dbraw/zinc/43/71/32/1128437132.db2.gz FSRMWCNVUNUCHS-APWZRJJASA-N 1 3 286.463 3.768 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+][C@H](CCN(C)C)C(C)(C)C)o1 ZINC000126002048 1128460087 /nfs/dbraw/zinc/46/00/87/1128460087.db2.gz PLHZDDFPSDELBV-UKRRQHHQSA-N 1 3 266.429 3.605 20 0 CHADHO CCC[C@@H](C)CC[C@H](C)[NH2+]CC[C@H]1CCCN1C ZINC001257470931 1128469920 /nfs/dbraw/zinc/46/99/20/1128469920.db2.gz MFGOBNGTRCYJPI-OWCLPIDISA-N 1 3 254.462 3.665 20 0 CHADHO CCC[C@H](C)CC[C@H](C)N1CCC([NH+](C)C)CC1 ZINC001257476519 1128480678 /nfs/dbraw/zinc/48/06/78/1128480678.db2.gz LPAWZLUKRSVGLY-GJZGRUSLSA-N 1 3 254.462 3.617 20 0 CHADHO C[C@@H](CN[C@@H](CC1CC1)c1ccccc1)C[NH+]1CCCC1 ZINC000566772587 1128551586 /nfs/dbraw/zinc/55/15/86/1128551586.db2.gz OQOSQFKUPZQLNB-LPHOPBHVSA-N 1 3 286.463 3.849 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+]C(C)(C)c1cccc(Cl)c1 ZINC000569995849 1128613485 /nfs/dbraw/zinc/61/34/85/1128613485.db2.gz PFLQZAAKEVHNSX-OAHLLOKOSA-N 1 3 280.843 3.649 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)c2cc3c(s2)CCCC3)C1 ZINC000130264960 1128575875 /nfs/dbraw/zinc/57/58/75/1128575875.db2.gz FRSUAOLFQDGFSB-UONOGXRCSA-N 1 3 292.492 3.619 20 0 CHADHO CC[C@@H]1CCC[C@H]([NH2+]CCCN2CCC(C)CC2)C1 ZINC000071107105 1128583064 /nfs/dbraw/zinc/58/30/64/1128583064.db2.gz IRMCTJNSMZXMSC-SJORKVTESA-N 1 3 266.473 3.667 20 0 CHADHO [NH3+]C[C@H]1CCCN(Cc2ccc(-c3ccccc3)s2)C1 ZINC000570965644 1128635198 /nfs/dbraw/zinc/63/51/98/1128635198.db2.gz LTUNSCLNJUNOJR-CQSZACIVSA-N 1 3 286.444 3.586 20 0 CHADHO C[C@H](N[C@H](c1cccc(F)c1)C(C)(C)C)[C@H]1CCC[NH2+]C1 ZINC000515828810 1128684005 /nfs/dbraw/zinc/68/40/05/1128684005.db2.gz YDROVNURPBVTEA-JLJPHGGASA-N 1 3 292.442 3.891 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+]C[C@H](C)CC2CCCCC2)C1 ZINC000578401317 1128716914 /nfs/dbraw/zinc/71/69/14/1128716914.db2.gz GHWWMBRYIOEQRG-AEFFLSMTSA-N 1 3 280.500 3.913 20 0 CHADHO c1ccc([C@@H]2CCCC[C@@H]2[NH2+][C@H]2CCNC3(CCC3)C2)cc1 ZINC000643546566 1117791903 /nfs/dbraw/zinc/79/19/03/1117791903.db2.gz REJSAGALPUPEIA-FHWLQOOXSA-N 1 3 298.474 3.977 20 0 CHADHO CCC[C@@H]([NH2+][C@H]1CCNC2(CCC2)C1)C1CCCCC1 ZINC000643547032 1117793987 /nfs/dbraw/zinc/79/39/87/1117793987.db2.gz YSOXAPRIKNNAHJ-DLBZAZTESA-N 1 3 278.484 4.000 20 0 CHADHO CC1(C)[C@H]([NH2+][C@@H]2CCNC3(CCC3)C2)C[C@@H]1c1ccccc1 ZINC000643547211 1117796501 /nfs/dbraw/zinc/79/65/01/1117796501.db2.gz BIBLCJNFWUCJID-KZNAEPCWSA-N 1 3 298.474 3.833 20 0 CHADHO CC[C@@H](N[C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(C)cc1 ZINC000623337924 1117833832 /nfs/dbraw/zinc/83/38/32/1117833832.db2.gz BMBOSUDKQHVCCZ-IAGOWNOFSA-N 1 3 274.452 3.909 20 0 CHADHO CC[C@@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(C)cc1 ZINC000623337924 1117833836 /nfs/dbraw/zinc/83/38/36/1117833836.db2.gz BMBOSUDKQHVCCZ-IAGOWNOFSA-N 1 3 274.452 3.909 20 0 CHADHO C[N@@H+]1CC[C@H](N[C@H](c2ccccc2)C2CC2)CC1(C)C ZINC000623344912 1117837454 /nfs/dbraw/zinc/83/74/54/1117837454.db2.gz IFWAWAZDODBSLU-DLBZAZTESA-N 1 3 272.436 3.600 20 0 CHADHO C[N@H+]1CC[C@H](N[C@H](c2ccccc2)C2CC2)CC1(C)C ZINC000623344912 1117837455 /nfs/dbraw/zinc/83/74/55/1117837455.db2.gz IFWAWAZDODBSLU-DLBZAZTESA-N 1 3 272.436 3.600 20 0 CHADHO CCSc1cccc(C[NH2+][C@@H]2CCN(C)C(C)(C)C2)c1 ZINC000623530699 1117868599 /nfs/dbraw/zinc/86/85/99/1117868599.db2.gz JHPFCXVFMPWVIV-OAHLLOKOSA-N 1 3 292.492 3.761 20 0 CHADHO CCSc1cccc(C[NH2+][C@H]2CCN(C)C(C)(C)C2)c1 ZINC000623530698 1117868614 /nfs/dbraw/zinc/86/86/14/1117868614.db2.gz JHPFCXVFMPWVIV-HNNXBMFYSA-N 1 3 292.492 3.761 20 0 CHADHO CN1CCCC[C@H](C[NH2+]Cc2ccc3ccccc3c2)C1 ZINC000623655309 1117884001 /nfs/dbraw/zinc/88/40/01/1117884001.db2.gz UNVQKPOPYJKRLL-QGZVFWFLSA-N 1 3 282.431 3.661 20 0 CHADHO CN1CCCC[C@H](C[NH2+]Cc2cc3ccccc3s2)C1 ZINC000623656326 1117884106 /nfs/dbraw/zinc/88/41/06/1117884106.db2.gz SAJTWOIQKHBOEB-CQSZACIVSA-N 1 3 288.460 3.723 20 0 CHADHO CC[C@H](C[NH2+]C[C@@H]1CCCCN(C)C1)c1ccccc1 ZINC000623657489 1117884311 /nfs/dbraw/zinc/88/43/11/1117884311.db2.gz RPXGQSHOKDHOQI-DLBZAZTESA-N 1 3 274.452 3.502 20 0 CHADHO CC[C@@H]([NH2+]CCCN1CCCC1)c1ccc(Cl)s1 ZINC000178414612 1117891947 /nfs/dbraw/zinc/89/19/47/1117891947.db2.gz NBIVRJDYMUDBHU-GFCCVEGCSA-N 1 3 286.872 3.928 20 0 CHADHO Cc1cc([C@H](C)NC2CC[NH+](C3CC3)CC2)c(C)s1 ZINC000037140812 1117970529 /nfs/dbraw/zinc/97/05/29/1117970529.db2.gz PNOIJTCTVODDMV-LBPRGKRZSA-N 1 3 278.465 3.642 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]C[C@H](C)CCc2ccccc2)C1 ZINC000579388887 1128747479 /nfs/dbraw/zinc/74/74/79/1128747479.db2.gz OKHFYVKVBAVWPV-IEBWSBKVSA-N 1 3 288.479 3.575 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@H]2CCSc3ccccc32)C1 ZINC000624119851 1117983349 /nfs/dbraw/zinc/98/33/49/1117983349.db2.gz KWEXDPSTKDUESQ-ZBFHGGJFSA-N 1 3 290.476 3.545 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCCN(C)C1)C(C)(C)c1ccccc1 ZINC000624122075 1117984821 /nfs/dbraw/zinc/98/48/21/1117984821.db2.gz JFNKEVITKRHERS-DLBZAZTESA-N 1 3 288.479 3.674 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000624122971 1117985810 /nfs/dbraw/zinc/98/58/10/1117985810.db2.gz BZLRAUUJNHHDNX-FPAYPSAMSA-N 1 3 286.463 3.500 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+](C[C@@H](C)Cc2ccccc2)C1 ZINC000182043159 1118011533 /nfs/dbraw/zinc/01/15/33/1118011533.db2.gz MOOVHOFWSOLDME-PKOBYXMFSA-N 1 3 288.479 3.529 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+](C[C@@H](C)Cc2ccccc2)C1 ZINC000182043159 1118011537 /nfs/dbraw/zinc/01/15/37/1118011537.db2.gz MOOVHOFWSOLDME-PKOBYXMFSA-N 1 3 288.479 3.529 20 0 CHADHO Cc1cc(C)cc([C@H]2CCN(CCC[NH+]3CCCC3)C2)c1 ZINC000183472105 1118044885 /nfs/dbraw/zinc/04/48/85/1118044885.db2.gz GCOGXVIRBQINPG-SFHVURJKSA-N 1 3 286.463 3.579 20 0 CHADHO Cc1cc(C)cc([C@H]2CC[N@H+](CCCN3CCCC3)C2)c1 ZINC000183472105 1118044892 /nfs/dbraw/zinc/04/48/92/1118044892.db2.gz GCOGXVIRBQINPG-SFHVURJKSA-N 1 3 286.463 3.579 20 0 CHADHO Cc1cc(C)cc([C@H]2CC[N@@H+](CCCN3CCCC3)C2)c1 ZINC000183472105 1118044896 /nfs/dbraw/zinc/04/48/96/1118044896.db2.gz GCOGXVIRBQINPG-SFHVURJKSA-N 1 3 286.463 3.579 20 0 CHADHO C[C@@H]([NH2+]C[C@H](C)CN(C)C)c1ccccc1C(F)(F)F ZINC000380422879 1118069489 /nfs/dbraw/zinc/06/94/89/1118069489.db2.gz IFPIMVFWRPDVII-NWDGAFQWSA-N 1 3 288.357 3.554 20 0 CHADHO C[C@@H](NCCCC[N@@H+]1CCCC[C@@H]1C)c1ccncc1F ZINC000340187621 1118105491 /nfs/dbraw/zinc/10/54/91/1118105491.db2.gz XYLOVTREBPXDMB-LSDHHAIUSA-N 1 3 293.430 3.526 20 0 CHADHO C[C@@H](NCCCC[N@H+]1CCCC[C@@H]1C)c1ccncc1F ZINC000340187621 1118105494 /nfs/dbraw/zinc/10/54/94/1118105494.db2.gz XYLOVTREBPXDMB-LSDHHAIUSA-N 1 3 293.430 3.526 20 0 CHADHO C[C@H](Cc1ccco1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000764773446 1118112149 /nfs/dbraw/zinc/11/21/49/1118112149.db2.gz IOUZUIFIEBCVDR-OAHLLOKOSA-N 1 3 290.451 3.597 20 0 CHADHO CCC(C)(C)C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000236849133 1118119801 /nfs/dbraw/zinc/11/98/01/1118119801.db2.gz JURNKLDFXSPKQK-UHFFFAOYSA-N 1 3 266.473 3.809 20 0 CHADHO C[C@H](CSC(C)(C)C)[NH2+]C[C@H](C)CN1CCCCC1 ZINC000765240685 1118139915 /nfs/dbraw/zinc/13/99/15/1118139915.db2.gz WCELPZFMKDVMJI-LSDHHAIUSA-N 1 3 286.529 3.618 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+]C2CCC(=C3CCC3)CC2)C1 ZINC000639170327 1118248665 /nfs/dbraw/zinc/24/86/65/1118248665.db2.gz SZNGMEZDPZLRCU-HNNXBMFYSA-N 1 3 276.468 3.729 20 0 CHADHO C[C@H]([NH2+]Cc1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000306747603 1118341056 /nfs/dbraw/zinc/34/10/56/1118341056.db2.gz FPYBZZMJEUEXHH-FXAWDEMLSA-N 1 3 294.442 3.687 20 0 CHADHO C[C@H](NCc1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000306747603 1118341061 /nfs/dbraw/zinc/34/10/61/1118341061.db2.gz FPYBZZMJEUEXHH-FXAWDEMLSA-N 1 3 294.442 3.687 20 0 CHADHO C[C@H](NCc1ccccc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000306747603 1118341063 /nfs/dbraw/zinc/34/10/63/1118341063.db2.gz FPYBZZMJEUEXHH-FXAWDEMLSA-N 1 3 294.442 3.687 20 0 CHADHO CCOc1cccc([C@H](C)[NH2+]CC[C@@H]2CCCCN2C)c1 ZINC000539279162 1118350644 /nfs/dbraw/zinc/35/06/44/1118350644.db2.gz ABQLUKARYNSKLD-RDJZCZTQSA-N 1 3 290.451 3.610 20 0 CHADHO Cc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000765783196 1118405380 /nfs/dbraw/zinc/40/53/80/1118405380.db2.gz KOTJZJFGDBDXTD-APWZRJJASA-N 1 3 286.463 3.692 20 0 CHADHO Cc1cccc([C@H](C)N2CCC[C@H]([C@H]3CCC[NH2+]3)C2)c1 ZINC000389354875 1118521258 /nfs/dbraw/zinc/52/12/58/1118521258.db2.gz TZYRBSXRNQDPBR-RYQLBKOJSA-N 1 3 272.436 3.520 20 0 CHADHO CC[NH2+]CC1CCN([C@@H](CC)c2ccc(F)cc2F)CC1 ZINC000430589823 1118576667 /nfs/dbraw/zinc/57/66/67/1118576667.db2.gz JCSGQDDXFAGQBV-KRWDZBQOSA-N 1 3 296.405 3.737 20 0 CHADHO C[C@@H]([NH3+])[C@H]1CCN(Cc2cccc(C3CCCC3)c2)C1 ZINC000656785710 1118657592 /nfs/dbraw/zinc/65/75/92/1118657592.db2.gz IOCHQTHHOSLIRT-KDOFPFPSSA-N 1 3 272.436 3.513 20 0 CHADHO CCOc1cccc([C@H](C)[NH2+][C@H]2CCC[C@H](N(C)C)C2)c1 ZINC000161068787 1118744468 /nfs/dbraw/zinc/74/44/68/1118744468.db2.gz UUIDPMSUVPYUDZ-XIRDDKMYSA-N 1 3 290.451 3.609 20 0 CHADHO CC[NH2+]CC1CCN([C@@H](C)c2ccccc2Cl)CC1 ZINC000131462746 1118761372 /nfs/dbraw/zinc/76/13/72/1118761372.db2.gz DZVHKMVLDOLLBE-ZDUSSCGKSA-N 1 3 280.843 3.723 20 0 CHADHO [NH3+][C@H]1C[C@H](NCCC2=CCCCC2)c2ccccc21 ZINC000131923197 1118775884 /nfs/dbraw/zinc/77/58/84/1118775884.db2.gz NLRBHMPCXBCFHA-IRXDYDNUSA-N 1 3 256.393 3.611 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H]2CCC[C@H]2CCCF)C1 ZINC000510756011 1118807341 /nfs/dbraw/zinc/80/73/41/1118807341.db2.gz YHEINOBJKPMJBH-IXDOHACOSA-N 1 3 284.463 3.615 20 0 CHADHO C(C[NH2+]C1CCCCC1)CN1CCC12CCCCC2 ZINC000707634031 1118836653 /nfs/dbraw/zinc/83/66/53/1118836653.db2.gz QXYOEJAMMPASDH-UHFFFAOYSA-N 1 3 264.457 3.707 20 0 CHADHO Cc1cccc2[nH]c(C[NH2+]C3CCN(C4CCC4)CC3)cc21 ZINC000657334100 1119007540 /nfs/dbraw/zinc/00/75/40/1119007540.db2.gz MCTDKAGKHNNLMQ-UHFFFAOYSA-N 1 3 297.446 3.583 20 0 CHADHO CCN(C)C[C@@H]1CC[N@H+](CCC2C[C@@H](C)C[C@H](C)C2)C1 ZINC001167575542 1119086261 /nfs/dbraw/zinc/08/62/61/1119086261.db2.gz CSHYGTYEQXZZPG-BQFCYCMXSA-N 1 3 280.500 3.722 20 0 CHADHO CCN(C)C[C@@H]1CC[N@@H+](CCC2C[C@@H](C)C[C@H](C)C2)C1 ZINC001167575542 1119086265 /nfs/dbraw/zinc/08/62/65/1119086265.db2.gz CSHYGTYEQXZZPG-BQFCYCMXSA-N 1 3 280.500 3.722 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@@H]1CCC(C)(C)c2ccccc21 ZINC000049553767 1119103839 /nfs/dbraw/zinc/10/38/39/1119103839.db2.gz FMTBZCRTEUWGHB-RHSMWYFYSA-N 1 3 274.452 3.729 20 0 CHADHO Cc1ccc([C@H](C)C[N@@H+]2CCCC23CCN(C)CC3)cc1 ZINC000628244269 1128834945 /nfs/dbraw/zinc/83/49/45/1128834945.db2.gz ZOVLYDMZKGCITR-QGZVFWFLSA-N 1 3 286.463 3.659 20 0 CHADHO Cc1ccc([C@H](C)C[N@H+]2CCCC23CCN(C)CC3)cc1 ZINC000628244269 1128834949 /nfs/dbraw/zinc/83/49/49/1128834949.db2.gz ZOVLYDMZKGCITR-QGZVFWFLSA-N 1 3 286.463 3.659 20 0 CHADHO C[C@@H]1C[C@@H]1C[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000583294975 1119337325 /nfs/dbraw/zinc/33/73/25/1119337325.db2.gz JAUAIWDOENWBFN-NZSAHSFTSA-N 1 3 286.463 3.534 20 0 CHADHO C[C@H](C[N@@H+]1CCC[C@H](N(C)C)CC1)C1CCCCC1 ZINC000569628313 1119346916 /nfs/dbraw/zinc/34/69/16/1119346916.db2.gz ALWNAOSLOBRJAD-WBVHZDCISA-N 1 3 266.473 3.619 20 0 CHADHO C[C@H](C[N@H+]1CCC[C@H](N(C)C)CC1)C1CCCCC1 ZINC000569628313 1119346920 /nfs/dbraw/zinc/34/69/20/1119346920.db2.gz ALWNAOSLOBRJAD-WBVHZDCISA-N 1 3 266.473 3.619 20 0 CHADHO CC[C@H](NCc1cccc2c1CC[NH2+]C2)c1ccsc1 ZINC000635007586 1119369047 /nfs/dbraw/zinc/36/90/47/1119369047.db2.gz DWBGSVLDKQGMJO-KRWDZBQOSA-N 1 3 286.444 3.635 20 0 CHADHO C[NH2+]Cc1ccccc1CNCc1ccc(CC(C)C)cc1 ZINC000650719380 1119379225 /nfs/dbraw/zinc/37/92/25/1119379225.db2.gz OBEPZFWWZQVJEX-UHFFFAOYSA-N 1 3 296.458 3.894 20 0 CHADHO CN(Cc1ccccc1)CC(C)(C)C[NH2+]Cc1ccoc1 ZINC000343693803 1119487708 /nfs/dbraw/zinc/48/77/08/1119487708.db2.gz NMCSMKHMDDMBDE-UHFFFAOYSA-N 1 3 286.419 3.527 20 0 CHADHO CC[C@@H](c1ccccc1)N1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000081632312 1119520085 /nfs/dbraw/zinc/52/00/85/1119520085.db2.gz LXFYLSXUFZWCFY-MJGOQNOKSA-N 1 3 286.463 3.801 20 0 CHADHO CC[C@@H](c1ccccc1)N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000081632312 1119520090 /nfs/dbraw/zinc/52/00/90/1119520090.db2.gz LXFYLSXUFZWCFY-MJGOQNOKSA-N 1 3 286.463 3.801 20 0 CHADHO CC(C)[C@H](NCc1cccc(C[NH+](C)C)c1)c1cccnc1 ZINC000091281252 1119555100 /nfs/dbraw/zinc/55/51/00/1119555100.db2.gz YDYGEGSJAWXJHP-IBGZPJMESA-N 1 3 297.446 3.630 20 0 CHADHO Cc1cc(CN[C@H](C)c2cccc(C[NH+](C)C)c2)cc(C)n1 ZINC000926601375 1119625453 /nfs/dbraw/zinc/62/54/53/1119625453.db2.gz NTARKFNLXQJLFW-MRXNPFEDSA-N 1 3 297.446 3.611 20 0 CHADHO Cc1ccc([C@@H](C)C[N@@H+]2CCC[C@@H](N(C)C)CC2)cc1 ZINC000628252093 1119761965 /nfs/dbraw/zinc/76/19/65/1119761965.db2.gz HZWZWWGIEXCHBI-FUHWJXTLSA-N 1 3 274.452 3.515 20 0 CHADHO Cc1ccc([C@@H](C)C[N@H+]2CCC[C@@H](N(C)C)CC2)cc1 ZINC000628252093 1119761968 /nfs/dbraw/zinc/76/19/68/1119761968.db2.gz HZWZWWGIEXCHBI-FUHWJXTLSA-N 1 3 274.452 3.515 20 0 CHADHO Cc1ccccc1[C@@H](C)[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000125905680 1119797840 /nfs/dbraw/zinc/79/78/40/1119797840.db2.gz HXEYEQFSRPCCOP-IAGOWNOFSA-N 1 3 274.452 3.766 20 0 CHADHO CCC[NH+]1CCC(N(C)CCc2ccc(CC)cc2)CC1 ZINC000531143073 1119888772 /nfs/dbraw/zinc/88/87/72/1119888772.db2.gz FNRSUZJMDPYRRS-UHFFFAOYSA-N 1 3 288.479 3.598 20 0 CHADHO CC[C@H]([NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1)[C@H]1C[C@H]1C ZINC000414102898 1119899876 /nfs/dbraw/zinc/89/98/76/1119899876.db2.gz DEVQZGYMPSXXEN-WGMGUUHVSA-N 1 3 278.484 3.664 20 0 CHADHO CC[C@H]([NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1)[C@@H]1C[C@H]1C ZINC000414102896 1119899924 /nfs/dbraw/zinc/89/99/24/1119899924.db2.gz DEVQZGYMPSXXEN-RKYPPNDESA-N 1 3 278.484 3.664 20 0 CHADHO CC[C@H](Cc1ccc(C)cc1)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000624121141 1120076220 /nfs/dbraw/zinc/07/62/20/1120076220.db2.gz OVKADCYYKVNVOZ-RTBURBONSA-N 1 3 288.479 3.638 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H](N(C)C)C2)CC(C)(C)C1 ZINC000715539239 1120082372 /nfs/dbraw/zinc/08/23/72/1120082372.db2.gz BTYCYBAYJSYXPJ-UGUYLWEFSA-N 1 3 266.473 3.664 20 0 CHADHO Cc1ccc([C@@H]([NH2+]C[C@@H]2CCCCN(C)C2)C2CC2)cc1 ZINC000624122150 1120102851 /nfs/dbraw/zinc/10/28/51/1120102851.db2.gz KWKJJEQSBZTPDF-QFBILLFUSA-N 1 3 286.463 3.768 20 0 CHADHO Cc1ccc([C@@H](NC[C@@H]2CCCC[N@@H+](C)C2)C2CC2)cc1 ZINC000624122150 1120102852 /nfs/dbraw/zinc/10/28/52/1120102852.db2.gz KWKJJEQSBZTPDF-QFBILLFUSA-N 1 3 286.463 3.768 20 0 CHADHO Cc1ccc([C@@H](NC[C@@H]2CCCC[N@H+](C)C2)C2CC2)cc1 ZINC000624122150 1120102853 /nfs/dbraw/zinc/10/28/53/1120102853.db2.gz KWKJJEQSBZTPDF-QFBILLFUSA-N 1 3 286.463 3.768 20 0 CHADHO C[C@H](Cc1cccc(F)c1)[NH2+]CCCN1CCCC[C@H]1C ZINC000252711288 1128896817 /nfs/dbraw/zinc/89/68/17/1128896817.db2.gz JDTUUQPCXMYRMN-HZPDHXFCSA-N 1 3 292.442 3.611 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@H]1C[C@H](c2ccccc2)C1(C)C ZINC000665282156 1120211059 /nfs/dbraw/zinc/21/10/59/1120211059.db2.gz RWCZYYCABUGOOS-ZACQAIPSSA-N 1 3 274.452 3.532 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H](C)[C@@H]2CC3CCC2CC3)C1 ZINC000394428745 1120218568 /nfs/dbraw/zinc/21/85/68/1120218568.db2.gz AUOIFVURPWVKFV-PUYXYEEKSA-N 1 3 278.484 3.521 20 0 CHADHO CCCN(Cc1ccc(Cl)c(CC)c1)C[C@@H]1CC[NH2+]C1 ZINC001236842578 1128905342 /nfs/dbraw/zinc/90/53/42/1128905342.db2.gz FPSDOLPCYKVDQU-OAHLLOKOSA-N 1 3 294.870 3.724 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@H](C)Cc2ccc(Cl)cc2)C1 ZINC000300529230 1120376054 /nfs/dbraw/zinc/37/60/54/1120376054.db2.gz MLYBTVPKRWLRNP-ZBFHGGJFSA-N 1 3 294.870 3.591 20 0 CHADHO CC1(C)[C@@H](c2ccccc2)[C@@H]1N[C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000629515985 1128914257 /nfs/dbraw/zinc/91/42/57/1128914257.db2.gz YSARZAAVXOXKTO-JKEDJMADSA-N 1 3 298.474 3.689 20 0 CHADHO CCC[C@H](C)CCCN1CC[C@H](C(F)(F)F)[C@@H](C[NH3+])C1 ZINC000629564162 1128915612 /nfs/dbraw/zinc/91/56/12/1128915612.db2.gz RTKOLNLZPGCHEJ-IHRRRGAJSA-N 1 3 294.405 3.662 20 0 CHADHO CCC[C@H](C)CCCN1CC[C@@H](C(F)(F)F)[C@@H](C[NH3+])C1 ZINC000629564164 1128916080 /nfs/dbraw/zinc/91/60/80/1128916080.db2.gz RTKOLNLZPGCHEJ-MELADBBJSA-N 1 3 294.405 3.662 20 0 CHADHO CN(C[C@H]1CCC[N@H+](C)C1)[C@@H]1CCc2ccc(Cl)cc21 ZINC000543203727 1120462040 /nfs/dbraw/zinc/46/20/40/1120462040.db2.gz VPTKCGWFAKFUNC-SUMWQHHRSA-N 1 3 292.854 3.601 20 0 CHADHO CN(C[C@H]1CCC[N@@H+](C)C1)[C@@H]1CCc2ccc(Cl)cc21 ZINC000543203727 1120462043 /nfs/dbraw/zinc/46/20/43/1120462043.db2.gz VPTKCGWFAKFUNC-SUMWQHHRSA-N 1 3 292.854 3.601 20 0 CHADHO CC(C)=CCC[NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000660257016 1120470056 /nfs/dbraw/zinc/47/00/56/1120470056.db2.gz PWZCBOHDTKVYQG-HZPDHXFCSA-N 1 3 264.457 3.585 20 0 CHADHO CCC[C@H](C)N1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000500073867 1120503602 /nfs/dbraw/zinc/50/36/02/1120503602.db2.gz JBGPKGFWQSQUMT-GVDBMIGSSA-N 1 3 266.473 3.761 20 0 CHADHO CCC[C@H](C)N1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000500073867 1120503608 /nfs/dbraw/zinc/50/36/08/1120503608.db2.gz JBGPKGFWQSQUMT-GVDBMIGSSA-N 1 3 266.473 3.761 20 0 CHADHO CC[C@H](C[N@@H+]1CCC[C@H]2CN(C)CC[C@@H]21)c1ccccc1 ZINC000582115068 1120539808 /nfs/dbraw/zinc/53/98/08/1120539808.db2.gz WDJAFCHOAFSJAU-NEWSRXKRSA-N 1 3 286.463 3.596 20 0 CHADHO CC[C@H](C[N@H+]1CCC[C@H]2CN(C)CC[C@@H]21)c1ccccc1 ZINC000582115068 1120539812 /nfs/dbraw/zinc/53/98/12/1120539812.db2.gz WDJAFCHOAFSJAU-NEWSRXKRSA-N 1 3 286.463 3.596 20 0 CHADHO Cc1nc2ccc(NCCC[N@H+]3CCCC[C@H]3C)cc2[nH]1 ZINC001167751897 1120541666 /nfs/dbraw/zinc/54/16/66/1120541666.db2.gz ORIVDNNQHRCLLS-CYBMUJFWSA-N 1 3 286.423 3.548 20 0 CHADHO Cc1nc2ccc(NCCC[N@@H+]3CCCC[C@H]3C)cc2[nH]1 ZINC001167751897 1120541667 /nfs/dbraw/zinc/54/16/67/1120541667.db2.gz ORIVDNNQHRCLLS-CYBMUJFWSA-N 1 3 286.423 3.548 20 0 CHADHO c1ccc([C@@H]2C[C@H]2C[NH2+][C@@H]2CCNC[C@@H]2C2CCCC2)cc1 ZINC000925677165 1120566063 /nfs/dbraw/zinc/56/60/63/1120566063.db2.gz OOIRIOUELURISR-VNTMZGSJSA-N 1 3 298.474 3.548 20 0 CHADHO CN(C)C1CC[NH+](CCCc2cccc3ccccc32)CC1 ZINC000132230622 1120684824 /nfs/dbraw/zinc/68/48/24/1120684824.db2.gz JLGIDJWBWNOSHP-UHFFFAOYSA-N 1 3 296.458 3.798 20 0 CHADHO CCCC1CCC([N@@H+]2CCC[C@@]3(CCCNC3)C2)CC1 ZINC000228083058 1120768563 /nfs/dbraw/zinc/76/85/63/1120768563.db2.gz AERRXSJAEDBZMR-DAWZGUTISA-N 1 3 278.484 3.811 20 0 CHADHO CCCC1CCC([N@H+]2CCC[C@@]3(CCCNC3)C2)CC1 ZINC000228083058 1120768565 /nfs/dbraw/zinc/76/85/65/1120768565.db2.gz AERRXSJAEDBZMR-DAWZGUTISA-N 1 3 278.484 3.811 20 0 CHADHO CC[C@@H](C)[NH2+][C@H](C)c1ccc(OC)c(CN(CC)CC)c1 ZINC000182193454 1128941007 /nfs/dbraw/zinc/94/10/07/1128941007.db2.gz GWMVFHLMYYBKJG-HUUCEWRRSA-N 1 3 292.467 3.986 20 0 CHADHO C[C@H]1CCCC[C@@H]1N1CCC([NH2+]C2(C3CCC3)CC2)CC1 ZINC000652272287 1120806551 /nfs/dbraw/zinc/80/65/51/1120806551.db2.gz GYYCOBDSHNCUJW-YJBOKZPZSA-N 1 3 290.495 3.952 20 0 CHADHO CCC1([NH3+])CCN([C@H](c2ccc(OC)cc2)C(C)C)CC1 ZINC000925756641 1120902074 /nfs/dbraw/zinc/90/20/74/1120902074.db2.gz NSOGBADSJZZMQF-KRWDZBQOSA-N 1 3 290.451 3.596 20 0 CHADHO CC(C)c1ccc([C@@H](C)[NH2+]C[C@@H]2CNCCC2(F)F)cc1 ZINC000925777849 1120986688 /nfs/dbraw/zinc/98/66/88/1120986688.db2.gz HOFQEBWWDJNZIO-CJNGLKHVSA-N 1 3 296.405 3.705 20 0 CHADHO Cc1cccc(COc2ccc([C@@H](C)[NH2+]C[C@@H](C)N)cc2)c1 ZINC000643528805 1121008688 /nfs/dbraw/zinc/00/86/88/1121008688.db2.gz PCSCUHINTHOPBX-HZPDHXFCSA-N 1 3 298.430 3.572 20 0 CHADHO CC1CCC([N@H+](CCCN)C2CCCCC2)CC1 ZINC000085070141 1121175193 /nfs/dbraw/zinc/17/51/93/1121175193.db2.gz UXQUGYFLNVNJEX-UHFFFAOYSA-N 1 3 252.446 3.549 20 0 CHADHO CC1CCC([N@@H+](CCCN)C2CCCCC2)CC1 ZINC000085070141 1121175195 /nfs/dbraw/zinc/17/51/95/1121175195.db2.gz UXQUGYFLNVNJEX-UHFFFAOYSA-N 1 3 252.446 3.549 20 0 CHADHO C[C@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc2ccccc2c1 ZINC000124382900 1121293722 /nfs/dbraw/zinc/29/37/22/1121293722.db2.gz WNWDTWXULRLTTH-HOTGVXAUSA-N 1 3 294.442 3.975 20 0 CHADHO C[C@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc2ccccc2c1 ZINC000124382900 1121293727 /nfs/dbraw/zinc/29/37/27/1121293727.db2.gz WNWDTWXULRLTTH-HOTGVXAUSA-N 1 3 294.442 3.975 20 0 CHADHO CC[C@H](CN[C@H]1C[C@H](C)c2ccccc21)[NH+]1CCCC1 ZINC000675642492 1121330857 /nfs/dbraw/zinc/33/08/57/1121330857.db2.gz PJNXTRHCIBXHDB-DAYGRLMNSA-N 1 3 272.436 3.699 20 0 CHADHO C[C@@H](CCc1cccc(F)c1)[N@@H+]1CCC[C@H](N(C)C)CC1 ZINC000432790539 1121353571 /nfs/dbraw/zinc/35/35/71/1121353571.db2.gz CJZMEMQHUNCDHZ-YJBOKZPZSA-N 1 3 292.442 3.563 20 0 CHADHO C[C@@H](CCc1cccc(F)c1)[N@H+]1CCC[C@H](N(C)C)CC1 ZINC000432790539 1121353580 /nfs/dbraw/zinc/35/35/80/1121353580.db2.gz CJZMEMQHUNCDHZ-YJBOKZPZSA-N 1 3 292.442 3.563 20 0 CHADHO C[C@H](CC1CCC1)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000675925750 1121384049 /nfs/dbraw/zinc/38/40/49/1121384049.db2.gz APSIUXLXWNVDJE-OAHLLOKOSA-N 1 3 278.484 3.952 20 0 CHADHO C[C@H]1CCCCC[C@@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000675906477 1121387378 /nfs/dbraw/zinc/38/73/78/1121387378.db2.gz WYJZHNIYXFCKCL-YJBOKZPZSA-N 1 3 278.484 3.952 20 0 CHADHO [NH3+]Cc1ccc(Nc2ccnc(C3CCC3)c2)cc1 ZINC001175967714 1121507443 /nfs/dbraw/zinc/50/74/43/1121507443.db2.gz WGRIJRSIHHOKAM-UHFFFAOYSA-N 1 3 253.349 3.551 20 0 CHADHO CCN(Cc1ccc(C[NH+](C)C)cc1)[C@@H](C)c1ccncc1 ZINC000626062172 1121593691 /nfs/dbraw/zinc/59/36/91/1121593691.db2.gz KDRPGZKJJURMRQ-INIZCTEOSA-N 1 3 297.446 3.726 20 0 CHADHO c1ccc(CN2C[C@@H]3CCC[C@@H]([NH2+]CCC4CC4)[C@@H]3C2)cc1 ZINC000512666420 1121673537 /nfs/dbraw/zinc/67/35/37/1121673537.db2.gz KKANHFVWWBYJRN-XUVXKRRUSA-N 1 3 298.474 3.677 20 0 CHADHO C[C@H]([NH2+]CC[C@H]1CCCN1C)c1ccc(C2CC2)cc1 ZINC000419347661 1121673970 /nfs/dbraw/zinc/67/39/70/1121673970.db2.gz XAYJGVCKIOCMJP-KBXCAEBGSA-N 1 3 272.436 3.699 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N[C@H](C)c1nc(C)sc1C ZINC000020089041 1121690793 /nfs/dbraw/zinc/69/07/93/1121690793.db2.gz WFNXXNMFJGEFFG-QWHCGFSZSA-N 1 3 297.512 3.921 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CCC[C@](C)(N)C1 ZINC001204939036 1121756024 /nfs/dbraw/zinc/75/60/24/1121756024.db2.gz PENPFZSAISFXLM-HOTGVXAUSA-N 1 3 252.446 3.572 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CCC[C@](C)(N)C1 ZINC001204939036 1121756030 /nfs/dbraw/zinc/75/60/30/1121756030.db2.gz PENPFZSAISFXLM-HOTGVXAUSA-N 1 3 252.446 3.572 20 0 CHADHO CC(C)Cc1ccc(C[N@@H+]2CCCC[C@](F)(CN)C2)cc1 ZINC001206363575 1121847542 /nfs/dbraw/zinc/84/75/42/1121847542.db2.gz YBKYQYZRWGAIGI-SFHVURJKSA-N 1 3 292.442 3.538 20 0 CHADHO CC(C)Cc1ccc(C[N@H+]2CCCC[C@](F)(CN)C2)cc1 ZINC001206363575 1121847552 /nfs/dbraw/zinc/84/75/52/1121847552.db2.gz YBKYQYZRWGAIGI-SFHVURJKSA-N 1 3 292.442 3.538 20 0 CHADHO C[C@H]1CC([NH2+]C[C@H]2CCCN(CC3CC3)C2)C[C@H](C)C1 ZINC001179266724 1121865608 /nfs/dbraw/zinc/86/56/08/1121865608.db2.gz WRHQOZFDLLEYHY-BFYDXBDKSA-N 1 3 278.484 3.523 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)CCSC2CCCCC2)[C@@H](C)C1 ZINC000501035655 1121946476 /nfs/dbraw/zinc/94/64/76/1121946476.db2.gz IPXRGOXLDFGRSG-DOTOQJQBSA-N 1 3 298.540 3.714 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)CCSC2CCCCC2)[C@@H](C)C1 ZINC000501035655 1121946482 /nfs/dbraw/zinc/94/64/82/1121946482.db2.gz IPXRGOXLDFGRSG-DOTOQJQBSA-N 1 3 298.540 3.714 20 0 CHADHO CCN(Cc1cccc(C(F)F)c1)[C@@H]1CCC[NH2+]CC1 ZINC000420303720 1121998001 /nfs/dbraw/zinc/99/80/01/1121998001.db2.gz DAZALAYLUMXSCF-OAHLLOKOSA-N 1 3 282.378 3.588 20 0 CHADHO c1ccc2c(c1)CN(CC[C@H]1CC[NH2+]C1)Cc1ccccc1-2 ZINC000420314135 1121999657 /nfs/dbraw/zinc/99/96/57/1121999657.db2.gz YUXKBMQBEJBSTC-MRXNPFEDSA-N 1 3 292.426 3.669 20 0 CHADHO CC(C)CCN1CCC([NH2+]CC(C)(C)C(C)C)CC1 ZINC001180986189 1122028872 /nfs/dbraw/zinc/02/88/72/1122028872.db2.gz WBPIAGYZRFWACV-UHFFFAOYSA-N 1 3 268.489 3.769 20 0 CHADHO c1ccc([C@H]2C[C@@H]2C[NH2+]C2CCN(C3CCCC3)CC2)cc1 ZINC000502983290 1122161917 /nfs/dbraw/zinc/16/19/17/1122161917.db2.gz AVTKGJNEYDMLCU-YLJYHZDGSA-N 1 3 298.474 3.787 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CCc2cccc3[nH]ccc32)CC1 ZINC000503062070 1122164967 /nfs/dbraw/zinc/16/49/67/1122164967.db2.gz OGWFTYJLWUVRFD-UHFFFAOYSA-N 1 3 299.462 3.563 20 0 CHADHO CCC[C@@H](Cc1ccccc1)[NH2+]C[C@H]1CCCCN(C)C1 ZINC001182903018 1122194831 /nfs/dbraw/zinc/19/48/31/1122194831.db2.gz VRFKTEINQBLWCH-MOPGFXCFSA-N 1 3 288.479 3.719 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+]CC[C@@H](C)N(C)C ZINC001183105147 1122206827 /nfs/dbraw/zinc/20/68/27/1122206827.db2.gz ZEPIVJITDKOWFR-SJLPKXTDSA-N 1 3 276.468 3.718 20 0 CHADHO CN1CCC2(CCC[N@@H+]2Cc2ccc3c(c2)CCCC3)CC1 ZINC000430059694 1122253138 /nfs/dbraw/zinc/25/31/38/1122253138.db2.gz QFQYEBWFHCXFFI-UHFFFAOYSA-N 1 3 298.474 3.626 20 0 CHADHO CN1CCC2(CCC[N@H+]2Cc2ccc3c(c2)CCCC3)CC1 ZINC000430059694 1122253141 /nfs/dbraw/zinc/25/31/41/1122253141.db2.gz QFQYEBWFHCXFFI-UHFFFAOYSA-N 1 3 298.474 3.626 20 0 CHADHO c1ccc(CN2C[C@@H]3CCCC[C@@H]([NH2+]CC4CC4)[C@@H]3C2)cc1 ZINC000514103652 1122375792 /nfs/dbraw/zinc/37/57/92/1122375792.db2.gz DFQCWVVPKSHUNJ-XUVXKRRUSA-N 1 3 298.474 3.677 20 0 CHADHO CC[C@@H]([NH2+]CC[C@H]1CCCCN1C)c1ccccc1OC ZINC000775077160 1122418234 /nfs/dbraw/zinc/41/82/34/1122418234.db2.gz KIRIHQRCAJANIJ-NVXWUHKLSA-N 1 3 290.451 3.610 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@H](c3ccccc3)C2)C1 ZINC000436315522 1122537373 /nfs/dbraw/zinc/53/73/73/1122537373.db2.gz PTLYYVSDQLWZBM-CADBVGFASA-N 1 3 286.463 3.785 20 0 CHADHO C[C@@H](CCN)[NH2+]CCCCc1ccc(Cl)c(Cl)c1 ZINC000414888059 1122567057 /nfs/dbraw/zinc/56/70/57/1122567057.db2.gz DUXFYPJGJKDKEI-NSHDSACASA-N 1 3 289.250 3.643 20 0 CHADHO CCN(CC)CCC[NH2+][C@H](C)C(C)(C)c1ccccc1 ZINC001192901301 1122661131 /nfs/dbraw/zinc/66/11/31/1122661131.db2.gz JRAGBMWWSOFGBH-MRXNPFEDSA-N 1 3 276.468 3.674 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000438070566 1122672756 /nfs/dbraw/zinc/67/27/56/1122672756.db2.gz FCZOJMGWNZCQFR-RTBURBONSA-N 1 3 288.479 3.817 20 0 CHADHO CCN(CC)CCC[NH2+][C@H]1CCC[C@H]1CCC(C)C ZINC001193495411 1122693191 /nfs/dbraw/zinc/69/31/91/1122693191.db2.gz AZPLDLXUPVQERE-IRXDYDNUSA-N 1 3 268.489 3.913 20 0 CHADHO CC1(C)CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C1 ZINC001167973175 1122870167 /nfs/dbraw/zinc/87/01/67/1122870167.db2.gz IJYREQNISKHFQA-XYTVBORESA-N 1 3 276.468 3.560 20 0 CHADHO CC(C)(CC1CC1)[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167975786 1122884862 /nfs/dbraw/zinc/88/48/62/1122884862.db2.gz WBSRDKRLMBSKMK-ALOPSCKCSA-N 1 3 276.468 3.560 20 0 CHADHO C[C@@H]1CCCC[N@@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C1 ZINC001167983305 1122905532 /nfs/dbraw/zinc/90/55/32/1122905532.db2.gz FKXSRQOIDREDDL-NAZJXLNTSA-N 1 3 276.468 3.514 20 0 CHADHO C[C@@H]1CCCC[N@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C1 ZINC001167983305 1122905535 /nfs/dbraw/zinc/90/55/35/1122905535.db2.gz FKXSRQOIDREDDL-NAZJXLNTSA-N 1 3 276.468 3.514 20 0 CHADHO CC[C@H](C)[C@H](C)N1CCC(CC)([NH+]2CCCC2)CC1 ZINC001196728074 1122931427 /nfs/dbraw/zinc/93/14/27/1122931427.db2.gz UBUGRNAUCASTQS-HOTGVXAUSA-N 1 3 266.473 3.761 20 0 CHADHO CC[C@H]([NH2+]CC[C@@H]1CCCN1C)c1cc(C)ccc1C ZINC001196944222 1122940953 /nfs/dbraw/zinc/94/09/53/1122940953.db2.gz UHOSXHKWNRHMFV-WMZOPIPTSA-N 1 3 274.452 3.828 20 0 CHADHO CC[C@H](NCC[C@@H]1CCC[N@@H+]1C)c1cc(C)ccc1C ZINC001196944222 1122940954 /nfs/dbraw/zinc/94/09/54/1122940954.db2.gz UHOSXHKWNRHMFV-WMZOPIPTSA-N 1 3 274.452 3.828 20 0 CHADHO CC[C@H](NCC[C@@H]1CCC[N@H+]1C)c1cc(C)ccc1C ZINC001196944222 1122940957 /nfs/dbraw/zinc/94/09/57/1122940957.db2.gz UHOSXHKWNRHMFV-WMZOPIPTSA-N 1 3 274.452 3.828 20 0 CHADHO C[C@@H]1CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C[C@H]1C ZINC001167985085 1122945556 /nfs/dbraw/zinc/94/55/56/1122945556.db2.gz VCVXMXPPJZBPML-ZWUJWRBQSA-N 1 3 290.495 3.760 20 0 CHADHO C[C@@H]1CCC[N@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C[C@H]1C ZINC001167985085 1122945558 /nfs/dbraw/zinc/94/55/58/1122945558.db2.gz VCVXMXPPJZBPML-ZWUJWRBQSA-N 1 3 290.495 3.760 20 0 CHADHO Cc1cc(C)c(/C=C\CNC2CC[NH+](C3CC3)CC2)c(C)c1 ZINC001199077928 1123020491 /nfs/dbraw/zinc/02/04/91/1123020491.db2.gz MVEMOARIGWGSLE-PLNGDYQASA-N 1 3 298.474 3.841 20 0 CHADHO C[C@H]([NH2+][C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1)c1ccoc1 ZINC000309915815 1129094661 /nfs/dbraw/zinc/09/46/61/1129094661.db2.gz OCBDZMTUQPHYNQ-XYJFISCASA-N 1 3 298.430 3.841 20 0 CHADHO CC[C@@H](F)CN1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000440774560 1123038062 /nfs/dbraw/zinc/03/80/62/1123038062.db2.gz YFQFIKQKPJULGO-DOTOQJQBSA-N 1 3 284.463 3.711 20 0 CHADHO CC[C@@H](F)CN1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000440774560 1123038066 /nfs/dbraw/zinc/03/80/66/1123038066.db2.gz YFQFIKQKPJULGO-DOTOQJQBSA-N 1 3 284.463 3.711 20 0 CHADHO C[C@H]1[C@@H](C[NH3+])CCCN1Cc1cccc(C(C)(C)C)c1 ZINC001205912780 1123075375 /nfs/dbraw/zinc/07/53/75/1123075375.db2.gz CFTJHIMOPZXRKY-GOEBONIOSA-N 1 3 274.452 3.543 20 0 CHADHO CCCCN1CCC([N@H+](C)Cc2ccc(F)cc2)CC1 ZINC001201717161 1123139804 /nfs/dbraw/zinc/13/98/04/1123139804.db2.gz BUOFGHCIEROEFA-UHFFFAOYSA-N 1 3 278.415 3.522 20 0 CHADHO CCCCN1CCC([N@@H+](C)Cc2ccc(F)cc2)CC1 ZINC001201717161 1123139806 /nfs/dbraw/zinc/13/98/06/1123139806.db2.gz BUOFGHCIEROEFA-UHFFFAOYSA-N 1 3 278.415 3.522 20 0 CHADHO CC(C)[C@H](Cc1ccccc1)[NH2+][C@H]1CCC[C@@H](N(C)C)C1 ZINC000427695295 1123242160 /nfs/dbraw/zinc/24/21/60/1123242160.db2.gz LSHIHNONSAEYOE-OTWHNJEPSA-N 1 3 288.479 3.716 20 0 CHADHO CC[C@@H]([NH2+]CC1(N)CCCC1)c1ccc(OC(F)F)cc1 ZINC000665249708 1123264048 /nfs/dbraw/zinc/26/40/48/1123264048.db2.gz XEUZDLGCYCGELY-CQSZACIVSA-N 1 3 298.377 3.600 20 0 CHADHO C(C1CCCCC1)N1CCC([NH2+][C@@H]2CCCC23CC3)CC1 ZINC000850430188 1123266556 /nfs/dbraw/zinc/26/65/56/1123266556.db2.gz JQMQLAXTTWFHHH-GOSISDBHSA-N 1 3 290.495 3.953 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@H](C)c1ccc(-c2ccncc2)cc1 ZINC000665280991 1123312384 /nfs/dbraw/zinc/31/23/84/1123312384.db2.gz RESGVGJPNGBUAF-DNVCBOLYSA-N 1 3 297.446 3.773 20 0 CHADHO CCC[C@@H](NCC[C@@H]([NH3+])C(C)C)c1ccsc1 ZINC000665281496 1123313525 /nfs/dbraw/zinc/31/35/25/1123313525.db2.gz FERCWUOTMQETBH-ZIAGYGMSSA-N 1 3 254.443 3.552 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]C2CCC(C(F)F)CC2)C1 ZINC000442782331 1123337773 /nfs/dbraw/zinc/33/77/73/1123337773.db2.gz PSQCGLONXGKBCW-NFOMZHRRSA-N 1 3 288.426 3.520 20 0 CHADHO CCC[C@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccsc1 ZINC000191200513 1123396719 /nfs/dbraw/zinc/39/67/19/1123396719.db2.gz YGFOEIHFJVIEKP-BBRMVZONSA-N 1 3 278.465 3.663 20 0 CHADHO CCC[C@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccsc1 ZINC000191200513 1123396723 /nfs/dbraw/zinc/39/67/23/1123396723.db2.gz YGFOEIHFJVIEKP-BBRMVZONSA-N 1 3 278.465 3.663 20 0 CHADHO C[C@H](CC(C)(C)C)[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000853240249 1123428959 /nfs/dbraw/zinc/42/89/59/1123428959.db2.gz NRODDDNKPPFWHZ-ZBFHGGJFSA-N 1 3 266.473 3.523 20 0 CHADHO CCN1CCC[C@@H](C[NH2+]C[C@H](C)CCc2ccccc2)C1 ZINC001648959960 1123438995 /nfs/dbraw/zinc/43/89/95/1123438995.db2.gz HDVINWGIQWAXEL-MJGOQNOKSA-N 1 3 288.479 3.577 20 0 CHADHO CC(C)CSCCCN1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000443608273 1123443835 /nfs/dbraw/zinc/44/38/35/1123443835.db2.gz YHPBHOZTOJKYLH-KRWDZBQOSA-N 1 3 298.540 3.574 20 0 CHADHO CC[C@@H]1CCC[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000157562182 1129129279 /nfs/dbraw/zinc/12/92/79/1129129279.db2.gz WBADZZXPZNHWHQ-QAPCUYQASA-N 1 3 278.484 3.952 20 0 CHADHO CN(CCCC1CCCCC1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000395236535 1123646225 /nfs/dbraw/zinc/64/62/25/1123646225.db2.gz PSBUIQHEDLMGRW-SJPCQFCGSA-N 1 3 264.457 3.562 20 0 CHADHO C[C@H](CC[NH2+]C[C@H]1C[C@H]1c1ccccc1)N1CCCCC1 ZINC000346257933 1123676173 /nfs/dbraw/zinc/67/61/73/1123676173.db2.gz YFOACFIGSZYRNR-QRQLOZEOSA-N 1 3 286.463 3.644 20 0 CHADHO C[C@@H]([NH3+])[C@H]1CCN(Cc2cc(-c3ccccc3)cs2)C1 ZINC000346650553 1123701418 /nfs/dbraw/zinc/70/14/18/1123701418.db2.gz PQBKCOCVGWCLMW-HIFRSBDPSA-N 1 3 286.444 3.584 20 0 CHADHO Cc1ccc([C@H]2CCCCN2C[C@@H]2CCC[NH2+]C2)cc1 ZINC000346982107 1123739218 /nfs/dbraw/zinc/73/92/18/1123739218.db2.gz MYSKPAHGRGJSRA-SJLPKXTDSA-N 1 3 272.436 3.522 20 0 CHADHO Cc1ccc(C)c(C[NH2+]CCCN2CCC(C)CC2)c1 ZINC000042298724 1123782679 /nfs/dbraw/zinc/78/26/79/1123782679.db2.gz VVPLCRPGMGPSFZ-UHFFFAOYSA-N 1 3 274.452 3.515 20 0 CHADHO CC[C@H](C[N@@H+]1CCCC12CCN(C)CC2)c1ccccc1 ZINC000475116894 1123795254 /nfs/dbraw/zinc/79/52/54/1123795254.db2.gz FWMSAHPENCWKGL-QGZVFWFLSA-N 1 3 286.463 3.740 20 0 CHADHO CC[C@H](C[N@H+]1CCCC12CCN(C)CC2)c1ccccc1 ZINC000475116894 1123795258 /nfs/dbraw/zinc/79/52/58/1123795258.db2.gz FWMSAHPENCWKGL-QGZVFWFLSA-N 1 3 286.463 3.740 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](C)CC(C)(C)c2ccccc2)C1 ZINC000037644506 1129155132 /nfs/dbraw/zinc/15/51/32/1129155132.db2.gz YYVXTJHGSQVJDT-IRXDYDNUSA-N 1 3 288.479 3.674 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H]2CCCc3ccc(C)cc32)C1 ZINC000339072800 1123971672 /nfs/dbraw/zinc/97/16/72/1123971672.db2.gz XTYRZKRWRULIIP-VQIMIIECSA-N 1 3 286.463 3.694 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H]2CCCc3ccc(C)cc32)C1 ZINC000339072800 1123971674 /nfs/dbraw/zinc/97/16/74/1123971674.db2.gz XTYRZKRWRULIIP-VQIMIIECSA-N 1 3 286.463 3.694 20 0 CHADHO CS[C@H]1C[C@H](NC2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)C1 ZINC000866486345 1124071767 /nfs/dbraw/zinc/07/17/67/1124071767.db2.gz FDHHQFWLVLLPNH-MWQQHZPXSA-N 1 3 296.524 3.513 20 0 CHADHO CS[C@H]1C[C@H]([NH2+]C2CCN([C@@H]3CCC[C@@H](C)C3)CC2)C1 ZINC000866486345 1124071771 /nfs/dbraw/zinc/07/17/71/1124071771.db2.gz FDHHQFWLVLLPNH-MWQQHZPXSA-N 1 3 296.524 3.513 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)CCc2ccc(Cl)cc2)C[C@@H]1C ZINC000445209754 1124076460 /nfs/dbraw/zinc/07/64/60/1124076460.db2.gz HADYZFVIYSCSPC-YOEHRIQHSA-N 1 3 294.870 3.687 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)CCc2ccc(Cl)cc2)C[C@@H]1C ZINC000445209754 1124076465 /nfs/dbraw/zinc/07/64/65/1124076465.db2.gz HADYZFVIYSCSPC-YOEHRIQHSA-N 1 3 294.870 3.687 20 0 CHADHO CN1CCC[C@H](C[N@H+](C)C/C=C/c2ccc(Cl)cc2)C1 ZINC000508568624 1124115801 /nfs/dbraw/zinc/11/58/01/1124115801.db2.gz KWFHHMHNTFYKSM-LLCTXKFZSA-N 1 3 292.854 3.627 20 0 CHADHO CN1CCC[C@H](C[N@@H+](C)C/C=C/c2ccc(Cl)cc2)C1 ZINC000508568624 1124115802 /nfs/dbraw/zinc/11/58/02/1124115802.db2.gz KWFHHMHNTFYKSM-LLCTXKFZSA-N 1 3 292.854 3.627 20 0 CHADHO C[C@H](CC[NH2+]C[C@@H](C)c1ccccc1)N1CCCCC1 ZINC000446759675 1124122060 /nfs/dbraw/zinc/12/20/60/1124122060.db2.gz PVPNZRNMFKWRMZ-IAGOWNOFSA-N 1 3 274.452 3.644 20 0 CHADHO C[C@@H](C[NH2+]CC[C@@H](C)N1CCCCC1)c1ccccc1 ZINC000446759674 1124122082 /nfs/dbraw/zinc/12/20/82/1124122082.db2.gz PVPNZRNMFKWRMZ-DLBZAZTESA-N 1 3 274.452 3.644 20 0 CHADHO Cc1cc(F)cc(Cl)c1CN(C)CC1CC[NH+](C)CC1 ZINC001238784297 1131248338 /nfs/dbraw/zinc/24/83/38/1131248338.db2.gz GYKKZMBEUFGOSZ-UHFFFAOYSA-N 1 3 298.833 3.561 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H](C)CC(C)(C)C)C1 ZINC000449129830 1124652550 /nfs/dbraw/zinc/65/25/50/1124652550.db2.gz DRVBQLVPOUGJNB-GJZGRUSLSA-N 1 3 254.462 3.521 20 0 CHADHO C[C@@H]([NH2+]CC1CC(C)(C)C1)[C@H]1CCCN(C2CCC2)C1 ZINC000528439864 1124666703 /nfs/dbraw/zinc/66/67/03/1124666703.db2.gz IWYCXAUMWLMRHY-ZBFHGGJFSA-N 1 3 278.484 3.665 20 0 CHADHO C[C@H]1CCC[C@H]([NH+]2CCC(NC3CC(C)(F)C3)CC2)C1 ZINC000449377796 1124715475 /nfs/dbraw/zinc/71/54/75/1124715475.db2.gz UOIZSQBZAHMIPA-PXZKZTPFSA-N 1 3 282.447 3.510 20 0 CHADHO CCC(CC)(CN[C@H]1CCCCC[C@@H]1[NH3+])C(F)(F)F ZINC000873251800 1124755333 /nfs/dbraw/zinc/75/53/33/1124755333.db2.gz XPPSHBQWBQFSEL-RYUDHWBXSA-N 1 3 280.378 3.605 20 0 CHADHO C[C@@H]1CCCC[C@@H]1C[NH2+][C@H]1CCN[C@H](C(C)(C)C)C1 ZINC001246095753 1131309120 /nfs/dbraw/zinc/30/91/20/1131309120.db2.gz RVXVTCAWUKLWBB-WCVJEAGWSA-N 1 3 266.473 3.569 20 0 CHADHO CC(C)n1ccc(-c2ccccc2CN2CCC([NH3+])CC2)c1 ZINC001239078699 1131300970 /nfs/dbraw/zinc/30/09/70/1131300970.db2.gz YARDLZDCLBYNGE-UHFFFAOYSA-N 1 3 297.446 3.659 20 0 CHADHO CN(Cc1cc(C[N@H+](C)CC2CC2)ccc1F)CC1CC1 ZINC000450267969 1124965858 /nfs/dbraw/zinc/96/58/58/1124965858.db2.gz CGSKADXDYGZXKW-UHFFFAOYSA-N 1 3 290.426 3.509 20 0 CHADHO CN(Cc1cc(C[N@@H+](C)CC2CC2)ccc1F)CC1CC1 ZINC000450267969 1124965861 /nfs/dbraw/zinc/96/58/61/1124965861.db2.gz CGSKADXDYGZXKW-UHFFFAOYSA-N 1 3 290.426 3.509 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)C[C@H]2CCCCC2(F)F)C[C@H]1C ZINC000450471561 1125038609 /nfs/dbraw/zinc/03/86/09/1125038609.db2.gz WFYGGSOBCWDXMJ-KFWWJZLASA-N 1 3 288.426 3.617 20 0 CHADHO CCc1ccc2nccc(N3CCC[C@H]([NH+](C)C)CC3)c2c1 ZINC000450488753 1125044928 /nfs/dbraw/zinc/04/49/28/1125044928.db2.gz PCXNIOXFUCKGFK-INIZCTEOSA-N 1 3 297.446 3.718 20 0 CHADHO Cc1cccc([C@@H](NC2C[C@H]3CC[C@@H](C2)[NH2+]3)C(C)C)c1 ZINC000530224858 1125133397 /nfs/dbraw/zinc/13/33/97/1125133397.db2.gz MUZSJIFDJNXUGU-WFFDWFOESA-N 1 3 272.436 3.565 20 0 CHADHO CCC(F)(F)C(C)(C)C[NH2+][C@@H]1C[C@@H](N)c2ccccc21 ZINC000530218455 1125134494 /nfs/dbraw/zinc/13/44/94/1125134494.db2.gz MLSGIQKDULDOJO-ZIAGYGMSSA-N 1 3 282.378 3.792 20 0 CHADHO CCc1c2ccccc2oc1[C@H](C)NCC1=CC[N@H+](C)CC1 ZINC000392242979 1125142974 /nfs/dbraw/zinc/14/29/74/1125142974.db2.gz MQRDQYVATWEBPC-AWEZNQCLSA-N 1 3 298.430 3.908 20 0 CHADHO CCc1c2ccccc2oc1[C@H](C)NCC1=CC[N@@H+](C)CC1 ZINC000392242979 1125142977 /nfs/dbraw/zinc/14/29/77/1125142977.db2.gz MQRDQYVATWEBPC-AWEZNQCLSA-N 1 3 298.430 3.908 20 0 CHADHO CC(C)C[C@H](C)C[C@@H](C)NC[C@]1(F)CCCC[NH2+]C1 ZINC001246116183 1131337085 /nfs/dbraw/zinc/33/70/85/1131337085.db2.gz VKYCQWUEVDUCIL-XHSDSOJGSA-N 1 3 272.452 3.519 20 0 CHADHO CCCCCC[C@@H](CC)NC[C@@]1(C(F)(F)F)CC[NH2+]C1 ZINC001246115986 1131340157 /nfs/dbraw/zinc/34/01/57/1131340157.db2.gz UCDCFHARFLVPNW-ZIAGYGMSSA-N 1 3 294.405 3.867 20 0 CHADHO CCCCN(C)CCC[NH2+][C@H](C)Cc1ccc(Cl)cc1 ZINC001168152489 1125274838 /nfs/dbraw/zinc/27/48/38/1125274838.db2.gz VOGGXGXMCGCETB-OAHLLOKOSA-N 1 3 296.886 3.983 20 0 CHADHO CC1([NH+]2CCC2)CCN([C@H]2CCCc3ccccc32)CC1 ZINC000880472827 1125277079 /nfs/dbraw/zinc/27/70/79/1125277079.db2.gz DVTGYLKPGXMAAM-SFHVURJKSA-N 1 3 284.447 3.624 20 0 CHADHO CC(C)(C[NH2+]C1CCN(C(C)(C)C)CC1)CC(F)F ZINC000883259014 1125386771 /nfs/dbraw/zinc/38/67/71/1125386771.db2.gz YCGCOCAVHSABNX-UHFFFAOYSA-N 1 3 276.415 3.520 20 0 CHADHO CC(C)[C@@H](NC1CC[NH+](C(C)C)CC1)c1ccc(F)cc1 ZINC000035016491 1125422126 /nfs/dbraw/zinc/42/21/26/1125422126.db2.gz FXDNEMUJFHZULW-GOSISDBHSA-N 1 3 292.442 3.985 20 0 CHADHO CSC(C)(C)C[C@H](C)[NH+]1C(C)(C)CC(N)CC1(C)C ZINC001258321375 1129196522 /nfs/dbraw/zinc/19/65/22/1129196522.db2.gz KCCCPMLUPPIFIB-LBPRGKRZSA-N 1 3 286.529 3.887 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3N[C@@H]1CCC[NH2+]CC1 ZINC000643522910 1129443495 /nfs/dbraw/zinc/44/34/95/1129443495.db2.gz URIJDFXOEPYHTI-KDOFPFPSSA-N 1 3 297.446 3.585 20 0 CHADHO CC(C)C1([NH2+]C2CCN([C@@H]3CCCC[C@@H]3C)CC2)CC1 ZINC000645494364 1129499783 /nfs/dbraw/zinc/49/97/83/1129499783.db2.gz HXXUGWLZKVHJAC-DOTOQJQBSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@H](C[N@H+](C1CC1)C1CCNCC1)c1cccc(Cl)c1 ZINC000647482472 1129578345 /nfs/dbraw/zinc/57/83/45/1129578345.db2.gz HTSFXLPSAFZMKH-CYBMUJFWSA-N 1 3 292.854 3.660 20 0 CHADHO C[C@H](C[N@@H+](C1CC1)C1CCNCC1)c1cccc(Cl)c1 ZINC000647482472 1129578348 /nfs/dbraw/zinc/57/83/48/1129578348.db2.gz HTSFXLPSAFZMKH-CYBMUJFWSA-N 1 3 292.854 3.660 20 0 CHADHO C[C@H](CN(C1CC1)C1CC[NH2+]CC1)c1cccc(Cl)c1 ZINC000647482472 1129578351 /nfs/dbraw/zinc/57/83/51/1129578351.db2.gz HTSFXLPSAFZMKH-CYBMUJFWSA-N 1 3 292.854 3.660 20 0 CHADHO C[C@@H](N[C@@H](c1ccco1)c1ccccc1)C1CC[NH+](C)CC1 ZINC000387341333 1129654123 /nfs/dbraw/zinc/65/41/23/1129654123.db2.gz WFWYTUXPFIHUOE-DNVCBOLYSA-N 1 3 298.430 3.689 20 0 CHADHO CCC[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC001169098873 1129696977 /nfs/dbraw/zinc/69/69/77/1129696977.db2.gz LXDGQVIVYCZIGQ-MHORFTMASA-N 1 3 272.436 3.743 20 0 CHADHO CCC[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC001169098873 1129696978 /nfs/dbraw/zinc/69/69/78/1129696978.db2.gz LXDGQVIVYCZIGQ-MHORFTMASA-N 1 3 272.436 3.743 20 0 CHADHO CC[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cc(C)cc(C)c1 ZINC001169118382 1129699951 /nfs/dbraw/zinc/69/99/51/1129699951.db2.gz IVHOSJRHCAUXAW-RDGPPVDQSA-N 1 3 286.463 3.969 20 0 CHADHO CC[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc(C)cc(C)c1 ZINC001169118382 1129699955 /nfs/dbraw/zinc/69/99/55/1129699955.db2.gz IVHOSJRHCAUXAW-RDGPPVDQSA-N 1 3 286.463 3.969 20 0 CHADHO CC[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc(C)c1C ZINC001169119809 1129700008 /nfs/dbraw/zinc/70/00/08/1129700008.db2.gz WMBNYAGDNSPMBU-SFNKJDCFSA-N 1 3 286.463 3.969 20 0 CHADHO CC[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(C)c1C ZINC001169119809 1129700009 /nfs/dbraw/zinc/70/00/09/1129700009.db2.gz WMBNYAGDNSPMBU-SFNKJDCFSA-N 1 3 286.463 3.969 20 0 CHADHO CC(C)C[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC001169090660 1129700284 /nfs/dbraw/zinc/70/02/84/1129700284.db2.gz KEBYDGAQFKFIGX-OKYOBFRVSA-N 1 3 286.463 3.989 20 0 CHADHO CC(C)C[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC001169090660 1129700286 /nfs/dbraw/zinc/70/02/86/1129700286.db2.gz KEBYDGAQFKFIGX-OKYOBFRVSA-N 1 3 286.463 3.989 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](N[C@@H](c1ccccc1)C(C)(C)C)C2 ZINC001169091435 1129700848 /nfs/dbraw/zinc/70/08/48/1129700848.db2.gz QZRFTRJSEVQFEP-MHORFTMASA-N 1 3 286.463 3.989 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](N[C@@H](c1ccccc1)C(C)(C)C)C2 ZINC001169091435 1129700851 /nfs/dbraw/zinc/70/08/51/1129700851.db2.gz QZRFTRJSEVQFEP-MHORFTMASA-N 1 3 286.463 3.989 20 0 CHADHO CS[C@H]1CC[C@H]1NC1CC[NH+](CC2CCCCC2)CC1 ZINC000766602008 1129701554 /nfs/dbraw/zinc/70/15/54/1129701554.db2.gz KPKVYVABESTBAW-SJORKVTESA-N 1 3 296.524 3.515 20 0 CHADHO CS[C@H]1CC[C@H]1[NH2+]C1CCN(CC2CCCCC2)CC1 ZINC000766602008 1129701556 /nfs/dbraw/zinc/70/15/56/1129701556.db2.gz KPKVYVABESTBAW-SJORKVTESA-N 1 3 296.524 3.515 20 0 CHADHO Cc1cccc(C)c1[C@H](C)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169107408 1129703285 /nfs/dbraw/zinc/70/32/85/1129703285.db2.gz GDGMWPVBMOEKIE-LUKYLMHMSA-N 1 3 272.436 3.579 20 0 CHADHO Cc1cccc(C)c1[C@H](C)N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169107408 1129703288 /nfs/dbraw/zinc/70/32/88/1129703288.db2.gz GDGMWPVBMOEKIE-LUKYLMHMSA-N 1 3 272.436 3.579 20 0 CHADHO CN1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1csc3ccccc13)C2 ZINC001169106871 1129703693 /nfs/dbraw/zinc/70/36/93/1129703693.db2.gz APPMBXBTRHFCBA-QKDCVEJESA-N 1 3 286.444 3.616 20 0 CHADHO CC[NH+]1CCC(N[C@@H](CC2CC2)c2cccc(F)c2)CC1 ZINC001169241202 1129712119 /nfs/dbraw/zinc/71/21/19/1129712119.db2.gz JQYOEBWTMCIQMC-SFHVURJKSA-N 1 3 290.426 3.741 20 0 CHADHO CC[C@]1(C)CCC[C@H]1[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000651705934 1129745449 /nfs/dbraw/zinc/74/54/49/1129745449.db2.gz NGARFHVRZSPZMU-BRWVUGGUSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)(CCN1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)C1CC1 ZINC000653586882 1129786324 /nfs/dbraw/zinc/78/63/24/1129786324.db2.gz GJUZOXTZXFLALH-YJBOKZPZSA-N 1 3 290.495 3.761 20 0 CHADHO CC(C)(CCN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)C1CC1 ZINC000653586882 1129786328 /nfs/dbraw/zinc/78/63/28/1129786328.db2.gz GJUZOXTZXFLALH-YJBOKZPZSA-N 1 3 290.495 3.761 20 0 CHADHO C[C@@H](C[NH2+][C@@H]1CCCC(C)(C)CC1)CN1CCCC1 ZINC000086908801 1129829891 /nfs/dbraw/zinc/82/98/91/1129829891.db2.gz AMTYPBMZGRBXBC-JKSUJKDBSA-N 1 3 266.473 3.667 20 0 CHADHO CCCCCC[C@H](CCC)[NH2+][C@H]1CCNC[C@@H]1C ZINC001246212388 1131401283 /nfs/dbraw/zinc/40/12/83/1131401283.db2.gz VDILVXGMJVZWAX-JYJNAYRXSA-N 1 3 254.462 3.713 20 0 CHADHO COc1ccccc1-c1ccc(CNCCC(C)(C)[NH3+])cc1 ZINC000903938469 1130212061 /nfs/dbraw/zinc/21/20/61/1130212061.db2.gz CAZOIBKIMOUELW-UHFFFAOYSA-N 1 3 298.430 3.579 20 0 CHADHO CN(C)c1ccnc(-c2ccc(C[NH2+]C(C)(C)C)cc2)c1 ZINC001240362009 1130277929 /nfs/dbraw/zinc/27/79/29/1130277929.db2.gz ULOSEBJTNHUPTK-UHFFFAOYSA-N 1 3 283.419 3.703 20 0 CHADHO C[C@H](CC[NH2+]C[C@H]1CCc2ccccc21)N1CCCCC1 ZINC000790056716 1130288931 /nfs/dbraw/zinc/28/89/31/1130288931.db2.gz XKXVRPAHRBZVGC-SJLPKXTDSA-N 1 3 286.463 3.571 20 0 CHADHO Cc1ccccc1[C@H](N[C@H]1CC[N@@H+]2CCC[C@H]2C1)C(C)C ZINC000677241699 1130298261 /nfs/dbraw/zinc/29/82/61/1130298261.db2.gz UBCVYNHCWBTWGB-JENIJYKNSA-N 1 3 286.463 3.909 20 0 CHADHO Cc1ccccc1[C@H](N[C@H]1CC[N@H+]2CCC[C@H]2C1)C(C)C ZINC000677241699 1130298266 /nfs/dbraw/zinc/29/82/66/1130298266.db2.gz UBCVYNHCWBTWGB-JENIJYKNSA-N 1 3 286.463 3.909 20 0 CHADHO c1cc(CN2CCC(C[NH+]3CCCCCC3)CC2)cs1 ZINC000678138976 1130357508 /nfs/dbraw/zinc/35/75/08/1130357508.db2.gz GUMDNZWWJXOUGB-UHFFFAOYSA-N 1 3 292.492 3.836 20 0 CHADHO CC(C)c1ccc(CCN[C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000678580363 1130430966 /nfs/dbraw/zinc/43/09/66/1130430966.db2.gz AAERCHQOVLGVDY-OALUTQOASA-N 1 3 286.463 3.569 20 0 CHADHO CC(C)c1ccc(CCN[C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000678580363 1130430968 /nfs/dbraw/zinc/43/09/68/1130430968.db2.gz AAERCHQOVLGVDY-OALUTQOASA-N 1 3 286.463 3.569 20 0 CHADHO C[C@H]1CC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000747100246 1130517641 /nfs/dbraw/zinc/51/76/41/1130517641.db2.gz GOLGBLFDMXMCSM-HOCLYGCPSA-N 1 3 264.457 3.562 20 0 CHADHO CC(C)CC[C@@H](C)N1CCC([NH+]2CCC(F)CC2)CC1 ZINC001256371928 1130639133 /nfs/dbraw/zinc/63/91/33/1130639133.db2.gz WXDVCWQBTHNAIU-OAHLLOKOSA-N 1 3 284.463 3.709 20 0 CHADHO Cc1ccc2ccccc2c1CN1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001234995114 1130699700 /nfs/dbraw/zinc/69/97/00/1130699700.db2.gz XROLXIRRVAULSX-FQEVSTJZSA-N 1 3 294.442 3.724 20 0 CHADHO C[C@H](CCN1CCC[C@]2(CC[NH2+]C2)C1)CC(C)(C)C ZINC001234991469 1130700402 /nfs/dbraw/zinc/70/04/02/1130700402.db2.gz HUCMWJKKJBRRKL-NVXWUHKLSA-N 1 3 266.473 3.524 20 0 CHADHO c1cc(C2CCC2)ccc1C[N@@H+]1CCCC12CCNCC2 ZINC001235145222 1130715016 /nfs/dbraw/zinc/71/50/16/1130715016.db2.gz QVKVKGNCYVDNEL-UHFFFAOYSA-N 1 3 284.447 3.672 20 0 CHADHO c1cc(C2CCC2)ccc1C[N@H+]1CCCC12CCNCC2 ZINC001235145222 1130715018 /nfs/dbraw/zinc/71/50/18/1130715018.db2.gz QVKVKGNCYVDNEL-UHFFFAOYSA-N 1 3 284.447 3.672 20 0 CHADHO CC1=C[C@H](C)[C@H](C[N@@H+]2CCCC[C@]23CCCNC3)CC1 ZINC001235171269 1130717004 /nfs/dbraw/zinc/71/70/04/1130717004.db2.gz IHKLNJCNUVTFIK-OKZBNKHCSA-N 1 3 276.468 3.587 20 0 CHADHO CC1=C[C@H](C)[C@H](C[N@H+]2CCCC[C@]23CCCNC3)CC1 ZINC001235171269 1130717008 /nfs/dbraw/zinc/71/70/08/1130717008.db2.gz IHKLNJCNUVTFIK-OKZBNKHCSA-N 1 3 276.468 3.587 20 0 CHADHO C1=CC2(CCN(CC[C@@H]3CCCC[NH2+]3)CC2)c2ccccc21 ZINC001235187430 1130721790 /nfs/dbraw/zinc/72/17/90/1130721790.db2.gz YVQOENIZHARHNJ-SFHVURJKSA-N 1 3 296.458 3.579 20 0 CHADHO N[C@@]12CCC[C@@H]1C[N@H+](Cc1ccccc1-c1ccccc1)C2 ZINC001235244777 1130726928 /nfs/dbraw/zinc/72/69/28/1130726928.db2.gz KBPXJQVXYDXEPO-UYAOXDASSA-N 1 3 292.426 3.667 20 0 CHADHO N[C@@]12CCC[C@@H]1C[N@@H+](Cc1ccccc1-c1ccccc1)C2 ZINC001235244777 1130726935 /nfs/dbraw/zinc/72/69/35/1130726935.db2.gz KBPXJQVXYDXEPO-UYAOXDASSA-N 1 3 292.426 3.667 20 0 CHADHO [NH3+][C@H]1C[C@@H]2C[C@H]1CN2Cc1ccc(C2CCCCC2)cc1 ZINC001235256293 1130728996 /nfs/dbraw/zinc/72/89/96/1130728996.db2.gz RKXDHRNLJTXXCD-FHWLQOOXSA-N 1 3 284.447 3.656 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CCC[C@@H](CN)C1 ZINC001235672652 1130763892 /nfs/dbraw/zinc/76/38/92/1130763892.db2.gz DZVQKTNOUSIODZ-QGZUEGPWSA-N 1 3 252.446 3.574 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CCC[C@@H](CN)C1 ZINC001235672652 1130763894 /nfs/dbraw/zinc/76/38/94/1130763894.db2.gz DZVQKTNOUSIODZ-QGZUEGPWSA-N 1 3 252.446 3.574 20 0 CHADHO CC/C=C\CCCCCCN1CCC[C@@H](C[NH3+])C1 ZINC001235672652 1130763897 /nfs/dbraw/zinc/76/38/97/1130763897.db2.gz DZVQKTNOUSIODZ-QGZUEGPWSA-N 1 3 252.446 3.574 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)C[N@@H+]2CCC[C@H](CN)C2)cc1 ZINC001235672847 1130765011 /nfs/dbraw/zinc/76/50/11/1130765011.db2.gz IOGXCQBDFKJLAE-SJLPKXTDSA-N 1 3 288.479 3.659 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCC[C@H](CN)C2)cc1 ZINC001235672847 1130765014 /nfs/dbraw/zinc/76/50/14/1130765014.db2.gz IOGXCQBDFKJLAE-SJLPKXTDSA-N 1 3 288.479 3.659 20 0 CHADHO [NH3+]C[C@@H]1CCCN(Cc2ccc(C3CCCCC3)cc2)C1 ZINC001235676183 1130766879 /nfs/dbraw/zinc/76/68/79/1130766879.db2.gz NQKUJECLXFQWCF-KRWDZBQOSA-N 1 3 286.463 3.905 20 0 CHADHO CCN(Cc1cccc(-c2ccccc2)c1)C1CC[NH2+]CC1 ZINC001235759899 1130776640 /nfs/dbraw/zinc/77/66/40/1130776640.db2.gz FALFTIJCUWTBPG-UHFFFAOYSA-N 1 3 294.442 3.928 20 0 CHADHO CC[N@H+](Cc1cccc(-c2ccccc2)c1)C1CCNCC1 ZINC001235759899 1130776645 /nfs/dbraw/zinc/77/66/45/1130776645.db2.gz FALFTIJCUWTBPG-UHFFFAOYSA-N 1 3 294.442 3.928 20 0 CHADHO CC[N@@H+](Cc1cccc(-c2ccccc2)c1)C1CCNCC1 ZINC001235759899 1130776651 /nfs/dbraw/zinc/77/66/51/1130776651.db2.gz FALFTIJCUWTBPG-UHFFFAOYSA-N 1 3 294.442 3.928 20 0 CHADHO [NH3+]C[C@H]1CCN(Cc2ccc(/C=C/c3ccccc3)cc2)C1 ZINC001235749053 1130777068 /nfs/dbraw/zinc/77/70/68/1130777068.db2.gz GDWYNXJGVQNXJA-ROUKRRSUSA-N 1 3 292.426 3.638 20 0 CHADHO [NH3+]C[C@H]1CCN(Cc2ccc3sc4ccccc4c3c2)C1 ZINC001235751389 1130777200 /nfs/dbraw/zinc/77/72/00/1130777200.db2.gz XRYQGTJITLUEPS-CQSZACIVSA-N 1 3 296.439 3.835 20 0 CHADHO CC1([NH3+])CCN(Cc2cccc3c4ccccc4oc32)CC1 ZINC001235748297 1130777452 /nfs/dbraw/zinc/77/74/52/1130777452.db2.gz KMZTXYPUOSTJPE-UHFFFAOYSA-N 1 3 294.398 3.899 20 0 CHADHO Cc1cccc(-c2ccc(CN3CC4(CC([NH3+])C4)C3)cc2)c1 ZINC001235821044 1130783292 /nfs/dbraw/zinc/78/32/92/1130783292.db2.gz XVXKUSYZFFFZKT-UHFFFAOYSA-N 1 3 292.426 3.585 20 0 CHADHO Cc1c(C[N@H+]2C[C@@H](N)CC[C@H]2C)cccc1-c1ccccc1 ZINC001235891740 1130795435 /nfs/dbraw/zinc/79/54/35/1130795435.db2.gz IQJMHKCVFVLDFS-BEFAXECRSA-N 1 3 294.442 3.974 20 0 CHADHO Cc1c(C[N@@H+]2C[C@@H](N)CC[C@H]2C)cccc1-c1ccccc1 ZINC001235891740 1130795441 /nfs/dbraw/zinc/79/54/41/1130795441.db2.gz IQJMHKCVFVLDFS-BEFAXECRSA-N 1 3 294.442 3.974 20 0 CHADHO CC[C@@H]1CO[C@](C)(CCC(C)C)N1CCC12CC([NH3+])(C1)C2 ZINC001235962209 1130819388 /nfs/dbraw/zinc/81/93/88/1130819388.db2.gz MRANZFBWEXNNSX-MRLCAUJQSA-N 1 3 294.483 3.521 20 0 CHADHO Cc1c(C[N@H+]2C[C@H](N)C[C@H](C)C2)cccc1-c1ccccc1 ZINC001236052436 1130840892 /nfs/dbraw/zinc/84/08/92/1130840892.db2.gz QVVREKPCLJIMHY-HNAYVOBHSA-N 1 3 294.442 3.831 20 0 CHADHO Cc1c(C[N@@H+]2C[C@H](N)C[C@H](C)C2)cccc1-c1ccccc1 ZINC001236052436 1130840899 /nfs/dbraw/zinc/84/08/99/1130840899.db2.gz QVVREKPCLJIMHY-HNAYVOBHSA-N 1 3 294.442 3.831 20 0 CHADHO CSc1ccccc1[C@@H]1CCCN1C[C@@H]1CCC[NH2+]C1 ZINC001236109675 1130866344 /nfs/dbraw/zinc/86/63/44/1130866344.db2.gz VNVLVDJVOLGJEG-ZBFHGGJFSA-N 1 3 290.476 3.545 20 0 CHADHO CCCc1ccc(CN(CCC)C2CC[NH2+]CC2)s1 ZINC001236181712 1130880140 /nfs/dbraw/zinc/88/01/40/1130880140.db2.gz BREGJQSDUZZVLB-UHFFFAOYSA-N 1 3 280.481 3.665 20 0 CHADHO CCCc1ccc(C[N@@H+](CCC)C2CCNCC2)s1 ZINC001236181712 1130880147 /nfs/dbraw/zinc/88/01/47/1130880147.db2.gz BREGJQSDUZZVLB-UHFFFAOYSA-N 1 3 280.481 3.665 20 0 CHADHO CCCc1ccc(C[N@H+](CCC)C2CCNCC2)s1 ZINC001236181712 1130880154 /nfs/dbraw/zinc/88/01/54/1130880154.db2.gz BREGJQSDUZZVLB-UHFFFAOYSA-N 1 3 280.481 3.665 20 0 CHADHO CCCN(Cc1cc(C)cc(Cl)c1)C1CC[NH2+]CC1 ZINC001236185065 1130880283 /nfs/dbraw/zinc/88/02/83/1130880283.db2.gz VGCILKAMCDZHOX-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO CCC[N@H+](Cc1cc(C)cc(Cl)c1)C1CCNCC1 ZINC001236185065 1130880289 /nfs/dbraw/zinc/88/02/89/1130880289.db2.gz VGCILKAMCDZHOX-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO CCC[N@@H+](Cc1cc(C)cc(Cl)c1)C1CCNCC1 ZINC001236185065 1130880295 /nfs/dbraw/zinc/88/02/95/1130880295.db2.gz VGCILKAMCDZHOX-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO C[N@H+](Cc1ccc(C(C)(C)C)cc1)[C@@H]1CCCC[C@H]1N ZINC001236211415 1130887023 /nfs/dbraw/zinc/88/70/23/1130887023.db2.gz HWMNYBZHMSXAHL-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO C[N@@H+](Cc1ccc(C(C)(C)C)cc1)[C@@H]1CCCC[C@H]1N ZINC001236211415 1130887032 /nfs/dbraw/zinc/88/70/32/1130887032.db2.gz HWMNYBZHMSXAHL-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO C[N@H+](Cc1c[nH]c2c1cccc2Cl)[C@@H]1CCCC[C@H]1N ZINC001236214729 1130889116 /nfs/dbraw/zinc/88/91/16/1130889116.db2.gz DWSNVQLURBLEJU-HUUCEWRRSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@@H+](Cc1c[nH]c2c1cccc2Cl)[C@@H]1CCCC[C@H]1N ZINC001236214729 1130889120 /nfs/dbraw/zinc/88/91/20/1130889120.db2.gz DWSNVQLURBLEJU-HUUCEWRRSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@H+](Cc1cccc(C(C)(C)C)c1)[C@@H]1CCCC[C@H]1N ZINC001236213882 1130890895 /nfs/dbraw/zinc/89/08/95/1130890895.db2.gz CEIYSXNWISSYGE-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO C[N@@H+](Cc1cccc(C(C)(C)C)c1)[C@@H]1CCCC[C@H]1N ZINC001236213882 1130890903 /nfs/dbraw/zinc/89/09/03/1130890903.db2.gz CEIYSXNWISSYGE-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO C[N@H+](Cc1cccc(C(C)(C)C)c1)[C@@H]1CCCC[C@@H]1N ZINC001236213880 1130890957 /nfs/dbraw/zinc/89/09/57/1130890957.db2.gz CEIYSXNWISSYGE-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO C[N@@H+](Cc1cccc(C(C)(C)C)c1)[C@@H]1CCCC[C@@H]1N ZINC001236213880 1130890966 /nfs/dbraw/zinc/89/09/66/1130890966.db2.gz CEIYSXNWISSYGE-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO C[N@H+](Cc1ccc(F)c2ccccc12)C1(C)CCNCC1 ZINC001236226728 1130896760 /nfs/dbraw/zinc/89/67/60/1130896760.db2.gz SDFMPJHKLJQTGH-UHFFFAOYSA-N 1 3 286.394 3.553 20 0 CHADHO C[N@@H+](Cc1ccc(F)c2ccccc12)C1(C)CCNCC1 ZINC001236226728 1130896765 /nfs/dbraw/zinc/89/67/65/1130896765.db2.gz SDFMPJHKLJQTGH-UHFFFAOYSA-N 1 3 286.394 3.553 20 0 CHADHO CN(Cc1ccc(F)c2ccccc12)C1(C)CC[NH2+]CC1 ZINC001236226728 1130896770 /nfs/dbraw/zinc/89/67/70/1130896770.db2.gz SDFMPJHKLJQTGH-UHFFFAOYSA-N 1 3 286.394 3.553 20 0 CHADHO CC(C)CCC[N@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236372642 1130922156 /nfs/dbraw/zinc/92/21/56/1130922156.db2.gz RNVIYIOUDWZUNL-INIZCTEOSA-N 1 3 266.473 3.667 20 0 CHADHO CC(C)CCC[N@@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236372642 1130922159 /nfs/dbraw/zinc/92/21/59/1130922159.db2.gz RNVIYIOUDWZUNL-INIZCTEOSA-N 1 3 266.473 3.667 20 0 CHADHO Cc1cc(C)cc([C@@H]2CCCN2CC[C@H]2CCCC[NH2+]2)c1 ZINC001236428891 1130940045 /nfs/dbraw/zinc/94/00/45/1130940045.db2.gz QCPKVTFUDZXOAK-MOPGFXCFSA-N 1 3 286.463 3.973 20 0 CHADHO Cc1ccc(C[N@H+](CC(C)(C)C)C2CCNCC2)cc1F ZINC001236458059 1130946637 /nfs/dbraw/zinc/94/66/37/1130946637.db2.gz QNUHAIKGJMZSSU-UHFFFAOYSA-N 1 3 292.442 3.734 20 0 CHADHO Cc1ccc(C[N@@H+](CC(C)(C)C)C2CCNCC2)cc1F ZINC001236458059 1130946639 /nfs/dbraw/zinc/94/66/39/1130946639.db2.gz QNUHAIKGJMZSSU-UHFFFAOYSA-N 1 3 292.442 3.734 20 0 CHADHO Cc1cc(F)ccc1C[N@H+](CC(C)(C)C)C1CCNCC1 ZINC001236458591 1130946884 /nfs/dbraw/zinc/94/68/84/1130946884.db2.gz YGZSYLYBFCYCHP-UHFFFAOYSA-N 1 3 292.442 3.734 20 0 CHADHO Cc1cc(F)ccc1C[N@@H+](CC(C)(C)C)C1CCNCC1 ZINC001236458591 1130946892 /nfs/dbraw/zinc/94/68/92/1130946892.db2.gz YGZSYLYBFCYCHP-UHFFFAOYSA-N 1 3 292.442 3.734 20 0 CHADHO Cc1cc(F)ccc1CN(CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236458591 1130946898 /nfs/dbraw/zinc/94/68/98/1130946898.db2.gz YGZSYLYBFCYCHP-UHFFFAOYSA-N 1 3 292.442 3.734 20 0 CHADHO CC1=CC[C@H](CC[N@H+](C[C@@H]2CCCNC2)C2CC2)C1(C)C ZINC001236584613 1130980784 /nfs/dbraw/zinc/98/07/84/1130980784.db2.gz MIVVBCUOTZUAAF-IAGOWNOFSA-N 1 3 290.495 3.833 20 0 CHADHO CC1=CC[C@H](CC[N@@H+](C[C@@H]2CCCNC2)C2CC2)C1(C)C ZINC001236584613 1130980787 /nfs/dbraw/zinc/98/07/87/1130980787.db2.gz MIVVBCUOTZUAAF-IAGOWNOFSA-N 1 3 290.495 3.833 20 0 CHADHO Cc1cc(F)ccc1[C@H](C)[NH2+]C1CCN(CC2CC2)CC1 ZINC000815561950 1130999991 /nfs/dbraw/zinc/99/99/91/1130999991.db2.gz TZLPGAVCMFPQOX-AWEZNQCLSA-N 1 3 290.426 3.659 20 0 CHADHO Cc1cc(F)ccc1[C@H](C)[NH2+][C@H]1CCC[C@H](N(C)C)C1 ZINC000815586157 1131003605 /nfs/dbraw/zinc/00/36/05/1131003605.db2.gz ARDPKKYXXAOBCP-BPUTZDHNSA-N 1 3 278.415 3.658 20 0 CHADHO CCCN(CCc1ccc(C(C)C)cc1)C[C@H]1CC[NH2+]C1 ZINC001236829481 1131016295 /nfs/dbraw/zinc/01/62/95/1131016295.db2.gz KONDSEDACURVIN-SFHVURJKSA-N 1 3 288.479 3.674 20 0 CHADHO CCCN(Cc1csc2ccccc12)C[C@H]1CC[NH2+]C1 ZINC001236835845 1131019775 /nfs/dbraw/zinc/01/97/75/1131019775.db2.gz PXQWYMYLJMFBOH-AWEZNQCLSA-N 1 3 288.460 3.723 20 0 CHADHO CC(C)[N@H+](Cc1ccc2n1CCNC2)[C@@H](C)c1ccccc1 ZINC001236860745 1131025708 /nfs/dbraw/zinc/02/57/08/1131025708.db2.gz UOKKAAPREQTOMD-INIZCTEOSA-N 1 3 297.446 3.563 20 0 CHADHO CC(C)[N@@H+](Cc1ccc2n1CCNC2)[C@@H](C)c1ccccc1 ZINC001236860745 1131025715 /nfs/dbraw/zinc/02/57/15/1131025715.db2.gz UOKKAAPREQTOMD-INIZCTEOSA-N 1 3 297.446 3.563 20 0 CHADHO C[N@H+](CCCN1CCCC1)Cc1ccc2cccccc1-2 ZINC001237190548 1131068783 /nfs/dbraw/zinc/06/87/83/1131068783.db2.gz KHVHQNSJLSOPOE-UHFFFAOYSA-N 1 3 282.431 3.709 20 0 CHADHO C[N@@H+](CCCN1CCCC1)Cc1ccc2cccccc1-2 ZINC001237190548 1131068789 /nfs/dbraw/zinc/06/87/89/1131068789.db2.gz KHVHQNSJLSOPOE-UHFFFAOYSA-N 1 3 282.431 3.709 20 0 CHADHO Cc1ccc(CN2CC[C@@H]3[NH2+]CCC[C@@H]3C2)c2ccccc12 ZINC001237389109 1131094504 /nfs/dbraw/zinc/09/45/04/1131094504.db2.gz FSMDPPCAMJERQM-XLIONFOSSA-N 1 3 294.442 3.722 20 0 CHADHO CC(C)C1=NCCc2ccc(C[NH+]3CC4CC(C4)C3)cc21 ZINC001237890501 1131148784 /nfs/dbraw/zinc/14/87/84/1131148784.db2.gz WZYIKCCUBOONAX-UHFFFAOYSA-N 1 3 282.431 3.530 20 0 CHADHO C(CC1CCCCCCC1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246235444 1131422032 /nfs/dbraw/zinc/42/20/32/1131422032.db2.gz GRLDJUJSXULNHR-PIIMJCKOSA-N 1 3 278.484 4.000 20 0 CHADHO Cc1ccc(C[NH+]2CCC(N(C)C)CC2)c2ccccc12 ZINC001138013703 1131450741 /nfs/dbraw/zinc/45/07/41/1131450741.db2.gz UDHKABKIWSTZBN-UHFFFAOYSA-N 1 3 282.431 3.674 20 0 CHADHO CC[C@@H]1C[C@H](N[C@H]2CC23CCCCC3)C[C@H](CC)[NH2+]1 ZINC001246333585 1131474660 /nfs/dbraw/zinc/47/46/60/1131474660.db2.gz KEIQKNZGPVZFFC-JJXSEGSLSA-N 1 3 264.457 3.608 20 0 CHADHO CCCC[C@H](CC(C)C)[N@@H+]1CCC(F)(F)[C@H](CN)C1 ZINC001246555812 1131617848 /nfs/dbraw/zinc/61/78/48/1131617848.db2.gz HUJUTRVSUNMIPV-ZIAGYGMSSA-N 1 3 276.415 3.507 20 0 CHADHO CCCC[C@H](CC(C)C)[N@H+]1CCC(F)(F)[C@H](CN)C1 ZINC001246555812 1131617850 /nfs/dbraw/zinc/61/78/50/1131617850.db2.gz HUJUTRVSUNMIPV-ZIAGYGMSSA-N 1 3 276.415 3.507 20 0 CHADHO C[C@@H]1[C@H](CN)CCC[N@@H+]1[C@H]1CCCC2(CCCCC2)C1 ZINC001246565086 1131630799 /nfs/dbraw/zinc/63/07/99/1131630799.db2.gz OORMQGCWPDPDOL-IKGGRYGDSA-N 1 3 278.484 3.939 20 0 CHADHO C[C@@H]1[C@H](CN)CCC[N@H+]1[C@H]1CCCC2(CCCCC2)C1 ZINC001246565086 1131630802 /nfs/dbraw/zinc/63/08/02/1131630802.db2.gz OORMQGCWPDPDOL-IKGGRYGDSA-N 1 3 278.484 3.939 20 0 CHADHO C[C@@H]1CCC[N@@H+]([C@@H]2CCNC3(CCCCC3)C2)C[C@@H]1C ZINC001246577434 1131664773 /nfs/dbraw/zinc/66/47/73/1131664773.db2.gz WLTYRIYXCQNGGH-IXDOHACOSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H]1CCC[N@H+]([C@@H]2CCNC3(CCCCC3)C2)C[C@@H]1C ZINC001246577434 1131664775 /nfs/dbraw/zinc/66/47/75/1131664775.db2.gz WLTYRIYXCQNGGH-IXDOHACOSA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)CC[C@H](C)[N@H+](C(C)C)[C@@H]1CCCNCC1 ZINC001246595914 1131710390 /nfs/dbraw/zinc/71/03/90/1131710390.db2.gz UFEHEBORQHGDKW-JKSUJKDBSA-N 1 3 254.462 3.664 20 0 CHADHO CC(C)CC[C@H](C)[N@@H+](C(C)C)[C@@H]1CCCNCC1 ZINC001246595914 1131710392 /nfs/dbraw/zinc/71/03/92/1131710392.db2.gz UFEHEBORQHGDKW-JKSUJKDBSA-N 1 3 254.462 3.664 20 0 CHADHO CCCCC(CCCC)[N@@H+]1CC[C@]2(C1)CCCNC2 ZINC001246613902 1131718334 /nfs/dbraw/zinc/71/83/34/1131718334.db2.gz ZTJRAMSRFYRZLW-QGZVFWFLSA-N 1 3 266.473 3.811 20 0 CHADHO CCCCC(CCCC)[N@H+]1CC[C@]2(C1)CCCNC2 ZINC001246613902 1131718337 /nfs/dbraw/zinc/71/83/37/1131718337.db2.gz ZTJRAMSRFYRZLW-QGZVFWFLSA-N 1 3 266.473 3.811 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]C2CCN(C(C)(C)C)CC2)c(C)n1 ZINC000772950170 1131721424 /nfs/dbraw/zinc/72/14/24/1131721424.db2.gz GCQSUPQSYHXDKJ-OAHLLOKOSA-N 1 3 289.467 3.612 20 0 CHADHO CCN(CC)CCC[N@@H+]1CC[C@H](c2ccccc2)C1(C)C ZINC001171268484 1131781522 /nfs/dbraw/zinc/78/15/22/1131781522.db2.gz XFRCCMHAKISERW-GOSISDBHSA-N 1 3 288.479 3.986 20 0 CHADHO CCN(CC)CCC[N@H+]1CC[C@H](c2ccccc2)C1(C)C ZINC001171268484 1131781525 /nfs/dbraw/zinc/78/15/25/1131781525.db2.gz XFRCCMHAKISERW-GOSISDBHSA-N 1 3 288.479 3.986 20 0 CHADHO CCCCN1CCC([N@H+](C)Cc2ccc(F)cc2C)CC1 ZINC001140781393 1131914074 /nfs/dbraw/zinc/91/40/74/1131914074.db2.gz RVHZPDMQPVBXIM-UHFFFAOYSA-N 1 3 292.442 3.830 20 0 CHADHO CCCCN1CCC([N@@H+](C)Cc2ccc(F)cc2C)CC1 ZINC001140781393 1131914079 /nfs/dbraw/zinc/91/40/79/1131914079.db2.gz RVHZPDMQPVBXIM-UHFFFAOYSA-N 1 3 292.442 3.830 20 0 CHADHO CC(C)=CCN[C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716717191 1132030786 /nfs/dbraw/zinc/03/07/86/1132030786.db2.gz IWANFAWGMGKPRJ-FHWLQOOXSA-N 1 3 284.447 3.595 20 0 CHADHO CC(C)=CCN[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716717191 1132030792 /nfs/dbraw/zinc/03/07/92/1132030792.db2.gz IWANFAWGMGKPRJ-FHWLQOOXSA-N 1 3 284.447 3.595 20 0 CHADHO CC(C)=CC[NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000716717191 1132030798 /nfs/dbraw/zinc/03/07/98/1132030798.db2.gz IWANFAWGMGKPRJ-FHWLQOOXSA-N 1 3 284.447 3.595 20 0 CHADHO CCCCN(C)CCC[NH2+][C@H]1CCc2c(C)cccc2C1 ZINC001171549748 1132051896 /nfs/dbraw/zinc/05/18/96/1132051896.db2.gz FLIWVZIRBXHNJL-SFHVURJKSA-N 1 3 288.479 3.564 20 0 CHADHO CCCCC[N@H+](C)C1CC(C)(C)N(C)C(C)(C)C1 ZINC001171628622 1132060687 /nfs/dbraw/zinc/06/06/87/1132060687.db2.gz DAOFXYNJRSPFHF-UHFFFAOYSA-N 1 3 254.462 3.760 20 0 CHADHO CCCCC[N@@H+](C)C1CC(C)(C)N(C)C(C)(C)C1 ZINC001171628622 1132060694 /nfs/dbraw/zinc/06/06/94/1132060694.db2.gz DAOFXYNJRSPFHF-UHFFFAOYSA-N 1 3 254.462 3.760 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@@H]2CC23CCCC3)CC1(C)C ZINC001171625275 1132067217 /nfs/dbraw/zinc/06/72/17/1132067217.db2.gz FICWMOBVJMGIHM-CQSZACIVSA-N 1 3 264.457 3.560 20 0 CHADHO Cc1cccc([C@H](C)N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC001172100221 1132126212 /nfs/dbraw/zinc/12/62/12/1132126212.db2.gz BIYNADVETDPSBW-LEUOFYLZSA-N 1 3 272.436 3.661 20 0 CHADHO Cc1cccc([C@H](C)N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC001172100221 1132126214 /nfs/dbraw/zinc/12/62/14/1132126214.db2.gz BIYNADVETDPSBW-LEUOFYLZSA-N 1 3 272.436 3.661 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC3(CC[C@@H](F)C3)CC1)C2 ZINC001172129047 1132127542 /nfs/dbraw/zinc/12/75/42/1132127542.db2.gz VUTYLZNIYAFSHU-NCOADZHNSA-N 1 3 294.458 3.606 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cc3ccccc3o1)C2 ZINC001172104672 1132129876 /nfs/dbraw/zinc/12/98/76/1132129876.db2.gz DZRZQPXQSYLGTQ-PHZGNYQRSA-N 1 3 284.403 3.538 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H]3CCCC[C@H]31)C2 ZINC001172123505 1132136224 /nfs/dbraw/zinc/13/62/24/1132136224.db2.gz GNFDJNPAYOPJTF-QXDIGNSFSA-N 1 3 276.468 3.656 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@@H]3CCCC[C@H]31)C2 ZINC001172123505 1132136227 /nfs/dbraw/zinc/13/62/27/1132136227.db2.gz GNFDJNPAYOPJTF-QXDIGNSFSA-N 1 3 276.468 3.656 20 0 CHADHO CCOCC[C@@H](C)[N@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001172430502 1132207342 /nfs/dbraw/zinc/20/73/42/1132207342.db2.gz GVWRFFMUJDNTAQ-MRXNPFEDSA-N 1 3 296.499 3.530 20 0 CHADHO CCOCC[C@@H](C)[N@@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001172430502 1132207346 /nfs/dbraw/zinc/20/73/46/1132207346.db2.gz GVWRFFMUJDNTAQ-MRXNPFEDSA-N 1 3 296.499 3.530 20 0 CHADHO C[C@@H]1C[C@H]([NH2+]C2CCN(CC3CCCCC3)CC2)CS1 ZINC000840856016 1132295364 /nfs/dbraw/zinc/29/53/64/1132295364.db2.gz OWCDHMKSGPBFSR-PBHICJAKSA-N 1 3 296.524 3.515 20 0 CHADHO C[C@@H]1C[C@H](NC2CC[NH+](CC3CCCCC3)CC2)CS1 ZINC000840856016 1132295369 /nfs/dbraw/zinc/29/53/69/1132295369.db2.gz OWCDHMKSGPBFSR-PBHICJAKSA-N 1 3 296.524 3.515 20 0 CHADHO CCCCCC[C@@H](C)[NH2+][C@H]1CCNC2(CCC2)C1 ZINC000841090199 1132325332 /nfs/dbraw/zinc/32/53/32/1132325332.db2.gz MODVEYCUZPZZRM-CABCVRRESA-N 1 3 252.446 3.610 20 0 CHADHO CCCOC1CCC([NH+]2C(C)(C)CC(N)CC2(C)C)CC1 ZINC001173092219 1132383930 /nfs/dbraw/zinc/38/39/30/1132383930.db2.gz JNYQAIIOMZVLNE-UHFFFAOYSA-N 1 3 296.499 3.705 20 0 CHADHO CC[NH+](CC)C1CCC(NCc2c(F)cccc2F)CC1 ZINC001173106513 1132392392 /nfs/dbraw/zinc/39/23/92/1132392392.db2.gz XHODATOLFZWEOT-UHFFFAOYSA-N 1 3 296.405 3.707 20 0 CHADHO c1c2c[nH]ccc-2nc1C[N@@H+]1CCC[C@H](c2ccccc2)C1 ZINC001232013873 1132411441 /nfs/dbraw/zinc/41/14/41/1132411441.db2.gz DYCUEBCFIRZWAC-INIZCTEOSA-N 1 3 291.398 3.943 20 0 CHADHO c1c2c[nH]ccc-2nc1C[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC001232013873 1132411445 /nfs/dbraw/zinc/41/14/45/1132411445.db2.gz DYCUEBCFIRZWAC-INIZCTEOSA-N 1 3 291.398 3.943 20 0 CHADHO C[N@H+](CCc1ccccc1Cl)Cc1cc2cnccc2[nH]1 ZINC001232014874 1132411587 /nfs/dbraw/zinc/41/15/87/1132411587.db2.gz VZXXQGDMWCHSOK-UHFFFAOYSA-N 1 3 299.805 3.891 20 0 CHADHO C[N@@H+](CCc1ccccc1Cl)Cc1cc2cnccc2[nH]1 ZINC001232014874 1132411593 /nfs/dbraw/zinc/41/15/93/1132411593.db2.gz VZXXQGDMWCHSOK-UHFFFAOYSA-N 1 3 299.805 3.891 20 0 CHADHO CCCC[C@@H](CC(C)C)[NH2+]CC[C@H]1CCCN1C ZINC001173248773 1132419088 /nfs/dbraw/zinc/41/90/88/1132419088.db2.gz FYNWSYBACGNXFS-JKSUJKDBSA-N 1 3 254.462 3.665 20 0 CHADHO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1cc(F)cc(CN(C)C)c1 ZINC001232144209 1132427047 /nfs/dbraw/zinc/42/70/47/1132427047.db2.gz KGBIVJCTXTVSHY-ZIAGYGMSSA-N 1 3 278.415 3.650 20 0 CHADHO CC[C@H]1CCCC[N@@H+]1Cc1cc(F)cc(CN(C)C)c1 ZINC001232146696 1132427162 /nfs/dbraw/zinc/42/71/62/1132427162.db2.gz ZEWPQQRAOFJJAH-KRWDZBQOSA-N 1 3 278.415 3.652 20 0 CHADHO CC[C@H]1CCCC[N@H+]1Cc1cc(F)cc(CN(C)C)c1 ZINC001232146696 1132427163 /nfs/dbraw/zinc/42/71/63/1132427163.db2.gz ZEWPQQRAOFJJAH-KRWDZBQOSA-N 1 3 278.415 3.652 20 0 CHADHO C[C@@H]1CCC[N@H+](Cc2cc(F)cc(CN(C)C)c2)C[C@H]1C ZINC001232144348 1132427505 /nfs/dbraw/zinc/42/75/05/1132427505.db2.gz IYUODTKZBWVXMF-HUUCEWRRSA-N 1 3 292.442 3.755 20 0 CHADHO C[C@@H]1CCC[N@@H+](Cc2cc(F)cc(CN(C)C)c2)C[C@H]1C ZINC001232144348 1132427511 /nfs/dbraw/zinc/42/75/11/1132427511.db2.gz IYUODTKZBWVXMF-HUUCEWRRSA-N 1 3 292.442 3.755 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@@H+]2CCC[C@H]3CCC[C@H]32)c1 ZINC001232146714 1132428483 /nfs/dbraw/zinc/42/84/83/1132428483.db2.gz ZWEDBQNMIHHUAE-SJLPKXTDSA-N 1 3 290.426 3.652 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@H+]2CCC[C@H]3CCC[C@H]32)c1 ZINC001232146714 1132428486 /nfs/dbraw/zinc/42/84/86/1132428486.db2.gz ZWEDBQNMIHHUAE-SJLPKXTDSA-N 1 3 290.426 3.652 20 0 CHADHO CC[C@@H]1CCCC[N@@H+]1Cc1cc(F)cc(CN(C)C)c1 ZINC001232146697 1132428575 /nfs/dbraw/zinc/42/85/75/1132428575.db2.gz ZEWPQQRAOFJJAH-QGZVFWFLSA-N 1 3 278.415 3.652 20 0 CHADHO CC[C@@H]1CCCC[N@H+]1Cc1cc(F)cc(CN(C)C)c1 ZINC001232146697 1132428578 /nfs/dbraw/zinc/42/85/78/1132428578.db2.gz ZEWPQQRAOFJJAH-QGZVFWFLSA-N 1 3 278.415 3.652 20 0 CHADHO CCCC[N@H+](CCC)Cc1cc(F)cc(CN(C)C)c1 ZINC001232147352 1132428584 /nfs/dbraw/zinc/42/85/84/1132428584.db2.gz PIDKXSFONWICCZ-UHFFFAOYSA-N 1 3 280.431 3.899 20 0 CHADHO CCCC[N@@H+](CCC)Cc1cc(F)cc(CN(C)C)c1 ZINC001232147352 1132428586 /nfs/dbraw/zinc/42/85/86/1132428586.db2.gz PIDKXSFONWICCZ-UHFFFAOYSA-N 1 3 280.431 3.899 20 0 CHADHO CC[C@H]1CC[C@@H](N2CCC([NH3+])(c3cccc(F)c3)CC2)C1 ZINC001173269124 1132434121 /nfs/dbraw/zinc/43/41/21/1132434121.db2.gz FSFZCJQNLGOCLI-WMLDXEAASA-N 1 3 290.426 3.654 20 0 CHADHO CC[C@H]1CC[C@@H](N2CCC([NH3+])(c3ccc(F)cc3)CC2)C1 ZINC001173270599 1132434892 /nfs/dbraw/zinc/43/48/92/1132434892.db2.gz NWOYBUFDCUSRDD-WMLDXEAASA-N 1 3 290.426 3.654 20 0 CHADHO [NH3+]CCCCCCNCc1c(Cl)cccc1Cl ZINC000843129482 1132496374 /nfs/dbraw/zinc/49/63/74/1132496374.db2.gz URSRUHRJVQFYTR-UHFFFAOYSA-N 1 3 275.223 3.602 20 0 CHADHO Cc1c(C)c(C)c(C[N@@H+]2CCCC[C@H](CN)C2)c(C)c1C ZINC001206632060 1132545130 /nfs/dbraw/zinc/54/51/30/1132545130.db2.gz FLXBGECAFNLAJP-GOSISDBHSA-N 1 3 288.479 3.790 20 0 CHADHO Cc1c(C)c(C)c(C[N@H+]2CCCC[C@H](CN)C2)c(C)c1C ZINC001206632060 1132545136 /nfs/dbraw/zinc/54/51/36/1132545136.db2.gz FLXBGECAFNLAJP-GOSISDBHSA-N 1 3 288.479 3.790 20 0 CHADHO CC(C)(C)c1cc(Nc2ccc3c(c2)C[C@@H]([NH3+])C3)ccn1 ZINC001159832144 1132914253 /nfs/dbraw/zinc/91/42/53/1132914253.db2.gz DHEZMQJPJKHXJF-AWEZNQCLSA-N 1 3 281.403 3.549 20 0 CHADHO CC(C)c1ccc(CC[NH2+]C[C@@H]2CCCCN(C)C2)cc1 ZINC001206680593 1133125587 /nfs/dbraw/zinc/12/55/87/1133125587.db2.gz NQNPUGAPRCJUFK-SFHVURJKSA-N 1 3 288.479 3.674 20 0 CHADHO Cc1ccc(C[N@@H+]2CCCC[C@@H]2CCN2CCCC2)cc1 ZINC001204172232 1133415306 /nfs/dbraw/zinc/41/53/06/1133415306.db2.gz ZQWBQJKMZNECQZ-LJQANCHMSA-N 1 3 286.463 3.835 20 0 CHADHO Cc1ccc(C[N@H+]2CCCC[C@@H]2CCN2CCCC2)cc1 ZINC001204172232 1133415308 /nfs/dbraw/zinc/41/53/08/1133415308.db2.gz ZQWBQJKMZNECQZ-LJQANCHMSA-N 1 3 286.463 3.835 20 0 CHADHO Cc1ccc(-c2ccc(CN3CCC[C@@H]([NH3+])CC3)cc2)o1 ZINC001205110310 1133531043 /nfs/dbraw/zinc/53/10/43/1133531043.db2.gz RSXFNSMGYNQCOK-QGZVFWFLSA-N 1 3 284.403 3.568 20 0 CHADHO Cc1c(C[N@H+]2CC[C@@H](N)[C@H]2C)cccc1-c1ccccc1 ZINC001205201614 1133546418 /nfs/dbraw/zinc/54/64/18/1133546418.db2.gz GUAOUTBVLPWHLE-DNVCBOLYSA-N 1 3 280.415 3.584 20 0 CHADHO Cc1c(C[N@@H+]2CC[C@@H](N)[C@H]2C)cccc1-c1ccccc1 ZINC001205201614 1133546420 /nfs/dbraw/zinc/54/64/20/1133546420.db2.gz GUAOUTBVLPWHLE-DNVCBOLYSA-N 1 3 280.415 3.584 20 0 CHADHO C[C@H](C[N@@H+]1CC[C@H](C)[C@H](CN)C1)c1cccc2ccccc21 ZINC001205296078 1133555848 /nfs/dbraw/zinc/55/58/48/1133555848.db2.gz GEVJZTLDRKQFBH-LZLYRXPVSA-N 1 3 296.458 3.860 20 0 CHADHO C[C@H](C[N@H+]1CC[C@H](C)[C@H](CN)C1)c1cccc2ccccc21 ZINC001205296078 1133555853 /nfs/dbraw/zinc/55/58/53/1133555853.db2.gz GEVJZTLDRKQFBH-LZLYRXPVSA-N 1 3 296.458 3.860 20 0 CHADHO Cc1ccc(-c2ccc(CN3CC[C@@H](C)[C@H](C[NH3+])C3)cc2)o1 ZINC001205303602 1133557047 /nfs/dbraw/zinc/55/70/47/1133557047.db2.gz IJGITNAXGOGKKA-RDTXWAMCSA-N 1 3 298.430 3.672 20 0 CHADHO Cc1ccc(-c2ccc(CN3CC[C@@H](C)[C@@H](C[NH3+])C3)cc2)o1 ZINC001205303600 1133557384 /nfs/dbraw/zinc/55/73/84/1133557384.db2.gz IJGITNAXGOGKKA-KDOFPFPSSA-N 1 3 298.430 3.672 20 0 CHADHO CC[C@@H](C)[C@@H](CNC(C)(C)CC[NH+]1CCCCCC1)OC ZINC001205470623 1133580456 /nfs/dbraw/zinc/58/04/56/1133580456.db2.gz AYVKASDWAGAVSL-IAGOWNOFSA-N 1 3 298.515 3.682 20 0 CHADHO C[C@@H]1CC[C@@H](CN)[N@H+](Cc2cccc3c(F)cccc23)C1 ZINC001205856555 1133623252 /nfs/dbraw/zinc/62/32/52/1133623252.db2.gz WUUWVUPEXPADRT-HIFRSBDPSA-N 1 3 286.394 3.538 20 0 CHADHO C[C@@H]1CC[C@@H](CN)[N@@H+](Cc2cccc3c(F)cccc23)C1 ZINC001205856555 1133623256 /nfs/dbraw/zinc/62/32/56/1133623256.db2.gz WUUWVUPEXPADRT-HIFRSBDPSA-N 1 3 286.394 3.538 20 0 CHADHO Cc1c(C[N@H+]2CCNC[C@H](C)C2)cccc1-c1ccccc1 ZINC001206284413 1133683132 /nfs/dbraw/zinc/68/31/32/1133683132.db2.gz DBEBRUYJYQSIOK-INIZCTEOSA-N 1 3 294.442 3.703 20 0 CHADHO Cc1c(C[N@@H+]2CCNC[C@H](C)C2)cccc1-c1ccccc1 ZINC001206284413 1133683136 /nfs/dbraw/zinc/68/31/36/1133683136.db2.gz DBEBRUYJYQSIOK-INIZCTEOSA-N 1 3 294.442 3.703 20 0 CHADHO Cc1ccc(Cl)c(CN2CCC[C@](C)(C[NH3+])CC2)c1F ZINC001206303697 1133686863 /nfs/dbraw/zinc/68/68/63/1133686863.db2.gz GCWMMMVHENTKTB-INIZCTEOSA-N 1 3 298.833 3.738 20 0 CHADHO CC(C)=CCC[C@@H](C)CCN1CCCC[C@](F)(C[NH3+])C1 ZINC001206337006 1133692019 /nfs/dbraw/zinc/69/20/19/1133692019.db2.gz QBOQRGRWGRLPAW-SJORKVTESA-N 1 3 284.463 3.912 20 0 CHADHO C[C@@]1(C[NH3+])CCCCN(Cc2ccc(C(F)F)cc2)C1 ZINC001206554566 1133716822 /nfs/dbraw/zinc/71/68/22/1133716822.db2.gz FNVFQSHIHNMCIL-INIZCTEOSA-N 1 3 282.378 3.575 20 0 CHADHO CC1(CN2CCC(C)([NH+]3CCCC3)CC2)CCCCC1 ZINC001208903534 1133960775 /nfs/dbraw/zinc/96/07/75/1133960775.db2.gz SDKACQSKZOVZFT-UHFFFAOYSA-N 1 3 278.484 3.907 20 0 CHADHO c1ccc(CN2CC[C@@H](C[NH+]3C4CCCC3CCC4)C2)cc1 ZINC001208957356 1133970019 /nfs/dbraw/zinc/97/00/19/1133970019.db2.gz KQMVPHSZFIQGPK-XEVCZEQESA-N 1 3 298.474 3.916 20 0 CHADHO CC/C=C\CCCCCC[NH+]1CCC2(CN(C)C2)CC1 ZINC001209288105 1134003387 /nfs/dbraw/zinc/00/33/87/1134003387.db2.gz CIDHESVXMCNSDC-PLNGDYQASA-N 1 3 278.484 3.931 20 0 CHADHO C[N@H+](CCCN1CCCCC1)CCc1cccc(Cl)c1 ZINC001209450967 1134024556 /nfs/dbraw/zinc/02/45/56/1134024556.db2.gz PLJURIRDZCJTBK-UHFFFAOYSA-N 1 3 294.870 3.690 20 0 CHADHO C[N@@H+](CCCN1CCCCC1)CCc1cccc(Cl)c1 ZINC001209450967 1134024561 /nfs/dbraw/zinc/02/45/61/1134024561.db2.gz PLJURIRDZCJTBK-UHFFFAOYSA-N 1 3 294.870 3.690 20 0 CHADHO C[C@@H]1CCN(Cc2ccc(-c3ccccc3)cc2)C[C@@H]1C[NH3+] ZINC000317926509 1135176123 /nfs/dbraw/zinc/17/61/23/1135176123.db2.gz PFMAPLDZXNPKBZ-UZLBHIALSA-N 1 3 294.442 3.770 20 0 CHADHO C[N@@H+]1CC[C@H](NCc2ccc(C3CC3)cc2)[C@@H]2CCC[C@@H]21 ZINC000353688040 529806782 /nfs/dbraw/zinc/80/67/82/529806782.db2.gz NVAQHLLNIYEDMM-FHWLQOOXSA-N 1 3 284.447 3.526 20 0 CHADHO C[N@H+]1CC[C@H](NCc2ccc(C3CC3)cc2)[C@@H]2CCC[C@@H]21 ZINC000353688040 529806783 /nfs/dbraw/zinc/80/67/83/529806783.db2.gz NVAQHLLNIYEDMM-FHWLQOOXSA-N 1 3 284.447 3.526 20 0 CHADHO C[C@H](Cc1cccs1)N[C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000093515140 260290024 /nfs/dbraw/zinc/29/00/24/260290024.db2.gz RSZITHBBFVYVFR-ZNMIVQPWSA-N 1 3 280.481 3.580 20 0 CHADHO CCCN1CC[C@@H](C[NH2+]C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000187705786 260042459 /nfs/dbraw/zinc/04/24/59/260042459.db2.gz BWZBXTVZQLCQEC-CABCVRRESA-N 1 3 294.870 3.765 20 0 CHADHO C[C@H](C[NH2+]C1CC(c2ccccc2)C1)CN1CCCCC1 ZINC000038041973 174044311 /nfs/dbraw/zinc/04/43/11/174044311.db2.gz DTESOZYFTNZNTJ-IPJUCJBFSA-N 1 3 286.463 3.644 20 0 CHADHO C[C@H](CNC1CC(c2ccccc2)C1)C[NH+]1CCCCC1 ZINC000038041973 174044313 /nfs/dbraw/zinc/04/43/13/174044313.db2.gz DTESOZYFTNZNTJ-IPJUCJBFSA-N 1 3 286.463 3.644 20 0 CHADHO C[C@@H]1CCC[N@H+](CCCCN[C@@H]2CCCc3occc32)C1 ZINC000192677669 227262590 /nfs/dbraw/zinc/26/25/90/227262590.db2.gz JTMBPZWVAHTFEE-NVXWUHKLSA-N 1 3 290.451 3.759 20 0 CHADHO C[C@@H]1CCC[N@@H+](CCCCN[C@@H]2CCCc3occc32)C1 ZINC000192677669 227262593 /nfs/dbraw/zinc/26/25/93/227262593.db2.gz JTMBPZWVAHTFEE-NVXWUHKLSA-N 1 3 290.451 3.759 20 0 CHADHO C[NH+](C)Cc1ccc(CNCc2ccc3occc3c2)cc1 ZINC000352252479 228206999 /nfs/dbraw/zinc/20/69/99/228206999.db2.gz ZIADPYMOECFENP-UHFFFAOYSA-N 1 3 294.398 3.784 20 0 CHADHO CC[C@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc(Cl)c1 ZINC000037649101 260115404 /nfs/dbraw/zinc/11/54/04/260115404.db2.gz CPWICGKPQTUAFJ-GUYCJALGSA-N 1 3 292.854 3.865 20 0 CHADHO CC[C@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1cccc(Cl)c1 ZINC000037649101 260115405 /nfs/dbraw/zinc/11/54/05/260115405.db2.gz CPWICGKPQTUAFJ-GUYCJALGSA-N 1 3 292.854 3.865 20 0 CHADHO C[C@H]1CCCCN1CCC[NH2+]Cc1cccc2[nH]ccc21 ZINC000070938681 260158540 /nfs/dbraw/zinc/15/85/40/260158540.db2.gz DOTGKXKVMBIAAC-HNNXBMFYSA-N 1 3 285.435 3.522 20 0 CHADHO CC[C@H](N[C@@H]1CC[N@H+](C)[C@H](C)C1)c1cccc(Cl)c1 ZINC000091959939 260267245 /nfs/dbraw/zinc/26/72/45/260267245.db2.gz GPADXURDIJDRIU-WQVCFCJDSA-N 1 3 280.843 3.863 20 0 CHADHO CC[C@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc(Cl)c1 ZINC000091959939 260267246 /nfs/dbraw/zinc/26/72/46/260267246.db2.gz GPADXURDIJDRIU-WQVCFCJDSA-N 1 3 280.843 3.863 20 0 CHADHO C[C@H](Cc1cccs1)N[C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000093515142 260290405 /nfs/dbraw/zinc/29/04/05/260290405.db2.gz RSZITHBBFVYVFR-KFWWJZLASA-N 1 3 280.481 3.580 20 0 CHADHO C[C@H](CN[C@@H]1C[C@H](C)c2ccccc21)C[NH+]1CCCC1 ZINC000313585314 260303308 /nfs/dbraw/zinc/30/33/08/260303308.db2.gz YKVXSEWYLRDOJQ-RVKKMQEKSA-N 1 3 272.436 3.556 20 0 CHADHO C[C@H](C[NH2+][C@@H]1C[C@H](C)c2ccccc21)CN1CCCC1 ZINC000313585314 260303309 /nfs/dbraw/zinc/30/33/09/260303309.db2.gz YKVXSEWYLRDOJQ-RVKKMQEKSA-N 1 3 272.436 3.556 20 0 CHADHO CC(C)(CN[C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1)c1cccs1 ZINC000127590179 260369128 /nfs/dbraw/zinc/36/91/28/260369128.db2.gz NQJGNELQOXSAPI-SOUVJXGZSA-N 1 3 292.492 3.536 20 0 CHADHO CC(C)(C)[C@H](N[C@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000129012084 260380378 /nfs/dbraw/zinc/38/03/78/260380378.db2.gz AZRFESRJHKCIDK-JKSUJKDBSA-N 1 3 260.425 3.506 20 0 CHADHO CC(C)(C)[C@@H](NC[C@H]1CCC[NH2+]C1)c1ccc(F)cc1 ZINC000130952315 260399393 /nfs/dbraw/zinc/39/93/93/260399393.db2.gz UQQAYABQKXOSPA-BBRMVZONSA-N 1 3 278.415 3.502 20 0 CHADHO CC(C)[N@H+](C)Cc1cccc(CN[C@H](C)c2ccncc2)c1 ZINC000156517009 261124885 /nfs/dbraw/zinc/12/48/85/261124885.db2.gz ACHAWBHZNQSNFU-MRXNPFEDSA-N 1 3 297.446 3.773 20 0 CHADHO CC(C)[N@@H+](C)Cc1cccc(CN[C@H](C)c2ccncc2)c1 ZINC000156517009 261124888 /nfs/dbraw/zinc/12/48/88/261124888.db2.gz ACHAWBHZNQSNFU-MRXNPFEDSA-N 1 3 297.446 3.773 20 0 CHADHO Cc1cccc2c1ncc(C)c2N1CCC([NH2+]C(C)C)CC1 ZINC000185293533 262049074 /nfs/dbraw/zinc/04/90/74/262049074.db2.gz NVSSSHSQBPRQFX-UHFFFAOYSA-N 1 3 297.446 3.818 20 0 CHADHO Cc1ccc(C[NH2+]CCCN2CCC(C)CC2)c(C)c1 ZINC000019999897 262212475 /nfs/dbraw/zinc/21/24/75/262212475.db2.gz WJYKUBSMAZAMPH-UHFFFAOYSA-N 1 3 274.452 3.515 20 0 CHADHO CC(C)CN1CCC([NH2+][C@@H](C)c2ccc(F)cc2)CC1 ZINC000221765954 262295795 /nfs/dbraw/zinc/29/57/95/262295795.db2.gz COIPWULODJFLQJ-AWEZNQCLSA-N 1 3 278.415 3.597 20 0 CHADHO CC(C)[C@H]1C[C@H](NCCC[NH+](C(C)C)C(C)C)CS1 ZINC000488454848 262325850 /nfs/dbraw/zinc/32/58/50/262325850.db2.gz ZTEYUEMCTFVBIM-JKSUJKDBSA-N 1 3 286.529 3.615 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](c2ccc(C)cc2)C2CCC2)C1 ZINC000187023595 262335229 /nfs/dbraw/zinc/33/52/29/262335229.db2.gz FRANYLXMAQJEJF-VQIMIIECSA-N 1 3 286.463 3.768 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H](c2ccc(C)cc2)C2CCC2)C1 ZINC000187023595 262335230 /nfs/dbraw/zinc/33/52/30/262335230.db2.gz FRANYLXMAQJEJF-VQIMIIECSA-N 1 3 286.463 3.768 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H](c2ccc(C)cc2)C2CCC2)C1 ZINC000187023595 262335231 /nfs/dbraw/zinc/33/52/31/262335231.db2.gz FRANYLXMAQJEJF-VQIMIIECSA-N 1 3 286.463 3.768 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]CCCN2CCC(C)CC2)s1 ZINC000021502622 262387585 /nfs/dbraw/zinc/38/75/85/262387585.db2.gz NQIIZPXVDZXJJU-HNNXBMFYSA-N 1 3 280.481 3.829 20 0 CHADHO c1cc2c(s1)CCC[C@H]2[NH2+]CCCN1CCCCC1 ZINC000061325108 262394265 /nfs/dbraw/zinc/39/42/65/262394265.db2.gz RWDXAHGNASOAPE-OAHLLOKOSA-N 1 3 278.465 3.591 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCCC[C@@H]1CN)c1cccc(Cl)c1 ZINC000414791462 263048936 /nfs/dbraw/zinc/04/89/36/263048936.db2.gz BFQPZZTZMOXGOS-XNRPHZJLSA-N 1 3 280.843 3.551 20 0 CHADHO Cc1cc(CNCc2ccc([C@H](C)[NH3+])cc2)ccc1Cl ZINC000414804003 263051826 /nfs/dbraw/zinc/05/18/26/263051826.db2.gz DOAJIGBHDZSLJX-ZDUSSCGKSA-N 1 3 288.822 3.958 20 0 CHADHO CCC[C@H](CNCC([NH3+])(CC)CC)c1ccccc1 ZINC000414804434 263051967 /nfs/dbraw/zinc/05/19/67/263051967.db2.gz DYCCCNQHQIYYHW-MRXNPFEDSA-N 1 3 262.441 3.677 20 0 CHADHO Cc1cc(C)cc(CNCc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000414808882 263052528 /nfs/dbraw/zinc/05/25/28/263052528.db2.gz LDWCBGOVRKLAET-HNNXBMFYSA-N 1 3 268.404 3.613 20 0 CHADHO COc1ccccc1/C=C/CNCc1ccc([C@H](C)[NH3+])cc1 ZINC000414808136 263052605 /nfs/dbraw/zinc/05/26/05/263052605.db2.gz KIIKUTSTNHLZGB-ZKKXHLJNSA-N 1 3 296.414 3.518 20 0 CHADHO Cc1cc(C)c(CNCc2ccc([C@@H](C)[NH3+])cc2)c(C)c1 ZINC000414812373 263053374 /nfs/dbraw/zinc/05/33/74/263053374.db2.gz RCIQRFRIZHAAKZ-MRXNPFEDSA-N 1 3 282.431 3.921 20 0 CHADHO CCCOc1cccc(CNCc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000414814635 263053508 /nfs/dbraw/zinc/05/35/08/263053508.db2.gz VSWPSEZNQXCQHB-HNNXBMFYSA-N 1 3 298.430 3.785 20 0 CHADHO CCCOc1cccc(CNCc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000414814637 263053751 /nfs/dbraw/zinc/05/37/51/263053751.db2.gz VSWPSEZNQXCQHB-OAHLLOKOSA-N 1 3 298.430 3.785 20 0 CHADHO C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@H](C)[C@@H]1CCCNC1 ZINC000414827634 263055744 /nfs/dbraw/zinc/05/57/44/263055744.db2.gz YDOOGPVZEJMZRA-BRWVUGGUSA-N 1 3 288.479 3.721 20 0 CHADHO C[C@@H](CNCC1([NH3+])CCCCC1)c1cccc(Cl)c1 ZINC000414844233 263058528 /nfs/dbraw/zinc/05/85/28/263058528.db2.gz PGBHFGPXNGHKRD-ZDUSSCGKSA-N 1 3 280.843 3.695 20 0 CHADHO [NH3+]C1(CNCCCc2c(F)cccc2Cl)CCCCC1 ZINC000414846098 263060974 /nfs/dbraw/zinc/06/09/74/263060974.db2.gz SGZYZUQAWGQOGE-UHFFFAOYSA-N 1 3 298.833 3.663 20 0 CHADHO Cc1cccc(CC[C@@H](C)NCC2([NH3+])CCCCC2)c1 ZINC000414849468 263065291 /nfs/dbraw/zinc/06/52/91/263065291.db2.gz XOPHHJHFPAWQBD-MRXNPFEDSA-N 1 3 274.452 3.567 20 0 CHADHO C[C@@H]([NH2+]C1CCC(c2ccccc2)CC1)[C@@H]1CCCNC1 ZINC000414855003 263071763 /nfs/dbraw/zinc/07/17/63/263071763.db2.gz MOYKHYXMNYDPAX-ZTRSQXPZSA-N 1 3 286.463 3.691 20 0 CHADHO C[C@@H](CNCC1([NH3+])CCCCCC1)c1ccc(F)cc1 ZINC000414861998 263075447 /nfs/dbraw/zinc/07/54/47/263075447.db2.gz UHBJESYMBNQSPE-AWEZNQCLSA-N 1 3 278.415 3.571 20 0 CHADHO C[C@H](CC[NH3+])NCc1ccc(Sc2ccccc2)cc1 ZINC000414896596 263104557 /nfs/dbraw/zinc/10/45/57/263104557.db2.gz PNWABUOIHODPDD-CQSZACIVSA-N 1 3 286.444 3.665 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+][C@H]1CCN[C@H](C)C1 ZINC000414944332 263153625 /nfs/dbraw/zinc/15/36/25/263153625.db2.gz GRRXVQRCXRYAPI-NXHRZFHOSA-N 1 3 274.452 3.518 20 0 CHADHO C[C@H](CC1CC1)N[C@@H](C[NH3+])c1ccc2ccccc2c1 ZINC000414946352 263155317 /nfs/dbraw/zinc/15/53/17/263155317.db2.gz TVKXEBSMYAENOF-ACJLOTCBSA-N 1 3 268.404 3.618 20 0 CHADHO Clc1scc(CNCCC[C@@H]2CCC[NH2+]2)c1Cl ZINC000414965651 263168617 /nfs/dbraw/zinc/16/86/17/263168617.db2.gz NPBIYEWVNFABMA-SNVBAGLBSA-N 1 3 293.263 3.677 20 0 CHADHO C[C@@H](CCCC[NH3+])NCc1c(Cl)cccc1Cl ZINC000415013815 263254918 /nfs/dbraw/zinc/25/49/18/263254918.db2.gz LCSSFQVFINAMHQ-JTQLQIEISA-N 1 3 275.223 3.601 20 0 CHADHO c1ccc2cc(CN3CCCC[C@H]3[C@@H]3CC[NH2+]C3)ccc2c1 ZINC000415036704 263257223 /nfs/dbraw/zinc/25/72/23/263257223.db2.gz GCSCNTULBQCJHC-UXHICEINSA-N 1 3 294.442 3.804 20 0 CHADHO Clc1ccccc1[C@H]1CCC[C@H]1[NH2+]CCCNC1CC1 ZINC000415065974 263259437 /nfs/dbraw/zinc/25/94/37/263259437.db2.gz IFDIBLDBPXDDLG-NVXWUHKLSA-N 1 3 292.854 3.708 20 0 CHADHO c1ccc([C@@H]2C[C@H](N[C@H]3CCc4ccccc43)CC[NH2+]2)cc1 ZINC000415109504 263273054 /nfs/dbraw/zinc/27/30/54/263273054.db2.gz PQHVBZCXLMQLOD-HOJAQTOUSA-N 1 3 292.426 3.757 20 0 CHADHO c1cc(N2CCC([NH2+][C@H]3CCC[C@@H](C4CC4)C3)CC2)ccn1 ZINC000425375947 264215368 /nfs/dbraw/zinc/21/53/68/264215368.db2.gz VHRHADNUOUXINL-AEFFLSMTSA-N 1 3 299.462 3.609 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@H]1C[NH3+])c1ccc(Cl)c(Cl)c1 ZINC000252678191 264305173 /nfs/dbraw/zinc/30/51/73/264305173.db2.gz FFHAAQCNAXYGOX-NURSFMCSSA-N 1 3 287.234 3.771 20 0 CHADHO CCSc1ccc([C@H](C)[NH2+]CC2=CCN(C)CC2)cc1 ZINC000344295959 265056442 /nfs/dbraw/zinc/05/64/42/265056442.db2.gz LBDHJVWNTPLXLF-AWEZNQCLSA-N 1 3 290.476 3.711 20 0 CHADHO CC[C@@H](NCC[C@H]1CCCC[N@@H+]1C)c1ccc(C)cc1 ZINC000356818648 266179659 /nfs/dbraw/zinc/17/96/59/266179659.db2.gz WLKQQXMKSDSMRC-QZTJIDSGSA-N 1 3 274.452 3.910 20 0 CHADHO CC[C@@H](NCC[C@H]1CCCC[N@H+]1C)c1ccc(C)cc1 ZINC000356818648 266179660 /nfs/dbraw/zinc/17/96/60/266179660.db2.gz WLKQQXMKSDSMRC-QZTJIDSGSA-N 1 3 274.452 3.910 20 0 CHADHO CC(C)[C@@H]1C[C@@H]([NH2+]C2CCN(C3CCCC3)CC2)CS1 ZINC000368460543 267173918 /nfs/dbraw/zinc/17/39/18/267173918.db2.gz DOQJJYWEZVGYMW-WBVHZDCISA-N 1 3 296.524 3.513 20 0 CHADHO CC(C)[C@@H]1C[C@@H](NC2CC[NH+](C3CCCC3)CC2)CS1 ZINC000368460543 267173920 /nfs/dbraw/zinc/17/39/20/267173920.db2.gz DOQJJYWEZVGYMW-WBVHZDCISA-N 1 3 296.524 3.513 20 0 CHADHO C[NH+](C)Cc1ccc(CN[C@@H]2CCc3cc(F)ccc32)cc1 ZINC000171132517 327647932 /nfs/dbraw/zinc/64/79/32/327647932.db2.gz XAFZLPSTUSDRPW-LJQANCHMSA-N 1 3 298.405 3.664 20 0 CHADHO CN(C)Cc1ccc(C[NH2+]C[C@@H]2C[C@@H]2c2ccccc2)cc1 ZINC000503220949 327883819 /nfs/dbraw/zinc/88/38/19/327883819.db2.gz RMVFOHBSHWIADR-VQTJNVASSA-N 1 3 294.442 3.642 20 0 CHADHO CCN1CC[C@H]([NH2+]Cc2ccc(-c3ccccc3)o2)[C@H](C)C1 ZINC000531683891 328021121 /nfs/dbraw/zinc/02/11/21/328021121.db2.gz SEJBQIMSLBZVEA-QAPCUYQASA-N 1 3 298.430 3.767 20 0 CHADHO C[NH+](C)CC[C@@H](N[C@H]1CCc2ccccc21)C(C)(C)C ZINC000531714903 328027918 /nfs/dbraw/zinc/02/79/18/328027918.db2.gz RLXUEMGNKJXHKX-DLBZAZTESA-N 1 3 274.452 3.630 20 0 CHADHO C[C@@H](C[C@@H]1CCCCC[NH2+]1)NCCCc1cccs1 ZINC000582719736 329129875 /nfs/dbraw/zinc/12/98/75/329129875.db2.gz VDEBUZVLALMLOX-GJZGRUSLSA-N 1 3 280.481 3.581 20 0 CHADHO C[C@H](N)[C@@H]1CCC[N@@H+]([C@@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000414652029 328208455 /nfs/dbraw/zinc/20/84/55/328208455.db2.gz CWSQRQWRRIAWHF-ISARSNTHSA-N 1 3 286.463 3.556 20 0 CHADHO C[C@H](N)[C@@H]1CCC[N@H+]([C@@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000414652029 328208456 /nfs/dbraw/zinc/20/84/56/328208456.db2.gz CWSQRQWRRIAWHF-ISARSNTHSA-N 1 3 286.463 3.556 20 0 CHADHO CCC([NH3+])(CC)CN[C@@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC000414802880 328231426 /nfs/dbraw/zinc/23/14/26/328231426.db2.gz BYINDHPFDSKCMY-IAGOWNOFSA-N 1 3 274.452 3.738 20 0 CHADHO [NH3+]CCC[C@@H](NCc1ccc(Cl)s1)c1ccccc1 ZINC000415052383 328299133 /nfs/dbraw/zinc/29/91/33/328299133.db2.gz KXBFXCVTMPKXKW-CQSZACIVSA-N 1 3 294.851 3.971 20 0 CHADHO Cc1cc(C)c(CN[C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)c(C)c1 ZINC000415081556 328302442 /nfs/dbraw/zinc/30/24/42/328302442.db2.gz KUNFHGZOBHFJLY-QXAKKESOSA-N 1 3 286.463 3.622 20 0 CHADHO CCCc1ccc([C@@H](C)N[C@@H](C)CC[NH+](C)C)cc1 ZINC000049553345 328371795 /nfs/dbraw/zinc/37/17/95/328371795.db2.gz KSSDKZPWEQCZAG-LSDHHAIUSA-N 1 3 262.441 3.630 20 0 CHADHO CC(C)[C@H]([NH2+]CCCN(C(C)C)C(C)C)C1CC1 ZINC000531981006 328373996 /nfs/dbraw/zinc/37/39/96/328373996.db2.gz FIUGHDTYKMWPQT-INIZCTEOSA-N 1 3 254.462 3.520 20 0 CHADHO CCCCN1CCC([NH2+]Cc2cc(C)sc2C)CC1 ZINC000049686589 328378117 /nfs/dbraw/zinc/37/81/17/328378117.db2.gz QKDCPOKBJRHCAN-UHFFFAOYSA-N 1 3 280.481 3.719 20 0 CHADHO C1CC1[C@@H]1CC[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000558241311 327080688 /nfs/dbraw/zinc/08/06/88/327080688.db2.gz NSKAELOJOURVIK-ROUUACIJSA-N 1 3 276.468 3.562 20 0 CHADHO CC(C)=CC[N@H+](C)CCC1CCN(c2ccncc2)CC1 ZINC000092821648 327195573 /nfs/dbraw/zinc/19/55/73/327195573.db2.gz OSYDMOJNRJUOGA-UHFFFAOYSA-N 1 3 287.451 3.586 20 0 CHADHO CC(C)=CC[N@@H+](C)CCC1CCN(c2ccncc2)CC1 ZINC000092821648 327195574 /nfs/dbraw/zinc/19/55/74/327195574.db2.gz OSYDMOJNRJUOGA-UHFFFAOYSA-N 1 3 287.451 3.586 20 0 CHADHO Cc1cccc(C)c1C[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000215822551 327212414 /nfs/dbraw/zinc/21/24/14/327212414.db2.gz KNYYFAJWVGBSEH-UHFFFAOYSA-N 1 3 274.452 3.656 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN([C@H]2C=CCCCCC2)C1 ZINC000559796364 327262007 /nfs/dbraw/zinc/26/20/07/327262007.db2.gz SGAFGVHDJFABLI-IRXDYDNUSA-N 1 3 264.457 3.539 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN([C@H]2C=CCCCCC2)C1 ZINC000559796364 327262009 /nfs/dbraw/zinc/26/20/09/327262009.db2.gz SGAFGVHDJFABLI-IRXDYDNUSA-N 1 3 264.457 3.539 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+]([C@H]2C=CCCCCC2)C1 ZINC000559796364 327262010 /nfs/dbraw/zinc/26/20/10/327262010.db2.gz SGAFGVHDJFABLI-IRXDYDNUSA-N 1 3 264.457 3.539 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+]([C@H]2C=CCCCCC2)C1 ZINC000559796364 327262012 /nfs/dbraw/zinc/26/20/12/327262012.db2.gz SGAFGVHDJFABLI-IRXDYDNUSA-N 1 3 264.457 3.539 20 0 CHADHO CC(C)C(C[NH2+]C[C@@H]1CCCN(C(C)C)C1)C(C)C ZINC000560047598 327280479 /nfs/dbraw/zinc/28/04/79/327280479.db2.gz AROVMIWLGYQZSQ-INIZCTEOSA-N 1 3 268.489 3.625 20 0 CHADHO CC(C)[C@@H]1C[C@@H](C[NH2+][C@H]2CCC[C@H](N)C2)c2ccccc21 ZINC000566484061 327394093 /nfs/dbraw/zinc/39/40/93/327394093.db2.gz ZOQFEMXJGAFIBW-FPXQBCRKSA-N 1 3 286.463 3.773 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](NC2CC(F)(c3cccc(Cl)c3)C2)C1 ZINC000566926626 327502228 /nfs/dbraw/zinc/50/22/28/327502228.db2.gz OADYRVDIHBFZMC-QVOMUQBLSA-N 1 3 296.817 3.527 20 0 CHADHO C[NH+](C)CCCC(C)(C)NCc1cccc(Cl)c1F ZINC000395710657 328757442 /nfs/dbraw/zinc/75/74/42/328757442.db2.gz CEOZVFCIEJYKMX-UHFFFAOYSA-N 1 3 286.822 3.689 20 0 CHADHO CCC[C@@H]([NH2+]C1CCN(c2ccncc2)CC1)C1CCC1 ZINC000324776069 328793292 /nfs/dbraw/zinc/79/32/92/328793292.db2.gz FEZKNTCTTRQXFP-GOSISDBHSA-N 1 3 287.451 3.609 20 0 CHADHO CCN(C)C[C@@H]1CC[N@H+](Cc2c(C)oc3ccccc32)C1 ZINC000180043990 329214845 /nfs/dbraw/zinc/21/48/45/329214845.db2.gz SYEITWNHDMQBTQ-HNNXBMFYSA-N 1 3 286.419 3.515 20 0 CHADHO CCN(C)C[C@@H]1CC[N@@H+](Cc2c(C)oc3ccccc32)C1 ZINC000180043990 329214846 /nfs/dbraw/zinc/21/48/46/329214846.db2.gz SYEITWNHDMQBTQ-HNNXBMFYSA-N 1 3 286.419 3.515 20 0 CHADHO C[C@@H]([NH2+]CC1(CN(C)C)CCCC1)c1ccsc1 ZINC000183952167 329255252 /nfs/dbraw/zinc/25/52/52/329255252.db2.gz YUWQYDBBHYHIMY-CYBMUJFWSA-N 1 3 266.454 3.521 20 0 CHADHO CC[C@@H]1CCC[C@@H](C[N@@H+]2CCC[C@H](N(C)C)CC2)C1 ZINC000432801296 330038147 /nfs/dbraw/zinc/03/81/47/330038147.db2.gz VIWFSUMFMQAXPT-ZACQAIPSSA-N 1 3 266.473 3.619 20 0 CHADHO CC[C@@H]1CCC[C@@H](C[N@H+]2CCC[C@H](N(C)C)CC2)C1 ZINC000432801296 330038148 /nfs/dbraw/zinc/03/81/48/330038148.db2.gz VIWFSUMFMQAXPT-ZACQAIPSSA-N 1 3 266.473 3.619 20 0 CHADHO CC1CCN(CCC[NH2+][C@@H]2CC[C@H]2C(C)(C)C)CC1 ZINC000580479792 330146971 /nfs/dbraw/zinc/14/69/71/330146971.db2.gz HUYYPKZFUJNTLL-HZPDHXFCSA-N 1 3 266.473 3.523 20 0 CHADHO c1cc(CN2CCCC[C@H]2[C@H]2CC[NH2+]C2)cc(C2CC2)c1 ZINC000422550835 330148998 /nfs/dbraw/zinc/14/89/98/330148998.db2.gz BZTDUNDNWPOYME-OALUTQOASA-N 1 3 284.447 3.528 20 0 CHADHO CC(C)(CC[NH3+])NCc1cccc(-c2ccccc2)c1 ZINC000422560195 330149239 /nfs/dbraw/zinc/14/92/39/330149239.db2.gz GEACSEFIQMXWLC-UHFFFAOYSA-N 1 3 268.404 3.571 20 0 CHADHO Cc1ccc(CN[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c(C)c1 ZINC000422691773 330150731 /nfs/dbraw/zinc/15/07/31/330150731.db2.gz IYGRTDMZVMSHFD-UXHICEINSA-N 1 3 294.442 3.886 20 0 CHADHO CCCC[C@@H]1CCC[C@@H]1[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000422710386 330151398 /nfs/dbraw/zinc/15/13/98/330151398.db2.gz LCCVDOXRFPJCTK-RKVPGOIHSA-N 1 3 289.467 3.858 20 0 CHADHO CCCC[C@@H]1CCC[C@@H]1[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000422710208 330151476 /nfs/dbraw/zinc/15/14/76/330151476.db2.gz LCCVDOXRFPJCTK-DAYGRLMNSA-N 1 3 289.467 3.858 20 0 CHADHO CCCC[C@H](N[C@H](C)C[C@H](C)[NH3+])c1ccc(OC)cc1 ZINC000422717979 330152080 /nfs/dbraw/zinc/15/20/80/330152080.db2.gz WHIPUWQFYNZJLA-VBQJREDUSA-N 1 3 278.440 3.642 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CCCCC(C)(C)C ZINC000422718209 330152115 /nfs/dbraw/zinc/15/21/15/330152115.db2.gz PIXPAMRXTQUYLF-CYBMUJFWSA-N 1 3 277.456 3.716 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC[C@@H]1CCCC[C@H]1C ZINC000422730610 330152420 /nfs/dbraw/zinc/15/24/20/330152420.db2.gz MHWMBAZAHDJKNO-YCPHGPKFSA-N 1 3 289.467 3.716 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC[C@H]1CCCC[C@H]1C ZINC000422730608 330152596 /nfs/dbraw/zinc/15/25/96/330152596.db2.gz MHWMBAZAHDJKNO-IJEWVQPXSA-N 1 3 289.467 3.716 20 0 CHADHO CC(C)(C)[C@@H](CC1CCCCC1)[NH2+]C1CCNCC1 ZINC000422741873 330152918 /nfs/dbraw/zinc/15/29/18/330152918.db2.gz FIIUCNRUGWXUDC-MRXNPFEDSA-N 1 3 266.473 3.713 20 0 CHADHO CC(C)(C)[C@H](CC1CCCCC1)[NH2+]C1CCNCC1 ZINC000422741872 330153032 /nfs/dbraw/zinc/15/30/32/330153032.db2.gz FIIUCNRUGWXUDC-INIZCTEOSA-N 1 3 266.473 3.713 20 0 CHADHO C[C@@H](N[C@@H](C)c1ccc2ccccc2c1)[C@H]1CCC[NH2+]C1 ZINC000422749596 330153496 /nfs/dbraw/zinc/15/34/96/330153496.db2.gz ZVIYJEOEKVXFAH-KHYOSLBOSA-N 1 3 282.431 3.879 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@H](c1ccc(Cl)cc1)C1CC1 ZINC000422757626 330153735 /nfs/dbraw/zinc/15/37/35/330153735.db2.gz HWAOMKAEOGQESN-PGUXBMHVSA-N 1 3 266.816 3.507 20 0 CHADHO [NH3+]C[C@@H]1CCCC[C@H]1NCCSc1ccc(Cl)cc1 ZINC000422765212 330154075 /nfs/dbraw/zinc/15/40/75/330154075.db2.gz KRBBWUSQBGOLHN-SWLSCSKDSA-N 1 3 298.883 3.539 20 0 CHADHO NC[C@@H]1CCCC[C@H]1[NH2+]CCSc1ccc(Cl)cc1 ZINC000422765212 330154076 /nfs/dbraw/zinc/15/40/76/330154076.db2.gz KRBBWUSQBGOLHN-SWLSCSKDSA-N 1 3 298.883 3.539 20 0 CHADHO Cc1ccc(SCC[NH2+][C@@H]2C[C@@H](N)c3ccccc32)cc1 ZINC000422764721 330154113 /nfs/dbraw/zinc/15/41/13/330154113.db2.gz KIPRGALDXYYATQ-QZTJIDSGSA-N 1 3 298.455 3.822 20 0 CHADHO Cc1ccc([C@H](C)CN[C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000422766834 330154209 /nfs/dbraw/zinc/15/42/09/330154209.db2.gz QIGIIYADWWVGEE-OQIJWPOYSA-N 1 3 286.463 3.609 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H](Cc1ccccc1)c1ccccc1 ZINC000422768249 330154244 /nfs/dbraw/zinc/15/42/44/330154244.db2.gz RVWUEJXOOJXINE-FRQCXROJSA-N 1 3 282.431 3.686 20 0 CHADHO C[C@H](CCC[NH3+])N[C@H](C)c1cc(Cl)ccc1Cl ZINC000422780585 330154866 /nfs/dbraw/zinc/15/48/66/330154866.db2.gz KKOJTZUHKNSGDQ-NXEZZACHSA-N 1 3 275.223 3.771 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC[C@@H]1CCC[C@@H](C)C1 ZINC000422744497 330155291 /nfs/dbraw/zinc/15/52/91/330155291.db2.gz KCKOCKHLYNVJBM-YCPHGPKFSA-N 1 3 289.467 3.716 20 0 CHADHO CCCC[C@@H](CC)C[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000422743679 330155310 /nfs/dbraw/zinc/15/53/10/330155310.db2.gz IYHKMYKRWKVWQI-DZGCQCFKSA-N 1 3 277.456 3.716 20 0 CHADHO c1ccc(C2(CN[C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)CCC2)cc1 ZINC000422802461 330155828 /nfs/dbraw/zinc/15/58/28/330155828.db2.gz BNLBVJGYWCZBIS-IPMKNSEASA-N 1 3 298.474 3.619 20 0 CHADHO c1ccc(C2(CN[C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)CC2)cc1 ZINC000422814830 330156204 /nfs/dbraw/zinc/15/62/04/330156204.db2.gz WFAZWHDBOXHPQF-GUDVDZBRSA-N 1 3 298.474 3.619 20 0 CHADHO CCS[C@@H]1CCC[C@H](N[C@@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000422818401 330156236 /nfs/dbraw/zinc/15/62/36/330156236.db2.gz KHUMKGCWUFGTCM-NSNWQYSKSA-N 1 3 290.476 3.785 20 0 CHADHO C[C@H](c1ccccc1)[C@H](C)N[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422818285 330156284 /nfs/dbraw/zinc/15/62/84/330156284.db2.gz FZXLJOACPQRDIZ-KODHJQJWSA-N 1 3 280.415 3.913 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](C)c1ccc(-c2cccnc2)cc1 ZINC000422831986 330156948 /nfs/dbraw/zinc/15/69/48/330156948.db2.gz XDLISNUFIKMQEG-KKUMJFAQSA-N 1 3 283.419 3.525 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CCCC1CCCCC1 ZINC000422851541 330157430 /nfs/dbraw/zinc/15/74/30/330157430.db2.gz XBEXCABVZHDVLK-CQSZACIVSA-N 1 3 289.467 3.860 20 0 CHADHO C[C@@H](CCCC[NH3+])N[C@@H](C)c1nc(C(C)(C)C)cs1 ZINC000422856520 330157859 /nfs/dbraw/zinc/15/78/59/330157859.db2.gz FOHFOYXRFRGYGN-RYUDHWBXSA-N 1 3 283.485 3.609 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H](c1ccccc1F)C1CCCC1 ZINC000422869866 330158113 /nfs/dbraw/zinc/15/81/13/330158113.db2.gz AWBLMSUZBIGYNP-AHIWAGSCSA-N 1 3 278.415 3.772 20 0 CHADHO C[C@H](N[C@@H](c1cccc(F)c1)C1CCCC1)[C@@H]1CC[NH2+]C1 ZINC000422873904 330158601 /nfs/dbraw/zinc/15/86/01/330158601.db2.gz MKKQUZZWCMIADP-FDQGKXFDSA-N 1 3 290.426 3.645 20 0 CHADHO CC[C@@H](N[C@@H](C)CCC[NH3+])c1ccccc1Br ZINC000422892165 330159287 /nfs/dbraw/zinc/15/92/87/330159287.db2.gz MKGDNRKUTBXFGI-SMDDNHRTSA-N 1 3 299.256 3.617 20 0 CHADHO C[C@@H](N)C[C@@H](C)[NH2+]CC1(c2cccc(F)c2)CCCCC1 ZINC000422908386 330159680 /nfs/dbraw/zinc/15/96/80/330159680.db2.gz YJIICGFPKOPBOQ-HUUCEWRRSA-N 1 3 292.442 3.743 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCC1(c2cccc(F)c2)CCCCC1 ZINC000422908386 330159682 /nfs/dbraw/zinc/15/96/82/330159682.db2.gz YJIICGFPKOPBOQ-HUUCEWRRSA-N 1 3 292.442 3.743 20 0 CHADHO c1ccc2c(c1)CC[C@@H]2C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCCN1 ZINC000422910246 330159686 /nfs/dbraw/zinc/15/96/86/330159686.db2.gz PYGMSWZVAGIQOX-BTHPGYMESA-N 1 3 298.474 3.617 20 0 CHADHO C[C@@H](NC1CCC(C[NH3+])CC1)c1c(F)cccc1Cl ZINC000422919588 330160699 /nfs/dbraw/zinc/16/06/99/330160699.db2.gz KCIRKYQDWSRHQZ-VOMCLLRMSA-N 1 3 284.806 3.647 20 0 CHADHO N[C@H]1C[C@@H]([NH2+]CCc2cc3ccccc3o2)c2ccccc21 ZINC000422923903 330160799 /nfs/dbraw/zinc/16/07/99/330160799.db2.gz SYFMXFMTCSQGRU-ZWKOTPCHSA-N 1 3 292.382 3.710 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C ZINC000422927642 330160819 /nfs/dbraw/zinc/16/08/19/330160819.db2.gz ZKRDKFFOYWLDBF-APCWTUGXSA-N 1 3 280.843 3.753 20 0 CHADHO NC[C@@H]1CCCC[C@H]1[NH2+]CC1(Cc2ccccc2)CCC1 ZINC000422927919 330160826 /nfs/dbraw/zinc/16/08/26/330160826.db2.gz HUOYCGNOWHAJRD-ZWKOTPCHSA-N 1 3 286.463 3.507 20 0 CHADHO CCCc1ccc([C@@H](N[C@H](C)C2C[NH2+]C2)C(C)C)cc1 ZINC000422937203 330161400 /nfs/dbraw/zinc/16/14/00/330161400.db2.gz NZBPYUDPMWPWPM-KDOFPFPSSA-N 1 3 274.452 3.534 20 0 CHADHO CCCc1ccc([C@@H]([NH2+][C@H](C)C2CNC2)C(C)C)cc1 ZINC000422937203 330161401 /nfs/dbraw/zinc/16/14/01/330161401.db2.gz NZBPYUDPMWPWPM-KDOFPFPSSA-N 1 3 274.452 3.534 20 0 CHADHO CC1(C)CC[C@@H](N[C@@H]2CCC[NH2+]CC2)c2ccccc21 ZINC000422943124 330161711 /nfs/dbraw/zinc/16/17/11/330161711.db2.gz KEHMYEACOWTSET-RHSMWYFYSA-N 1 3 272.436 3.531 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCC1(Sc2ccccc2)CCCC1 ZINC000422901383 330162257 /nfs/dbraw/zinc/16/22/57/330162257.db2.gz BXHBQMUVSINCHU-GJZGRUSLSA-N 1 3 292.492 3.807 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]CC1(Sc2ccccc2)CCCC1 ZINC000422901383 330162259 /nfs/dbraw/zinc/16/22/59/330162259.db2.gz BXHBQMUVSINCHU-GJZGRUSLSA-N 1 3 292.492 3.807 20 0 CHADHO CCC[C@H]([NH2+]C[C@H](N)CC)c1ccc(Cl)cc1 ZINC000423486002 330206795 /nfs/dbraw/zinc/20/67/95/330206795.db2.gz ZJBMOBAWOMNXRT-KGLIPLIRSA-N 1 3 254.805 3.508 20 0 CHADHO C(=C/c1ccccc1)\CN[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000422972814 330164693 /nfs/dbraw/zinc/16/46/93/330164693.db2.gz AKFSUCSFSAISKM-YECZOLDGSA-N 1 3 292.426 3.783 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](C)Cc1c(Cl)cccc1Cl ZINC000423017136 330165345 /nfs/dbraw/zinc/16/53/45/330165345.db2.gz VMPLDGIQZVOVNV-DCAQKATOSA-N 1 3 289.250 3.640 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@@H](C)Cc1c(Cl)cccc1Cl ZINC000423017136 330165347 /nfs/dbraw/zinc/16/53/47/330165347.db2.gz VMPLDGIQZVOVNV-DCAQKATOSA-N 1 3 289.250 3.640 20 0 CHADHO CC1(CN[C@H]2C[C@@H]([NH3+])c3ccccc32)Cc2ccccc2C1 ZINC000423019000 330165578 /nfs/dbraw/zinc/16/55/78/330165578.db2.gz STHSLPCRMIXBDD-MOPGFXCFSA-N 1 3 292.426 3.526 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]C[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000423056473 330167380 /nfs/dbraw/zinc/16/73/80/330167380.db2.gz FXRYKYNNUUDWDY-WOPDTQHZSA-N 1 3 288.357 3.524 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NC[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000423056473 330167381 /nfs/dbraw/zinc/16/73/81/330167381.db2.gz FXRYKYNNUUDWDY-WOPDTQHZSA-N 1 3 288.357 3.524 20 0 CHADHO C[C@@H]1CCNCC[C@@H]1[NH2+][C@H]1CCC[C@@H](c2ccccc2)C1 ZINC000423069863 330168357 /nfs/dbraw/zinc/16/83/57/330168357.db2.gz FDNFZEZMJKKEPH-YSHGAJCASA-N 1 3 286.463 3.691 20 0 CHADHO C1CC12CCC([NH2+][C@H]1CCC[C@@H]1[C@H]1CCCCN1)CC2 ZINC000423077067 330168600 /nfs/dbraw/zinc/16/86/00/330168600.db2.gz SHAZDHXTVDUMLW-ZACQAIPSSA-N 1 3 276.468 3.610 20 0 CHADHO [NH3+][C@H]1C[C@H](NCC2CC(c3ccccc3)C2)c2ccccc21 ZINC000423107181 330170589 /nfs/dbraw/zinc/17/05/89/330170589.db2.gz DQFDCCOOXNPNHH-PNQJHCTGSA-N 1 3 292.426 3.915 20 0 CHADHO C[C@H]1CCNCC[C@H]1[NH2+]C1CC(c2cccc(Cl)c2)C1 ZINC000423112985 330170804 /nfs/dbraw/zinc/17/08/04/330170804.db2.gz XXJBAOGUNAWYPG-JEWKTJRQSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@H]1CC[NH2+]CC[C@H]1NC1CC(c2cccc(Cl)c2)C1 ZINC000423112985 330170805 /nfs/dbraw/zinc/17/08/05/330170805.db2.gz XXJBAOGUNAWYPG-JEWKTJRQSA-N 1 3 292.854 3.564 20 0 CHADHO [NH3+][C@@H]1C[C@H](NC[C@H]2CCCC(F)(F)C2)c2ccccc21 ZINC000423114574 330170968 /nfs/dbraw/zinc/17/09/68/330170968.db2.gz LSGZYLUUPKQDNE-GLQYFDAESA-N 1 3 280.362 3.546 20 0 CHADHO CC[C@H]1CC[C@H](N[C@@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC000423121639 330171055 /nfs/dbraw/zinc/17/10/55/330171055.db2.gz AXQCVHODRQQNKQ-MGBSGCIJSA-N 1 3 258.409 3.690 20 0 CHADHO C[C@H](N[C@@H](C)[C@@H]1CC[NH2+]C1)c1ccc(F)c2ccccc21 ZINC000423123683 330171252 /nfs/dbraw/zinc/17/12/52/330171252.db2.gz LOLJCFCTIQFQIE-MELADBBJSA-N 1 3 286.394 3.628 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NC[C@@H]2CCCCC(F)(F)C2)c2ccccc21 ZINC000423128133 330171668 /nfs/dbraw/zinc/17/16/68/330171668.db2.gz KFLUDEXVDIGROG-DAXOMENPSA-N 1 3 294.389 3.936 20 0 CHADHO NC[C@@H]1CCCC[C@H]1[NH2+]CCc1cc2ccccc2s1 ZINC000423138054 330172394 /nfs/dbraw/zinc/17/23/94/330172394.db2.gz RXHFYUXEXBOCCY-GOEBONIOSA-N 1 3 288.460 3.551 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@@H]1N[C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423146041 330172663 /nfs/dbraw/zinc/17/26/63/330172663.db2.gz NPZDMSXMGZDSBR-KFZJALRRSA-N 1 3 292.854 3.836 20 0 CHADHO Clc1ccc([C@@H]2CCC[C@H]([NH2+]C3CCNCC3)C2)cc1 ZINC000423150796 330172800 /nfs/dbraw/zinc/17/28/00/330172800.db2.gz CJOKIYYXQBHKEF-PBHICJAKSA-N 1 3 292.854 3.708 20 0 CHADHO [NH3+][C@@H]1C[C@H](NC[C@@H]2CCC[C@@H]2C2CC2)c2ccccc21 ZINC000423169661 330174318 /nfs/dbraw/zinc/17/43/18/330174318.db2.gz JYTJKUPNPFUKMK-JFTQMJAMSA-N 1 3 270.420 3.547 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@H]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000423170752 330174463 /nfs/dbraw/zinc/17/44/63/330174463.db2.gz YTHVIOLLRGOHFE-DUPGQFARSA-N 1 3 280.843 3.692 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@H](c2cccc(Cl)c2)C1)C1CNC1 ZINC000423170772 330174542 /nfs/dbraw/zinc/17/45/42/330174542.db2.gz YUSQGCXGKWRRMW-JDFRZJQESA-N 1 3 292.854 3.564 20 0 CHADHO C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C1CCNCC1 ZINC000423175692 330174698 /nfs/dbraw/zinc/17/46/98/330174698.db2.gz ASPKYFWQPSKUGX-CQSZACIVSA-N 1 3 299.462 3.566 20 0 CHADHO C[C@H](CC(C)(C)c1c[nH]c2ccccc21)NC1CC[NH2+]CC1 ZINC000423175692 330174699 /nfs/dbraw/zinc/17/46/99/330174699.db2.gz ASPKYFWQPSKUGX-CQSZACIVSA-N 1 3 299.462 3.566 20 0 CHADHO C[C@H](CCc1c(F)cccc1F)NCC1([NH3+])CCCCC1 ZINC000423175114 330174717 /nfs/dbraw/zinc/17/47/17/330174717.db2.gz DAGZGKKAFXJGRM-CYBMUJFWSA-N 1 3 296.405 3.537 20 0 CHADHO Clc1ccc([C@@H]2CC[C@@H]([NH2+][C@@H]3CCCNCC3)C2)cc1 ZINC000423174186 330174855 /nfs/dbraw/zinc/17/48/55/330174855.db2.gz BOHYGERWNRWDEE-DJIMGWMZSA-N 1 3 292.854 3.708 20 0 CHADHO NC1(C[NH2+][C@H]2CCCc3c4ccccc4[nH]c32)CCCCC1 ZINC000423184487 330175759 /nfs/dbraw/zinc/17/57/59/330175759.db2.gz UASRKYNMGKZBQD-KRWDZBQOSA-N 1 3 297.446 3.797 20 0 CHADHO Clc1ccc([C@@H]([NH2+]C2CCNCC2)C2CC2)cc1Cl ZINC000423194289 330176341 /nfs/dbraw/zinc/17/63/41/330176341.db2.gz XORTZFPUQHLNOG-HNNXBMFYSA-N 1 3 299.245 3.786 20 0 CHADHO C[C@@H](NC[C@H]1CCC[NH2+]C1)c1cc2ccccc2s1 ZINC000423217452 330178869 /nfs/dbraw/zinc/17/88/69/330178869.db2.gz UFSAIZFZFCULQD-OLZOCXBDSA-N 1 3 274.433 3.552 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCCNC1)c1cc2ccccc2s1 ZINC000423217452 330178871 /nfs/dbraw/zinc/17/88/71/330178871.db2.gz UFSAIZFZFCULQD-OLZOCXBDSA-N 1 3 274.433 3.552 20 0 CHADHO CCC[C@H](N[C@H](C)[C@H]1CCC[NH2+]C1)c1ccc(OC)cc1 ZINC000423221948 330179575 /nfs/dbraw/zinc/17/95/75/330179575.db2.gz YUVPNGZTJOOLRJ-HFTRVMKXSA-N 1 3 290.451 3.514 20 0 CHADHO CCC[C@H]([NH2+][C@H](C)[C@H]1CCCNC1)c1ccc(OC)cc1 ZINC000423221948 330179577 /nfs/dbraw/zinc/17/95/77/330179577.db2.gz YUVPNGZTJOOLRJ-HFTRVMKXSA-N 1 3 290.451 3.514 20 0 CHADHO CNC[C@H](C)C[NH2+][C@H](C)C(c1ccccc1)c1ccccc1 ZINC000423284016 330185685 /nfs/dbraw/zinc/18/56/85/330185685.db2.gz XXWPQZAFUDZCGM-DLBZAZTESA-N 1 3 296.458 3.652 20 0 CHADHO C[NH2+]C[C@H](C)CN[C@H](C)C(c1ccccc1)c1ccccc1 ZINC000423284016 330185686 /nfs/dbraw/zinc/18/56/86/330185686.db2.gz XXWPQZAFUDZCGM-DLBZAZTESA-N 1 3 296.458 3.652 20 0 CHADHO CCC(N)(CC)C[NH2+][C@H](C)c1ccc(-c2ccncc2)cc1 ZINC000423283267 330185736 /nfs/dbraw/zinc/18/57/36/330185736.db2.gz FCCBAVMHBVGNJE-OAHLLOKOSA-N 1 3 297.446 3.917 20 0 CHADHO CCC[C@@H]([NH2+]CC(C)(C)N)c1cccc(C(F)(F)F)c1 ZINC000423282599 330185783 /nfs/dbraw/zinc/18/57/83/330185783.db2.gz CVKVHGKLRJQUCX-CYBMUJFWSA-N 1 3 288.357 3.874 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2ccsc2)cc1 ZINC000423290507 330186760 /nfs/dbraw/zinc/18/67/60/330186760.db2.gz DHLKSJFMEYWKPM-VXGBXAGGSA-N 1 3 260.406 3.619 20 0 CHADHO CC[C@@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccc(OC)cc1 ZINC000423290555 330186895 /nfs/dbraw/zinc/18/68/95/330186895.db2.gz DMLXFYODQLGGFN-AUUYWEPGSA-N 1 3 298.430 3.956 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2c3cc(F)ccc3C[C@@H]2C)cc1 ZINC000423291681 330187093 /nfs/dbraw/zinc/18/70/93/330187093.db2.gz JKVZRHSQFQWKIN-JMERFSKESA-N 1 3 298.405 3.869 20 0 CHADHO CCC[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1cccnc1 ZINC000423290869 330187248 /nfs/dbraw/zinc/18/72/48/330187248.db2.gz FTCNLZMILIOMLO-KDOFPFPSSA-N 1 3 283.419 3.732 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H]2CCCc3c(O)cccc32)cc1 ZINC000423293106 330187811 /nfs/dbraw/zinc/18/78/11/330187811.db2.gz PSTVWYWNZXYSKH-ACJLOTCBSA-N 1 3 296.414 3.579 20 0 CHADHO C[C@@H](NC[C@@H](C)C[NH3+])c1ccc(OCc2ccccc2)cc1 ZINC000423294846 330187886 /nfs/dbraw/zinc/18/78/86/330187886.db2.gz CWOZGIFNVWQENG-JKSUJKDBSA-N 1 3 298.430 3.511 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc3c(c2)COC3)cc1 ZINC000423293863 330187977 /nfs/dbraw/zinc/18/79/77/330187977.db2.gz SGAQDBJDYREXML-KGLIPLIRSA-N 1 3 296.414 3.587 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](c2ccccc2)C2CC2)cc1 ZINC000423293416 330188082 /nfs/dbraw/zinc/18/80/82/330188082.db2.gz RHMHAMLCFWAYGL-KUHUBIRLSA-N 1 3 280.415 3.947 20 0 CHADHO CCC([NH3+])(CC)CN[C@@H]1CCC[C@H](c2ncccc2C)C1 ZINC000423293527 330188131 /nfs/dbraw/zinc/18/81/31/330188131.db2.gz RPROMUGPLCMDNO-JKSUJKDBSA-N 1 3 289.467 3.523 20 0 CHADHO C[C@@H](C[NH3+])CN[C@@H](C)c1ccc(OCc2ccccc2)cc1 ZINC000423294844 330188135 /nfs/dbraw/zinc/18/81/35/330188135.db2.gz CWOZGIFNVWQENG-HOTGVXAUSA-N 1 3 298.430 3.511 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2CCCOc3ccccc32)cc1 ZINC000423295177 330188358 /nfs/dbraw/zinc/18/83/58/330188358.db2.gz WINKCJLCAQSGFI-KBXCAEBGSA-N 1 3 296.414 3.710 20 0 CHADHO COc1ccccc1-c1ccc([C@H](C)NC[C@H](C)C[NH3+])cc1 ZINC000423302554 330188922 /nfs/dbraw/zinc/18/89/22/330188922.db2.gz VRRMRUMTLBJTBT-CABCVRRESA-N 1 3 298.430 3.608 20 0 CHADHO C[C@H](C[NH3+])CN[C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000423299394 330189025 /nfs/dbraw/zinc/18/90/25/330189025.db2.gz QAEKNAMKELDUCQ-HUUCEWRRSA-N 1 3 268.404 3.599 20 0 CHADHO CC(C)[C@@H](NC[C@@H](C)C[NH3+])c1cccc(C(F)(F)F)c1 ZINC000423300912 330189124 /nfs/dbraw/zinc/18/91/24/330189124.db2.gz SMOGTBUACZRWJJ-SMDDNHRTSA-N 1 3 288.357 3.587 20 0 CHADHO N[C@@H](C[NH2+][C@H](CC1CC1)c1ccc(Cl)cc1)C1CC1 ZINC000423313548 330189766 /nfs/dbraw/zinc/18/97/66/330189766.db2.gz FULRGNUZMGMNSP-JKSUJKDBSA-N 1 3 278.827 3.508 20 0 CHADHO C[C@@H]([NH2+]C[C@H](N)C1CC1)c1ccc(-c2ccccc2)cc1 ZINC000423320766 330190418 /nfs/dbraw/zinc/19/04/18/330190418.db2.gz MPTVAJWURFOCEH-KUHUBIRLSA-N 1 3 280.415 3.742 20 0 CHADHO C[C@H]([NH2+]C[C@H](N)C1CC1)c1ccc(-c2cccs2)cc1 ZINC000423323178 330190660 /nfs/dbraw/zinc/19/06/60/330190660.db2.gz ONKXWJVQQZDCRY-LRDDRELGSA-N 1 3 286.444 3.803 20 0 CHADHO C[C@H]([NH2+]CC1(N)CCC1)c1ccc(-c2cccs2)cc1 ZINC000423343493 330192229 /nfs/dbraw/zinc/19/22/29/330192229.db2.gz ZWAKUWKEWJBBEY-ZDUSSCGKSA-N 1 3 286.444 3.947 20 0 CHADHO C[C@@H]1CC[C@@H](NC[C@]2(C)CCC[NH2+]C2)c2ccccc21 ZINC000423343860 330192335 /nfs/dbraw/zinc/19/23/35/330192335.db2.gz XKMUYXZTDLTMDU-ZTFGCOKTSA-N 1 3 272.436 3.604 20 0 CHADHO C[C@@H]1CC[C@@H]([NH2+]C[C@]2(C)CCCNC2)c2ccccc21 ZINC000423343860 330192337 /nfs/dbraw/zinc/19/23/37/330192337.db2.gz XKMUYXZTDLTMDU-ZTFGCOKTSA-N 1 3 272.436 3.604 20 0 CHADHO CC[C@H](NCC1=CC[NH2+]CC1)c1ccc(Cl)c(Cl)c1 ZINC000423344374 330192444 /nfs/dbraw/zinc/19/24/44/330192444.db2.gz MQPLNTWXXUFAFT-HNNXBMFYSA-N 1 3 299.245 3.954 20 0 CHADHO c1cc2c(s1)CCC[C@@H]2NCc1ccc2c(c1)C[NH2+]C2 ZINC000423357947 330193346 /nfs/dbraw/zinc/19/33/46/330193346.db2.gz MQKJWCGYZWACLT-INIZCTEOSA-N 1 3 284.428 3.519 20 0 CHADHO CC[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccc(C)cc1 ZINC000423357473 330193413 /nfs/dbraw/zinc/19/34/13/330193413.db2.gz MBNHXIVVOGRBLO-IBGZPJMESA-N 1 3 280.415 3.839 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@H]2CCCCc3ccc(Cl)cc32)CCN1 ZINC000423363522 330193821 /nfs/dbraw/zinc/19/38/21/330193821.db2.gz AMXIAZOBJMZCIM-PVUWLOKVSA-N 1 3 292.854 3.838 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCCCc3ccc(Cl)cc32)CCN1 ZINC000423363523 330194021 /nfs/dbraw/zinc/19/40/21/330194021.db2.gz AMXIAZOBJMZCIM-SRCQZFHVSA-N 1 3 292.854 3.838 20 0 CHADHO COc1ccc([C@H](C)[NH2+][C@@H]2CCN[C@@H](C)C2)c2ccccc12 ZINC000423401238 330196496 /nfs/dbraw/zinc/19/64/96/330196496.db2.gz XAYGVSNLIANUAE-SOUVJXGZSA-N 1 3 298.430 3.640 20 0 CHADHO CC(C)COc1ccc([C@H](C)N[C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000423405476 330196564 /nfs/dbraw/zinc/19/65/64/330196564.db2.gz YAFTWRUIJRAQGK-USXIJHARSA-N 1 3 290.451 3.642 20 0 CHADHO CCC[C@H](Cc1ccccc1)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423406933 330196902 /nfs/dbraw/zinc/19/69/02/330196902.db2.gz ZLIXTOIITBWXKR-HXUWFJFHSA-N 1 3 294.442 3.791 20 0 CHADHO c1ccc([C@H]2CC[C@@H]([NH2+]Cc3ccc4c(c3)CNC4)C2)cc1 ZINC000423376050 330198579 /nfs/dbraw/zinc/19/85/79/330198579.db2.gz JABQOFJHSIIPQV-FXAWDEMLSA-N 1 3 292.426 3.716 20 0 CHADHO COc1ccc2cc([C@H](C)[NH2+][C@H]3CCN[C@H](C)C3)ccc2c1 ZINC000423374350 330198584 /nfs/dbraw/zinc/19/85/84/330198584.db2.gz JUHKTGGXGJNNMA-GLJUWKHASA-N 1 3 298.430 3.640 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCN[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000423379810 330198838 /nfs/dbraw/zinc/19/88/38/330198838.db2.gz NHRGXNVNWGNZTJ-GLQYFDAESA-N 1 3 266.816 3.521 20 0 CHADHO CCSc1ccccc1[C@H](C)N[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423383632 330199131 /nfs/dbraw/zinc/19/91/31/330199131.db2.gz KMKAHIKNSSCYBY-BFHYXJOUSA-N 1 3 278.465 3.719 20 0 CHADHO C[C@H](N[C@H]1CC[NH2+][C@H](C)C1)c1cccc2ccccc21 ZINC000423381772 330199360 /nfs/dbraw/zinc/19/93/60/330199360.db2.gz OOOFAQMWLFCVLC-YCPHGPKFSA-N 1 3 268.404 3.631 20 0 CHADHO C[C@H]([NH2+][C@H]1CCN[C@H](C)C1)c1cccc2ccccc21 ZINC000423381772 330199361 /nfs/dbraw/zinc/19/93/61/330199361.db2.gz OOOFAQMWLFCVLC-YCPHGPKFSA-N 1 3 268.404 3.631 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000423395765 330200848 /nfs/dbraw/zinc/20/08/48/330200848.db2.gz NNPGYIZWRAJCSY-COXVUDFISA-N 1 3 292.442 3.891 20 0 CHADHO CC(C)Sc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H](C)N)cc1 ZINC000423447411 330202421 /nfs/dbraw/zinc/20/24/21/330202421.db2.gz OXNKEEAASZKYHD-AGIUHOORSA-N 1 3 266.454 3.573 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)c1ccc(OCc2ccccc2)cc1)[C@H](C)N ZINC000423450198 330202946 /nfs/dbraw/zinc/20/29/46/330202946.db2.gz SQNUXXPOMRWULY-XHSDSOJGSA-N 1 3 298.430 3.652 20 0 CHADHO C[C@@H](N)[C@@H](C)[NH2+][C@@H](C)c1ccc(-c2cccs2)cc1 ZINC000423452734 330203181 /nfs/dbraw/zinc/20/31/81/330203181.db2.gz WTONFGYPPBEIPB-UPJWGTAASA-N 1 3 274.433 3.801 20 0 CHADHO CC[C@@H](N)C[NH2+][C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423455628 330203582 /nfs/dbraw/zinc/20/35/82/330203582.db2.gz CUDCFYSZYOROPA-HUUCEWRRSA-N 1 3 266.816 3.508 20 0 CHADHO CC[C@H]([NH3+])CN[C@H](C)C(c1ccccc1)c1ccccc1 ZINC000423457425 330203706 /nfs/dbraw/zinc/20/37/06/330203706.db2.gz FQBQHDSRGPQIFC-QAPCUYQASA-N 1 3 282.431 3.534 20 0 CHADHO C[C@@H]([NH2+][C@H](c1ccc(Cl)cc1)C1CCC1)[C@H](C)N ZINC000423471636 330205231 /nfs/dbraw/zinc/20/52/31/330205231.db2.gz PSXHCDIXZMDBLC-RWSFTLGLSA-N 1 3 266.816 3.507 20 0 CHADHO CC[C@H](NCCC[C@H]1CCC[NH2+]1)c1ccc(F)cc1F ZINC000423476194 330205755 /nfs/dbraw/zinc/20/57/55/330205755.db2.gz IOUKIFJHROYYSE-CJNGLKHVSA-N 1 3 282.378 3.538 20 0 CHADHO CC[C@H](N)C[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C(C)C ZINC000423486663 330206801 /nfs/dbraw/zinc/20/68/01/330206801.db2.gz ZYDHIOQQRJMEHY-UONOGXRCSA-N 1 3 288.357 3.729 20 0 CHADHO CC[C@@H](NCCC[C@H]1CCC[NH2+]1)c1cc(F)ccc1F ZINC000423490678 330207405 /nfs/dbraw/zinc/20/74/05/330207405.db2.gz XYDBOGVXNSRFBG-CZUORRHYSA-N 1 3 282.378 3.538 20 0 CHADHO Cc1ccncc1[C@H](C)N[C@@H](CCC[NH3+])c1ccccc1 ZINC000423497047 330207986 /nfs/dbraw/zinc/20/79/86/330207986.db2.gz FWTDTUDQRODZPN-YJBOKZPZSA-N 1 3 283.419 3.521 20 0 CHADHO CCc1ccc([C@@H](C)N[C@H](CCC[NH3+])c2ccccc2)o1 ZINC000423506718 330208767 /nfs/dbraw/zinc/20/87/67/330208767.db2.gz PGCVVRHZHXNYOK-RHSMWYFYSA-N 1 3 286.419 3.973 20 0 CHADHO C[C@@H](N[C@H](CCC[NH3+])c1ccccc1)c1ccccc1F ZINC000423505662 330208771 /nfs/dbraw/zinc/20/87/71/330208771.db2.gz ORIUBUMSTFAZTR-RDTXWAMCSA-N 1 3 286.394 3.957 20 0 CHADHO C[C@H]([NH2+]CCCNC1CC1)c1cc2ccccc2s1 ZINC000423551772 330211562 /nfs/dbraw/zinc/21/15/62/330211562.db2.gz JNHLTPHEFPTACU-LBPRGKRZSA-N 1 3 274.433 3.694 20 0 CHADHO C[C@H](NCCC1=CC[NH2+]CC1)c1cc(Cl)ccc1Cl ZINC000423571790 330212209 /nfs/dbraw/zinc/21/22/09/330212209.db2.gz XURKIJZXDIROMI-NSHDSACASA-N 1 3 299.245 3.954 20 0 CHADHO C[C@H](C[NH2+]CCCN1CCCC[C@H]1C)c1ccc(F)cc1 ZINC000527116833 330223254 /nfs/dbraw/zinc/22/32/54/330223254.db2.gz LAUAPSUSCLHHEP-HZPDHXFCSA-N 1 3 292.442 3.783 20 0 CHADHO C[C@H](CNCCC[N@@H+]1CCCC[C@H]1C)c1ccc(F)cc1 ZINC000527116833 330223255 /nfs/dbraw/zinc/22/32/55/330223255.db2.gz LAUAPSUSCLHHEP-HZPDHXFCSA-N 1 3 292.442 3.783 20 0 CHADHO C[C@H](CNCCC[N@H+]1CCCC[C@H]1C)c1ccc(F)cc1 ZINC000527116833 330223256 /nfs/dbraw/zinc/22/32/56/330223256.db2.gz LAUAPSUSCLHHEP-HZPDHXFCSA-N 1 3 292.442 3.783 20 0 CHADHO CC[C@H](CCc1ccccc1)[NH2+][C@H]1CCN2CCC[C@H]2C1 ZINC000527763944 330281598 /nfs/dbraw/zinc/28/15/98/330281598.db2.gz NEKCUBAMPQZCCM-QYZOEREBSA-N 1 3 286.463 3.614 20 0 CHADHO CC[C@H](CCc1ccccc1)N[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000527763944 330281599 /nfs/dbraw/zinc/28/15/99/330281599.db2.gz NEKCUBAMPQZCCM-QYZOEREBSA-N 1 3 286.463 3.614 20 0 CHADHO CC[C@H](CCc1ccccc1)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000527763944 330281600 /nfs/dbraw/zinc/28/16/00/330281600.db2.gz NEKCUBAMPQZCCM-QYZOEREBSA-N 1 3 286.463 3.614 20 0 CHADHO C[C@@H]([NH2+]C1CCN(C2CCCCC2)CC1)[C@H]1CC12CC2 ZINC000527868942 330286050 /nfs/dbraw/zinc/28/60/50/330286050.db2.gz VGKPNVFRTABWEY-RHSMWYFYSA-N 1 3 276.468 3.562 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](c2cccc(C)c2)C(C)C)C1 ZINC000527855128 330288682 /nfs/dbraw/zinc/28/86/82/330288682.db2.gz ZRGNHGFMXAGESC-AEFFLSMTSA-N 1 3 274.452 3.624 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](c2cccc(C)c2)C(C)C)C1 ZINC000527855128 330288683 /nfs/dbraw/zinc/28/86/83/330288683.db2.gz ZRGNHGFMXAGESC-AEFFLSMTSA-N 1 3 274.452 3.624 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](c2cccc(C)c2)C(C)C)C1 ZINC000527855128 330288684 /nfs/dbraw/zinc/28/86/84/330288684.db2.gz ZRGNHGFMXAGESC-AEFFLSMTSA-N 1 3 274.452 3.624 20 0 CHADHO CC(C)c1cccc([C@H](C)NC[C@@H]2CCC[N@H+](C)C2)c1 ZINC000527861496 330289265 /nfs/dbraw/zinc/28/92/65/330289265.db2.gz LNYTUUFKGGXONE-HOTGVXAUSA-N 1 3 274.452 3.802 20 0 CHADHO CC(C)c1cccc([C@H](C)NC[C@@H]2CCC[N@@H+](C)C2)c1 ZINC000527861496 330289266 /nfs/dbraw/zinc/28/92/66/330289266.db2.gz LNYTUUFKGGXONE-HOTGVXAUSA-N 1 3 274.452 3.802 20 0 CHADHO C[C@@H]1CCCC[C@H]1N1CCC([NH2+]CC2CC=CC2)CC1 ZINC000527947293 330294339 /nfs/dbraw/zinc/29/43/39/330294339.db2.gz YAZDJDHGQZOWKM-CRAIPNDOSA-N 1 3 276.468 3.585 20 0 CHADHO CCSc1ccccc1[C@@H](C)[NH2+][C@@H]1CCCC[C@H]1N ZINC000424378157 330348853 /nfs/dbraw/zinc/34/88/53/330348853.db2.gz SJDPJAACAKAKTH-BPLDGKMQSA-N 1 3 278.465 3.719 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCCC[C@H]1N)c1cccc(C(F)(F)F)c1 ZINC000424378184 330348941 /nfs/dbraw/zinc/34/89/41/330348941.db2.gz SPTIISXWVPRKRB-ZLKJLUDKSA-N 1 3 286.341 3.626 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](c2ccc(F)c(C)c2)C2CC2)C1 ZINC000536948471 330373088 /nfs/dbraw/zinc/37/30/88/330373088.db2.gz UMGWULUHYFZVDP-KSSFIOAISA-N 1 3 290.426 3.517 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](c2ccc(F)c(C)c2)C2CC2)C1 ZINC000536948471 330373089 /nfs/dbraw/zinc/37/30/89/330373089.db2.gz UMGWULUHYFZVDP-KSSFIOAISA-N 1 3 290.426 3.517 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](c2ccc(F)c(C)c2)C2CC2)C1 ZINC000536948471 330373090 /nfs/dbraw/zinc/37/30/90/330373090.db2.gz UMGWULUHYFZVDP-KSSFIOAISA-N 1 3 290.426 3.517 20 0 CHADHO CC(C)[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)c1ccccc1 ZINC000537016717 330379319 /nfs/dbraw/zinc/37/93/19/330379319.db2.gz SQZGFGJAFXVMSM-SQNIBIBYSA-N 1 3 274.452 3.846 20 0 CHADHO CC(C)[C@H](N[C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccccc1 ZINC000537016717 330379320 /nfs/dbraw/zinc/37/93/20/330379320.db2.gz SQZGFGJAFXVMSM-SQNIBIBYSA-N 1 3 274.452 3.846 20 0 CHADHO Cc1cc([C@H](C)N[C@H]2CCCC[C@@H]2C[NH3+])c(C)s1 ZINC000089143853 330380791 /nfs/dbraw/zinc/38/07/91/330380791.db2.gz HXVRHTCTBVFLOE-LNSITVRQSA-N 1 3 266.454 3.533 20 0 CHADHO CC[C@H](N[C@H]1CCC[C@@H]1C[NH3+])c1ccc(Cl)cc1 ZINC000089148652 330380891 /nfs/dbraw/zinc/38/08/91/330380891.db2.gz UNFMLHQVANSRCL-SNPRPXQTSA-N 1 3 266.816 3.508 20 0 CHADHO C[C@@H]1C[C@@H](N[C@@H](c2ccc(F)cc2)C(C)(C)C)CC[N@@H+]1C ZINC000120429508 330388709 /nfs/dbraw/zinc/38/87/09/330388709.db2.gz PUUMSKAMCQQZLR-COXVUDFISA-N 1 3 292.442 3.985 20 0 CHADHO C[C@@H]1C[C@@H](N[C@@H](c2ccc(F)cc2)C(C)(C)C)CC[N@H+]1C ZINC000120429508 330388710 /nfs/dbraw/zinc/38/87/10/330388710.db2.gz PUUMSKAMCQQZLR-COXVUDFISA-N 1 3 292.442 3.985 20 0 CHADHO CC(C)[NH+](CCCNC[C@H]1C[C@H]1c1ccccc1)C(C)C ZINC000537312095 330432390 /nfs/dbraw/zinc/43/23/90/330432390.db2.gz QUMSKFPLRCQCHP-MOPGFXCFSA-N 1 3 288.479 3.889 20 0 CHADHO C[C@H](c1cccc(Cl)c1)N1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000516291117 330491082 /nfs/dbraw/zinc/49/10/82/330491082.db2.gz IXJBNITUHPFODY-CZUORRHYSA-N 1 3 292.854 3.723 20 0 CHADHO CC1=C[C@H](C)C[C@H](C[NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000575097992 330845386 /nfs/dbraw/zinc/84/53/86/330845386.db2.gz XKQZKZHWWZDCCM-RDJZCZTQSA-N 1 3 290.495 3.975 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H]2CC[C@@H](C)c3ccsc32)C1 ZINC000453069672 331086317 /nfs/dbraw/zinc/08/63/17/331086317.db2.gz UHMJGMCEUASMER-UMVBOHGHSA-N 1 3 278.465 3.618 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H]2CC[C@@H](C)c3ccsc32)C1 ZINC000453069672 331086318 /nfs/dbraw/zinc/08/63/18/331086318.db2.gz UHMJGMCEUASMER-UMVBOHGHSA-N 1 3 278.465 3.618 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H]2CC[C@@H](C)c3ccsc32)C1 ZINC000453069672 331086319 /nfs/dbraw/zinc/08/63/19/331086319.db2.gz UHMJGMCEUASMER-UMVBOHGHSA-N 1 3 278.465 3.618 20 0 CHADHO C[C@@H]1CC[C@H](N[C@H]2CC[N@@H+]3CCCC[C@H]23)c2sccc21 ZINC000453070134 331086353 /nfs/dbraw/zinc/08/63/53/331086353.db2.gz ZZEMZJHAGNGXOS-SYAUCNOPSA-N 1 3 290.476 3.903 20 0 CHADHO C[C@@H]1CC[C@H](N[C@H]2CC[N@H+]3CCCC[C@H]23)c2sccc21 ZINC000453070134 331086354 /nfs/dbraw/zinc/08/63/54/331086354.db2.gz ZZEMZJHAGNGXOS-SYAUCNOPSA-N 1 3 290.476 3.903 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H]2CC[C@@H](C)c3ccsc32)C1 ZINC000453069671 331086392 /nfs/dbraw/zinc/08/63/92/331086392.db2.gz UHMJGMCEUASMER-NFAWXSAZSA-N 1 3 278.465 3.618 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H]2CC[C@@H](C)c3ccsc32)C1 ZINC000453069671 331086393 /nfs/dbraw/zinc/08/63/93/331086393.db2.gz UHMJGMCEUASMER-NFAWXSAZSA-N 1 3 278.465 3.618 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H]2CC[C@@H](C)c3ccsc32)C1 ZINC000453069671 331086394 /nfs/dbraw/zinc/08/63/94/331086394.db2.gz UHMJGMCEUASMER-NFAWXSAZSA-N 1 3 278.465 3.618 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H](C2CC2)C2CCCC2)C1 ZINC000453116066 331090768 /nfs/dbraw/zinc/09/07/68/331090768.db2.gz XRHPIZQIATUCSR-CRAIPNDOSA-N 1 3 278.484 3.665 20 0 CHADHO c1cc(N2CCC([NH2+][C@@H]3CC[C@H]4CCC[C@H]4C3)CC2)ccn1 ZINC000459419800 331280499 /nfs/dbraw/zinc/28/04/99/331280499.db2.gz XJQOFCNJEVNXJD-SOLBZPMBSA-N 1 3 299.462 3.609 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC000459427376 331280766 /nfs/dbraw/zinc/28/07/66/331280766.db2.gz NIXZWZXXGXIFKQ-QGZVFWFLSA-N 1 3 286.463 3.774 20 0 CHADHO C[C@@H]([NH2+]C1CC2(CCC2)C1)[C@H]1CCCN(C2CCC2)C1 ZINC000459472699 331283537 /nfs/dbraw/zinc/28/35/37/331283537.db2.gz WDGAOJPEIDTPCU-CABCVRRESA-N 1 3 276.468 3.562 20 0 CHADHO CC(C)(C)N1CCC([NH2+][C@@H]2C[C@H]2c2ccccc2F)CC1 ZINC000459656022 331292428 /nfs/dbraw/zinc/29/24/28/331292428.db2.gz JVODSLNTYOHBND-DOTOQJQBSA-N 1 3 290.426 3.534 20 0 CHADHO Cc1cc(CN2CCC([C@H]3CCC[NH2+]3)CC2)ccc1Cl ZINC000470014492 331469769 /nfs/dbraw/zinc/46/97/69/331469769.db2.gz APLXGGBBLXBUJC-QGZVFWFLSA-N 1 3 292.854 3.612 20 0 CHADHO C[C@H](CCCC(F)(F)F)[NH2+][C@@H]1CCC[C@H](N(C)C)C1 ZINC000480173762 331761403 /nfs/dbraw/zinc/76/14/03/331761403.db2.gz XDFZPRPBBCSDLV-UPJWGTAASA-N 1 3 280.378 3.570 20 0 CHADHO C[C@H](CCC[NH3+])N[C@H](C)c1ccc(Cl)cc1Cl ZINC000336679792 335111521 /nfs/dbraw/zinc/11/15/21/335111521.db2.gz DHXVLCJNKDXPLV-NXEZZACHSA-N 1 3 275.223 3.771 20 0 CHADHO C[C@@H](N[C@@H](C)CCC[NH3+])c1ccc(Cl)cc1Cl ZINC000336679800 335111592 /nfs/dbraw/zinc/11/15/92/335111592.db2.gz DHXVLCJNKDXPLV-VHSXEESVSA-N 1 3 275.223 3.771 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)CCC(C)(C)C)CN1CCCC1 ZINC000310892979 333062529 /nfs/dbraw/zinc/06/25/29/333062529.db2.gz YVDQPWCDNQXAPC-CABCVRRESA-N 1 3 254.462 3.523 20 0 CHADHO CC[NH+](CC)CCCN1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000514077356 333064902 /nfs/dbraw/zinc/06/49/02/333064902.db2.gz PSZOSIALXXLHOR-FUHWJXTLSA-N 1 3 274.452 3.596 20 0 CHADHO CCN(CC)CCC[N@@H+]1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000514077356 333064904 /nfs/dbraw/zinc/06/49/04/333064904.db2.gz PSZOSIALXXLHOR-FUHWJXTLSA-N 1 3 274.452 3.596 20 0 CHADHO CCN(CC)CCC[N@H+]1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000514077356 333064905 /nfs/dbraw/zinc/06/49/05/333064905.db2.gz PSZOSIALXXLHOR-FUHWJXTLSA-N 1 3 274.452 3.596 20 0 CHADHO CC(C)[C@H]1C[C@H](N[C@H](C)CC[NH+](C)C)c2ccccc21 ZINC000516906724 333086023 /nfs/dbraw/zinc/08/60/23/333086023.db2.gz QEWYSCPVCVPZTI-OLMNPRSZSA-N 1 3 274.452 3.801 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H](C)C2CCCCCC2)C1 ZINC000517439401 333099011 /nfs/dbraw/zinc/09/90/11/333099011.db2.gz WVHFOVUHAAVWAL-JKSUJKDBSA-N 1 3 266.473 3.665 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@H]2NC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000186104795 333154961 /nfs/dbraw/zinc/15/49/61/333154961.db2.gz XWMDNTQVDOHRPN-QFBILLFUSA-N 1 3 298.474 3.755 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@H]2NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000186104795 333154963 /nfs/dbraw/zinc/15/49/63/333154963.db2.gz XWMDNTQVDOHRPN-QFBILLFUSA-N 1 3 298.474 3.755 20 0 CHADHO C[C@@H](CCC1CC1)[NH2+]C1CCN(CC2CCCC2)CC1 ZINC000186295757 333158112 /nfs/dbraw/zinc/15/81/12/333158112.db2.gz ZJJVRESWDHWNCV-HNNXBMFYSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@H](CCC1CC1)[NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000186498791 333162041 /nfs/dbraw/zinc/16/20/41/333162041.db2.gz GQYDRUHKGQBFHQ-BFYDXBDKSA-N 1 3 278.484 3.808 20 0 CHADHO CC(C)C[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)c1ccccc1 ZINC000222942646 333202630 /nfs/dbraw/zinc/20/26/30/333202630.db2.gz VNFHCCKORQPFBW-IKGGRYGDSA-N 1 3 260.425 3.633 20 0 CHADHO CCN(CC)CCC[NH2+]C(C)(C)c1ccccc1C ZINC000564187899 333240500 /nfs/dbraw/zinc/24/05/00/333240500.db2.gz IJCZLUOBDWZHHF-UHFFFAOYSA-N 1 3 262.441 3.552 20 0 CHADHO Cc1cc(CN2CCC(C[NH+]3CCCC3)CC2)c(C)s1 ZINC000195027282 333243485 /nfs/dbraw/zinc/24/34/85/333243485.db2.gz YDMZADVUMHDJDU-UHFFFAOYSA-N 1 3 292.492 3.673 20 0 CHADHO C[C@H](CC1CCCCC1)[NH2+][C@H]1CCN2CCC[C@@H]2C1 ZINC000194251904 333267896 /nfs/dbraw/zinc/26/78/96/333267896.db2.gz UROLOEPFRDYNNB-HYVNUMGLSA-N 1 3 264.457 3.562 20 0 CHADHO C[C@@H](c1ccc(F)cc1)N1CCC(C[NH+]2CCCC2)CC1 ZINC000194737741 333276739 /nfs/dbraw/zinc/27/67/39/333276739.db2.gz AEXFGDBLCATLRD-HNNXBMFYSA-N 1 3 290.426 3.695 20 0 CHADHO CC(C)C1CCC([NH2+]CCCN(C)C(C)C)CC1 ZINC000230639767 333319195 /nfs/dbraw/zinc/31/91/95/333319195.db2.gz YGLMVGKZDYCCNM-UHFFFAOYSA-N 1 3 254.462 3.521 20 0 CHADHO CC1=C[C@H](C)C[C@@H](C[NH2+]C2CC(C)(C)NC(C)(C)C2)C1 ZINC000235383123 333368769 /nfs/dbraw/zinc/36/87/69/333368769.db2.gz KBIZBMLAIHHBHM-DZGCQCFKSA-N 1 3 278.484 3.878 20 0 CHADHO CN(Cc1ccc2ccccc2c1)C[C@H]1CCC[N@H+](C)C1 ZINC000524970866 333394193 /nfs/dbraw/zinc/39/41/93/333394193.db2.gz CBEIWGUROZEONH-KRWDZBQOSA-N 1 3 282.431 3.613 20 0 CHADHO CN(Cc1ccc2ccccc2c1)C[C@H]1CCC[N@@H+](C)C1 ZINC000524970866 333394194 /nfs/dbraw/zinc/39/41/94/333394194.db2.gz CBEIWGUROZEONH-KRWDZBQOSA-N 1 3 282.431 3.613 20 0 CHADHO Cc1cccc([C@@H](C)NCc2ccc(C[NH+](C)C)cc2)c1 ZINC000173823644 335141663 /nfs/dbraw/zinc/14/16/63/335141663.db2.gz GTFWMRUJHAZEIG-MRXNPFEDSA-N 1 3 282.431 3.907 20 0 CHADHO C[NH+]1CCC([C@@H]2CCN(Cc3ccc(Cl)s3)C2)CC1 ZINC000576028600 335143299 /nfs/dbraw/zinc/14/32/99/335143299.db2.gz MHCSANQWPISQKZ-CYBMUJFWSA-N 1 3 298.883 3.565 20 0 CHADHO C([NH2+]C1CCN(C2CCCCC2)CC1)C12CCC(CC1)C2 ZINC000540984302 333756869 /nfs/dbraw/zinc/75/68/69/333756869.db2.gz NGKMNUXQYHPXMA-UHFFFAOYSA-N 1 3 290.495 3.953 20 0 CHADHO COc1cccc([C@H](C)[N@H+](C)CC[C@@H]2CCCCN2C)c1 ZINC000079464998 334155006 /nfs/dbraw/zinc/15/50/06/334155006.db2.gz GVYUFSDKAQNGDD-RDJZCZTQSA-N 1 3 290.451 3.562 20 0 CHADHO COc1cccc([C@H](C)[N@@H+](C)CC[C@@H]2CCCCN2C)c1 ZINC000079464998 334155007 /nfs/dbraw/zinc/15/50/07/334155007.db2.gz GVYUFSDKAQNGDD-RDJZCZTQSA-N 1 3 290.451 3.562 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN([C@H](CC)c2ccccc2)C1 ZINC000245417491 334191009 /nfs/dbraw/zinc/19/10/09/334191009.db2.gz GBMQPWYONNCEER-SJLPKXTDSA-N 1 3 274.452 3.801 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN([C@H](CC)c2ccccc2)C1 ZINC000245417491 334191011 /nfs/dbraw/zinc/19/10/11/334191011.db2.gz GBMQPWYONNCEER-SJLPKXTDSA-N 1 3 274.452 3.801 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+]([C@H](CC)c2ccccc2)C1 ZINC000245417491 334191012 /nfs/dbraw/zinc/19/10/12/334191012.db2.gz GBMQPWYONNCEER-SJLPKXTDSA-N 1 3 274.452 3.801 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+]([C@H](CC)c2ccccc2)C1 ZINC000245417491 334191015 /nfs/dbraw/zinc/19/10/15/334191015.db2.gz GBMQPWYONNCEER-SJLPKXTDSA-N 1 3 274.452 3.801 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)C/C(C)=C/c2ccccc2)[C@@H](C)C1 ZINC000245779140 334219244 /nfs/dbraw/zinc/21/92/44/334219244.db2.gz TZACIYWDEMMGGA-PMNOOLIMSA-N 1 3 286.463 3.752 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)C/C(C)=C/c2ccccc2)[C@@H](C)C1 ZINC000245779140 334219245 /nfs/dbraw/zinc/21/92/45/334219245.db2.gz TZACIYWDEMMGGA-PMNOOLIMSA-N 1 3 286.463 3.752 20 0 CHADHO CC(C)=CCC[C@@H](C)[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000247007024 334273858 /nfs/dbraw/zinc/27/38/58/334273858.db2.gz LYGMBDLOXJPNDT-IAGOWNOFSA-N 1 3 266.473 3.831 20 0 CHADHO Cc1ccsc1[C@H](C)[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000247010984 334273863 /nfs/dbraw/zinc/27/38/63/334273863.db2.gz KHZXLEMSEZVFJL-BFHYXJOUSA-N 1 3 266.454 3.580 20 0 CHADHO Cc1ccccc1[C@H](C)[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000247253370 334278281 /nfs/dbraw/zinc/27/82/81/334278281.db2.gz YMHRBWMHIJFWBH-ARFHVFGLSA-N 1 3 260.425 3.518 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H](c2ccccc2)C(C)C)C1 ZINC000246013527 334227904 /nfs/dbraw/zinc/22/79/04/334227904.db2.gz KOWXAGZKQLBOGK-AEFFLSMTSA-N 1 3 274.452 3.705 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H](c2ccccc2)C(C)C)C1 ZINC000246013527 334227905 /nfs/dbraw/zinc/22/79/05/334227905.db2.gz KOWXAGZKQLBOGK-AEFFLSMTSA-N 1 3 274.452 3.705 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](c2ccccc2)C(C)C)C1 ZINC000246013527 334227906 /nfs/dbraw/zinc/22/79/06/334227906.db2.gz KOWXAGZKQLBOGK-AEFFLSMTSA-N 1 3 274.452 3.705 20 0 CHADHO C[C@@]1(NC2CC[NH+](C3CCCC3)CC2)C[C@H]1c1ccccc1 ZINC000551241938 334242589 /nfs/dbraw/zinc/24/25/89/334242589.db2.gz QIFRHZLUJRNLKA-VQTJNVASSA-N 1 3 298.474 3.929 20 0 CHADHO CC(C)[C@@H]1CC[C@@H]1NCCC[NH+](C(C)C)C(C)C ZINC000552046538 334281093 /nfs/dbraw/zinc/28/10/93/334281093.db2.gz KEWFJFUNLRRMNY-HOTGVXAUSA-N 1 3 254.462 3.520 20 0 CHADHO CC(C)[C@@H]1CC[C@@H]1[NH2+]CCCN(C(C)C)C(C)C ZINC000552046538 334281094 /nfs/dbraw/zinc/28/10/94/334281094.db2.gz KEWFJFUNLRRMNY-HOTGVXAUSA-N 1 3 254.462 3.520 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](c2ccc(F)c(F)c2)C(C)C)C1 ZINC000248459375 334302869 /nfs/dbraw/zinc/30/28/69/334302869.db2.gz VPNVOHIPIUZNPO-DYVFJYSZSA-N 1 3 296.405 3.593 20 0 CHADHO C[C@@H]1CCCc2ccccc2[C@@H]1N[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000248749139 334316022 /nfs/dbraw/zinc/31/60/22/334316022.db2.gz FRBTUEWMQXWMNC-PHXBYCTMSA-N 1 3 298.474 3.917 20 0 CHADHO C[C@@H]1CCCc2ccccc2[C@@H]1N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000248749139 334316023 /nfs/dbraw/zinc/31/60/23/334316023.db2.gz FRBTUEWMQXWMNC-PHXBYCTMSA-N 1 3 298.474 3.917 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN(CC[C@H](C)c2ccccc2)C1 ZINC000248883084 334320543 /nfs/dbraw/zinc/32/05/43/334320543.db2.gz LGAADYDXDSBSLC-ZWKOTPCHSA-N 1 3 288.479 3.844 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN(CC[C@H](C)c2ccccc2)C1 ZINC000248883084 334320544 /nfs/dbraw/zinc/32/05/44/334320544.db2.gz LGAADYDXDSBSLC-ZWKOTPCHSA-N 1 3 288.479 3.844 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+](CC[C@H](C)c2ccccc2)C1 ZINC000248883084 334320546 /nfs/dbraw/zinc/32/05/46/334320546.db2.gz LGAADYDXDSBSLC-ZWKOTPCHSA-N 1 3 288.479 3.844 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+](CC[C@H](C)c2ccccc2)C1 ZINC000248883084 334320548 /nfs/dbraw/zinc/32/05/48/334320548.db2.gz LGAADYDXDSBSLC-ZWKOTPCHSA-N 1 3 288.479 3.844 20 0 CHADHO C[C@H](CC[NH2+][C@H]1CCN2CCC[C@H]2C1)CC(C)(C)C ZINC000249046439 334325546 /nfs/dbraw/zinc/32/55/46/334325546.db2.gz FEANMLREAKOAAN-PMPSAXMXSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@H](CCN[C@H]1CC[N@@H+]2CCC[C@H]2C1)CC(C)(C)C ZINC000249046439 334325548 /nfs/dbraw/zinc/32/55/48/334325548.db2.gz FEANMLREAKOAAN-PMPSAXMXSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@H](CCN[C@H]1CC[N@H+]2CCC[C@H]2C1)CC(C)(C)C ZINC000249046439 334325549 /nfs/dbraw/zinc/32/55/49/334325549.db2.gz FEANMLREAKOAAN-PMPSAXMXSA-N 1 3 266.473 3.665 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](C)c2cccc3ccccc32)C1 ZINC000249381937 334332890 /nfs/dbraw/zinc/33/28/90/334332890.db2.gz SFIMVMBBGGQFLF-CVEARBPZSA-N 1 3 282.431 3.832 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](C)c2cccc3ccccc32)C1 ZINC000249381937 334332892 /nfs/dbraw/zinc/33/28/92/334332892.db2.gz SFIMVMBBGGQFLF-CVEARBPZSA-N 1 3 282.431 3.832 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](C)c2cccc3ccccc32)C1 ZINC000249381937 334332893 /nfs/dbraw/zinc/33/28/93/334332893.db2.gz SFIMVMBBGGQFLF-CVEARBPZSA-N 1 3 282.431 3.832 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@H]1CN)c1cccc2ccccc21 ZINC000251522095 334363058 /nfs/dbraw/zinc/36/30/58/334363058.db2.gz LDQFYJWZRUZUIQ-DHSIGJKJSA-N 1 3 268.404 3.618 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@H]1C[NH3+])c1cccc2ccccc21 ZINC000251522095 334363060 /nfs/dbraw/zinc/36/30/60/334363060.db2.gz LDQFYJWZRUZUIQ-DHSIGJKJSA-N 1 3 268.404 3.618 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)N1CCC[C@H]([C@H](C)[NH3+])C1 ZINC000251529297 334363332 /nfs/dbraw/zinc/36/33/32/334363332.db2.gz MLSPGLUPEYHFHD-KHYOSLBOSA-N 1 3 282.431 3.960 20 0 CHADHO C1C[C@@H]2C[C@H]([NH2+][C@@H]3CC[C@H]4CCCC[C@@H]4C3)CCN2C1 ZINC000252673289 334384864 /nfs/dbraw/zinc/38/48/64/334384864.db2.gz IMEUTJXEPMANOL-DUQPFJRNSA-N 1 3 276.468 3.562 20 0 CHADHO Cc1cc(N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)c2ccccc2n1 ZINC000252672767 334384929 /nfs/dbraw/zinc/38/49/29/334384929.db2.gz CLCRTMQQNNFDOG-CABCVRRESA-N 1 3 281.403 3.582 20 0 CHADHO Cc1cc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc2n1 ZINC000252672767 334384931 /nfs/dbraw/zinc/38/49/31/334384931.db2.gz CLCRTMQQNNFDOG-CABCVRRESA-N 1 3 281.403 3.582 20 0 CHADHO CC[C@@H]1CCC[C@H](N[C@H]2C[C@H]([NH3+])c3ccccc32)C1 ZINC000252763951 334390998 /nfs/dbraw/zinc/39/09/98/334390998.db2.gz FDUKQACTUBBZMR-OQUILHJVSA-N 1 3 258.409 3.690 20 0 CHADHO CC(C)(CC[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCCN1)C1CC1 ZINC000262143941 334532818 /nfs/dbraw/zinc/53/28/18/334532818.db2.gz FHKHTYNKGHXZNR-YESZJQIVSA-N 1 3 278.484 3.713 20 0 CHADHO CCc1ccc([C@@H](CC)[NH2+]CC2=CCN(C)CC2)cc1 ZINC000344295535 335246434 /nfs/dbraw/zinc/24/64/34/335246434.db2.gz UCPVJACJQFJIMY-GOSISDBHSA-N 1 3 272.436 3.552 20 0 CHADHO Cc1cc(Cl)cc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)N3C)c1 ZINC000577477346 335356513 /nfs/dbraw/zinc/35/65/13/335356513.db2.gz QKGXSRPUFJTOLJ-SJPCQFCGSA-N 1 3 292.854 3.705 20 0 CHADHO Cc1cc(Cl)cc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)N3C)c1 ZINC000577477346 335356515 /nfs/dbraw/zinc/35/65/15/335356515.db2.gz QKGXSRPUFJTOLJ-SJPCQFCGSA-N 1 3 292.854 3.705 20 0 CHADHO CC(C)(CN[C@@H]1CCC[C@@H]([NH3+])C1)c1c(F)cccc1Cl ZINC000577509569 335362654 /nfs/dbraw/zinc/36/26/54/335362654.db2.gz DWFUQINGENTZJR-VXGBXAGGSA-N 1 3 298.833 3.616 20 0 CHADHO CC(C)(C)CC(C)(C)[NH+]1CCC(NCCCF)CC1 ZINC000577704990 335390466 /nfs/dbraw/zinc/39/04/66/335390466.db2.gz MJWNPGNTYGGLBB-UHFFFAOYSA-N 1 3 272.452 3.615 20 0 CHADHO c1csc([C@H]2CCCN2Cc2ccc3c(c2)C[NH2+]CC3)c1 ZINC000581829427 336148887 /nfs/dbraw/zinc/14/88/87/336148887.db2.gz RVISAMJCNGDGJG-QGZVFWFLSA-N 1 3 298.455 3.731 20 0 CHADHO C[C@H](c1cccc2ccccc21)N1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC000386687375 336177361 /nfs/dbraw/zinc/17/73/61/336177361.db2.gz KNQOGGBYOBBQSR-IDHHARJASA-N 1 3 280.415 3.585 20 0 CHADHO CC(C)(CN[C@H]1C[C@H]([NH3+])c2ccccc21)c1cccs1 ZINC000157473360 519271114 /nfs/dbraw/zinc/27/11/14/519271114.db2.gz XUTRKZJQGLNTDZ-GJZGRUSLSA-N 1 3 286.444 3.760 20 0 CHADHO CCCCC[C@H](C)[NH2+]C1CCN(c2ccncc2)CC1 ZINC000036792061 520309973 /nfs/dbraw/zinc/30/99/73/520309973.db2.gz DJAPEBGSBOBODY-HNNXBMFYSA-N 1 3 275.440 3.609 20 0 CHADHO CCCCN1CCC([NH2+][C@H](C)c2cccc(OC)c2)CC1 ZINC000037150436 520578059 /nfs/dbraw/zinc/57/80/59/520578059.db2.gz IHVUJJUVVCDMDH-OAHLLOKOSA-N 1 3 290.451 3.610 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N[C@@H](C)c1cccnc1Cl ZINC000131277869 520630820 /nfs/dbraw/zinc/63/08/20/520630820.db2.gz WVVMVMNHVVZDNB-KGLIPLIRSA-N 1 3 297.874 3.896 20 0 CHADHO CC[NH+](CC)Cc1ccc(CN[C@H](C)c2cccnc2)cc1 ZINC000120579024 520750649 /nfs/dbraw/zinc/75/06/49/520750649.db2.gz SBHHFADZKPRTMM-MRXNPFEDSA-N 1 3 297.446 3.774 20 0 CHADHO CC[N@H+](CC[C@H]1CCCN1C)Cc1cccc(Cl)c1 ZINC000340373361 521160300 /nfs/dbraw/zinc/16/03/00/521160300.db2.gz MTTULIUQVJZACM-MRXNPFEDSA-N 1 3 280.843 3.646 20 0 CHADHO CC[N@@H+](CC[C@H]1CCCN1C)Cc1cccc(Cl)c1 ZINC000340373361 521160309 /nfs/dbraw/zinc/16/03/09/521160309.db2.gz MTTULIUQVJZACM-MRXNPFEDSA-N 1 3 280.843 3.646 20 0 CHADHO CC[C@H]1CCC[C@H]([NH2+]C2CCN(c3ccncc3)CC2)C1 ZINC000068591788 523139590 /nfs/dbraw/zinc/13/95/90/523139590.db2.gz KUQATEJTLOYYMF-RDJZCZTQSA-N 1 3 287.451 3.609 20 0 CHADHO CC[C@@H]1CCCC[C@@H]1[NH2+]C1CCN(c2ccncc2)CC1 ZINC000037031393 523196931 /nfs/dbraw/zinc/19/69/31/523196931.db2.gz YJGGPEJQJPMQCQ-QAPCUYQASA-N 1 3 287.451 3.609 20 0 CHADHO CN(Cc1cccc2ccccc21)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000040746532 523321493 /nfs/dbraw/zinc/32/14/93/523321493.db2.gz WCXKZVXHDJNTET-JWTNVVGKSA-N 1 3 280.415 3.555 20 0 CHADHO COc1cccc([C@@H](C)[NH2+]C2CCN(C(C)(C)C)CC2)c1 ZINC000037786210 524089937 /nfs/dbraw/zinc/08/99/37/524089937.db2.gz ICEAVEWNVWCMGY-CQSZACIVSA-N 1 3 290.451 3.609 20 0 CHADHO CSC1(CNC2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)CC1 ZINC000365106208 525329619 /nfs/dbraw/zinc/32/96/19/525329619.db2.gz CPSVVBDQLBQTLK-ZBFHGGJFSA-N 1 3 296.524 3.515 20 0 CHADHO CSC1(C[NH2+]C2CCN([C@H]3CCCC[C@H]3C)CC2)CC1 ZINC000365106208 525329632 /nfs/dbraw/zinc/32/96/32/525329632.db2.gz CPSVVBDQLBQTLK-ZBFHGGJFSA-N 1 3 296.524 3.515 20 0 CHADHO Cc1ccnc([C@H](C)NCCCC[NH+]2CCC(C)CC2)c1 ZINC000285633443 525713299 /nfs/dbraw/zinc/71/32/99/525713299.db2.gz LLZPKCKYGADCCV-KRWDZBQOSA-N 1 3 289.467 3.553 20 0 CHADHO CSc1ccc([C@@H](C)NC[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000037649184 526061248 /nfs/dbraw/zinc/06/12/48/526061248.db2.gz NCEYQEHAFMBTIF-KGLIPLIRSA-N 1 3 290.476 3.543 20 0 CHADHO CSc1ccc([C@@H](C)NC[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000037649184 526061259 /nfs/dbraw/zinc/06/12/59/526061259.db2.gz NCEYQEHAFMBTIF-KGLIPLIRSA-N 1 3 290.476 3.543 20 0 CHADHO Cc1oc2ccccc2c1CN(C)[C@@H]1CC[N@@H+](C)C[C@@H]1C ZINC000290395763 526786618 /nfs/dbraw/zinc/78/66/18/526786618.db2.gz JBEVLEWOYNJBDR-SUMWQHHRSA-N 1 3 286.419 3.513 20 0 CHADHO Cc1oc2ccccc2c1CN(C)[C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000290395763 526786623 /nfs/dbraw/zinc/78/66/23/526786623.db2.gz JBEVLEWOYNJBDR-SUMWQHHRSA-N 1 3 286.419 3.513 20 0 CHADHO N[C@@H]1C[C@@H]([NH2+]CCSc2ccccc2)c2ccccc21 ZINC000157409247 527375118 /nfs/dbraw/zinc/37/51/18/527375118.db2.gz HZWZQBFQCFIVST-IAGOWNOFSA-N 1 3 284.428 3.513 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2cccc3cccnc32)C[C@@H]1C ZINC000353746943 527757318 /nfs/dbraw/zinc/75/73/18/527757318.db2.gz LXSSLXJKRPCUDC-MAUKXSAKSA-N 1 3 297.446 3.539 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2cccc3cccnc32)C[C@@H]1C ZINC000353746943 527757321 /nfs/dbraw/zinc/75/73/21/527757321.db2.gz LXSSLXJKRPCUDC-MAUKXSAKSA-N 1 3 297.446 3.539 20 0 CHADHO CC1=CCC[C@@H](C)[C@H]1C[NH+]1CCC(N2CCCC2)CC1 ZINC000191047180 528106543 /nfs/dbraw/zinc/10/65/43/528106543.db2.gz UWZVILIDIHHFGH-AEFFLSMTSA-N 1 3 276.468 3.539 20 0 CHADHO CC1=CCC[C@@H](C)[C@H]1CN1CCC([NH+]2CCCC2)CC1 ZINC000191047180 528106550 /nfs/dbraw/zinc/10/65/50/528106550.db2.gz UWZVILIDIHHFGH-AEFFLSMTSA-N 1 3 276.468 3.539 20 0 CHADHO CC(C)C1CCC(C[NH2+]C[C@H]2CCN(C(C)C)C2)CC1 ZINC000394285349 1118680190 /nfs/dbraw/zinc/68/01/90/1118680190.db2.gz JQLWFODSFLOCFG-LXPRWKDFSA-N 1 3 280.500 3.769 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1csc(Cl)c1 ZINC000191166103 1120516128 /nfs/dbraw/zinc/51/61/28/1120516128.db2.gz YVPKEETZIMREKI-WDEREUQCSA-N 1 3 284.856 3.536 20 0 CHADHO CC[C@H]1CCC[C@@H]([NH2+]CCCN(C)C(C)C)CC1 ZINC000226334589 1120601938 /nfs/dbraw/zinc/60/19/38/1120601938.db2.gz ZQDCZGQTJCTVIL-JKSUJKDBSA-N 1 3 254.462 3.665 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@@H]1CCCc2c(Cl)cccc21 ZINC000543599597 1121508471 /nfs/dbraw/zinc/50/84/71/1121508471.db2.gz CFSSWHYVMSPDHN-MLGOLLRUSA-N 1 3 280.843 3.647 20 0 CHADHO CCN1CC[C@H](C[NH2+]CC[C@H](C)CCC=C(C)C)C1 ZINC000512844340 1121623106 /nfs/dbraw/zinc/62/31/06/1121623106.db2.gz HHHLLOMNYVCMRX-IAGOWNOFSA-N 1 3 266.473 3.690 20 0 CHADHO C[C@H]1CC[C@H]([NH2+]CC2(N)CCCC2)c2sccc21 ZINC000665246564 1123253833 /nfs/dbraw/zinc/25/38/33/1123253833.db2.gz IXAGBNNXZWLHHK-AAEUAGOBSA-N 1 3 264.438 3.548 20 0 CHADHO NC1(C[NH2+][C@H](c2cccs2)C2CCCC2)CCCC1 ZINC000665248449 1123261009 /nfs/dbraw/zinc/26/10/09/1123261009.db2.gz XHJNAAPMPVGNLU-HNNXBMFYSA-N 1 3 278.465 3.841 20 0 CHADHO CCCC[C@@H]1C[C@@H]([N@@H+]2CCCCC[C@@H]2C)CCN1 ZINC001246771750 1131781148 /nfs/dbraw/zinc/78/11/48/1131781148.db2.gz ZEVKZHOQGFSANA-XHSDSOJGSA-N 1 3 252.446 3.562 20 0 CHADHO CCCC[C@@H]1C[C@@H]([N@H+]2CCCCC[C@@H]2C)CCN1 ZINC001246771750 1131781155 /nfs/dbraw/zinc/78/11/55/1131781155.db2.gz ZEVKZHOQGFSANA-XHSDSOJGSA-N 1 3 252.446 3.562 20 0 CHADHO CN1C(C)(C)CC([N@H+]2CCCC(F)(F)CC2)CC1(C)C ZINC001171631894 1132062677 /nfs/dbraw/zinc/06/26/77/1132062677.db2.gz PCCKQEOCUUKEFQ-UHFFFAOYSA-N 1 3 288.426 3.759 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NC[C@@H]2CCc3ccccc3C2)c2ccccc21 ZINC000643478080 1125513644 /nfs/dbraw/zinc/51/36/44/1125513644.db2.gz WRDNBPGQVZWDBP-JSNMRZPZSA-N 1 3 292.426 3.526 20 0 CHADHO Cc1ccc([C@H](C)C[NH2+]C2CCN(CC(C)C)CC2)cc1 ZINC000152000168 1125636262 /nfs/dbraw/zinc/63/62/62/1125636262.db2.gz KSAVMQOIEOIEPV-QGZVFWFLSA-N 1 3 288.479 3.809 20 0 CHADHO C[C@@H]1CC[N@H+](CC[C@H]2CCCN2C)[C@@H](c2ccco2)C1 ZINC000248142917 1125663231 /nfs/dbraw/zinc/66/32/31/1125663231.db2.gz ZADSIBSGUHAVKF-BZUAXINKSA-N 1 3 276.424 3.537 20 0 CHADHO C[C@@H]1CC[N@@H+](CC[C@H]2CCCN2C)[C@@H](c2ccco2)C1 ZINC000248142917 1125663232 /nfs/dbraw/zinc/66/32/32/1125663232.db2.gz ZADSIBSGUHAVKF-BZUAXINKSA-N 1 3 276.424 3.537 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCCC[C@H]1C)c1cccs1 ZINC000248534797 1125665650 /nfs/dbraw/zinc/66/56/50/1125665650.db2.gz WLHANWMXSINUEL-ZIAGYGMSSA-N 1 3 266.454 3.663 20 0 CHADHO CCC1(N2CCC2)CC[NH+]([C@@H]2CCc3ccccc32)CC1 ZINC000886715939 1125711708 /nfs/dbraw/zinc/71/17/08/1125711708.db2.gz JRWYKDJLRFFQDS-GOSISDBHSA-N 1 3 284.447 3.624 20 0 CHADHO CN(Cc1ccccc1-c1ccccc1)C[C@@]1(C)CC[NH2+]C1 ZINC000262064502 1125750464 /nfs/dbraw/zinc/75/04/64/1125750464.db2.gz RLQJQDZWILAZIW-FQEVSTJZSA-N 1 3 294.442 3.785 20 0 CHADHO CCSc1ccc([C@@H](C)[NH2+]CCCN2CCCC2)cc1 ZINC000533784304 1125781998 /nfs/dbraw/zinc/78/19/98/1125781998.db2.gz IOPFKCJXVMZWKV-OAHLLOKOSA-N 1 3 292.492 3.935 20 0 CHADHO Cc1cccc2c1ncc(C)c2N1CCC[C@H]([NH+](C)C)CC1 ZINC000428678173 1125788628 /nfs/dbraw/zinc/78/86/28/1125788628.db2.gz GMWPAMQQZLBPSJ-INIZCTEOSA-N 1 3 297.446 3.772 20 0 CHADHO Cc1ccc(F)cc1[C@H](C)[NH2+]C1CCN(CC2CC2)CC1 ZINC001168366548 1126750526 /nfs/dbraw/zinc/75/05/26/1126750526.db2.gz VQCFGDNTBAEALC-AWEZNQCLSA-N 1 3 290.426 3.659 20 0 CHADHO CC(C)[N@H+](CCC1CCCCC1)[C@@H]1CCCNCC1 ZINC001206579919 1130488546 /nfs/dbraw/zinc/48/85/46/1130488546.db2.gz AXBCAWKFNMHERG-QGZVFWFLSA-N 1 3 266.473 3.809 20 0 CHADHO CC(C)[N@@H+](CCC1CCCCC1)[C@@H]1CCCNCC1 ZINC001206579919 1130488548 /nfs/dbraw/zinc/48/85/48/1130488548.db2.gz AXBCAWKFNMHERG-QGZVFWFLSA-N 1 3 266.473 3.809 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)C(C)(C)c1ccccc1 ZINC000484485115 1126818533 /nfs/dbraw/zinc/81/85/33/1126818533.db2.gz IWMPBTGSFNZQNY-RYQLBKOJSA-N 1 3 288.479 3.815 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)c1ccc2c(c1)CCC2 ZINC000484488288 1126819735 /nfs/dbraw/zinc/81/97/35/1126819735.db2.gz HHWDMDPOAZDZJX-JVPBZIDWSA-N 1 3 286.463 3.699 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)c1cc2c(s1)CCC2 ZINC000484504841 1126823132 /nfs/dbraw/zinc/82/31/32/1126823132.db2.gz QXHBPJZNGNSFAP-QEJZJMRPSA-N 1 3 292.492 3.760 20 0 CHADHO CC[C@H](c1ccccc1)N1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000252417999 1126853663 /nfs/dbraw/zinc/85/36/63/1126853663.db2.gz UHVJWNUOGIZLET-KZNAEPCWSA-N 1 3 272.436 3.602 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1)[C@@H]1CC1(C)C ZINC000487555985 1127035021 /nfs/dbraw/zinc/03/50/21/1127035021.db2.gz UGHZOXAMOCWCRO-HWMZRRJGSA-N 1 3 278.484 3.664 20 0 CHADHO Cc1ccc([C@@H](C)NC2CC[NH+](C3CCC3)CC2)cc1C ZINC000269031824 1127032503 /nfs/dbraw/zinc/03/25/03/1127032503.db2.gz RYVMFESZTLMKFK-MRXNPFEDSA-N 1 3 286.463 3.971 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](N[C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC000629556766 1127107586 /nfs/dbraw/zinc/10/75/86/1127107586.db2.gz YKNNWWRISCUIDQ-IIAWOOMASA-N 1 3 278.827 3.577 20 0 CHADHO c1ccc(C2=CC[N@H+](C3CCN(CC4CC4)CC3)CC2)cc1 ZINC001168387951 1127216564 /nfs/dbraw/zinc/21/65/64/1127216564.db2.gz ZBDBYTCIVRYPHI-UHFFFAOYSA-N 1 3 296.458 3.650 20 0 CHADHO c1ccc(C2=CC[N@@H+](C3CCN(CC4CC4)CC3)CC2)cc1 ZINC001168387951 1127216566 /nfs/dbraw/zinc/21/65/66/1127216566.db2.gz ZBDBYTCIVRYPHI-UHFFFAOYSA-N 1 3 296.458 3.650 20 0 CHADHO CC(C)(C)N1CCC([NH2+]Cc2ccc3occc3c2)CC1 ZINC000285463642 1127229901 /nfs/dbraw/zinc/22/99/01/1127229901.db2.gz NCLIKGMJBSXNTR-UHFFFAOYSA-N 1 3 286.419 3.785 20 0 CHADHO Cc1ccnc([C@H](C)NCCCC[N@@H+]2CCC[C@@H](C)C2)c1 ZINC000285464736 1127230458 /nfs/dbraw/zinc/23/04/58/1127230458.db2.gz AJVHAGSIKVJGHB-SJORKVTESA-N 1 3 289.467 3.553 20 0 CHADHO Cc1ccnc([C@H](C)NCCCC[N@H+]2CCC[C@@H](C)C2)c1 ZINC000285464736 1127230460 /nfs/dbraw/zinc/23/04/60/1127230460.db2.gz AJVHAGSIKVJGHB-SJORKVTESA-N 1 3 289.467 3.553 20 0 CHADHO NCCC[N@@H+](Cc1cccc2cccnc21)CC1CCCC1 ZINC000352488429 1127236235 /nfs/dbraw/zinc/23/62/35/1127236235.db2.gz QDOUUKPCHLRFSD-UHFFFAOYSA-N 1 3 297.446 3.576 20 0 CHADHO NCCC[N@H+](Cc1cccc2cccnc21)CC1CCCC1 ZINC000352488429 1127236238 /nfs/dbraw/zinc/23/62/38/1127236238.db2.gz QDOUUKPCHLRFSD-UHFFFAOYSA-N 1 3 297.446 3.576 20 0 CHADHO CC(C)[N@H+](C)CC1CCN(Cc2ccc(Cl)cc2)CC1 ZINC000590786364 1127272983 /nfs/dbraw/zinc/27/29/83/1127272983.db2.gz AITORIHRKQMUKT-UHFFFAOYSA-N 1 3 294.870 3.892 20 0 CHADHO CC(C)[N@@H+](C)CC1CCN(Cc2ccc(Cl)cc2)CC1 ZINC000590786364 1127272985 /nfs/dbraw/zinc/27/29/85/1127272985.db2.gz AITORIHRKQMUKT-UHFFFAOYSA-N 1 3 294.870 3.892 20 0 CHADHO Cc1cccc2c1CC[C@H]2NC1CC[NH+](C2CCC2)CC1 ZINC000360510233 1127501062 /nfs/dbraw/zinc/50/10/62/1127501062.db2.gz GRLCCRVSRKIPHM-LJQANCHMSA-N 1 3 284.447 3.589 20 0 CHADHO Cc1cnccc1CNCc1ccccc1C[N@@H+](C)C(C)C ZINC000295395132 1127640539 /nfs/dbraw/zinc/64/05/39/1127640539.db2.gz LQUQCROLVUTVLE-UHFFFAOYSA-N 1 3 297.446 3.520 20 0 CHADHO Cc1cnccc1CNCc1ccccc1C[N@H+](C)C(C)C ZINC000295395132 1127640541 /nfs/dbraw/zinc/64/05/41/1127640541.db2.gz LQUQCROLVUTVLE-UHFFFAOYSA-N 1 3 297.446 3.520 20 0 CHADHO FCCC[C@H]1CCC[C@@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000374603639 1127905665 /nfs/dbraw/zinc/90/56/65/1127905665.db2.gz NGAPDLURNCUBII-QAPCUYQASA-N 1 3 296.474 3.901 20 0 CHADHO CC(C)CCC[C@H](C)[NH2+]CCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000540169135 1127965185 /nfs/dbraw/zinc/96/51/85/1127965185.db2.gz DAUKKPZHXBLKSI-OKZBNKHCSA-N 1 3 298.515 3.680 20 0 CHADHO CCc1cccc(CN2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000469730906 1128051924 /nfs/dbraw/zinc/05/19/24/1128051924.db2.gz GZHMBKKLLZJADJ-AZUAARDMSA-N 1 3 298.474 3.698 20 0 CHADHO CCc1cccc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000469730906 1128051928 /nfs/dbraw/zinc/05/19/28/1128051928.db2.gz GZHMBKKLLZJADJ-AZUAARDMSA-N 1 3 298.474 3.698 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H]2CCC[C@@H]2CCCF)C1 ZINC000510756012 1128057268 /nfs/dbraw/zinc/05/72/68/1128057268.db2.gz YHEINOBJKPMJBH-ZACQAIPSSA-N 1 3 284.463 3.615 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@H+](C)C[C@H]1CCCNC1 ZINC000469977567 1128060109 /nfs/dbraw/zinc/06/01/09/1128060109.db2.gz VOJXAKLPIHTNPL-KKUMJFAQSA-N 1 3 294.870 3.763 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)C[C@H]1CCCNC1 ZINC000469977567 1128060113 /nfs/dbraw/zinc/06/01/13/1128060113.db2.gz VOJXAKLPIHTNPL-KKUMJFAQSA-N 1 3 294.870 3.763 20 0 CHADHO CCC[C@H](CN(C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1 ZINC000470016458 1128061429 /nfs/dbraw/zinc/06/14/29/1128061429.db2.gz GCHFYICMFAKQRN-KAKFPZCNSA-N 1 3 286.463 3.785 20 0 CHADHO C[N@H+](CC1CC1)C[C@H]1CCN([C@H]2CCCc3ccccc32)C1 ZINC000470976419 1128083841 /nfs/dbraw/zinc/08/38/41/1128083841.db2.gz KGMIQHSVJMXIDI-XLIONFOSSA-N 1 3 298.474 3.728 20 0 CHADHO C[N@@H+](CC1CC1)C[C@H]1CCN([C@H]2CCCc3ccccc32)C1 ZINC000470976419 1128083845 /nfs/dbraw/zinc/08/38/45/1128083845.db2.gz KGMIQHSVJMXIDI-XLIONFOSSA-N 1 3 298.474 3.728 20 0 CHADHO Cc1noc(C)c1[C@H](C)NCCCC[N@@H+]1CCCC[C@@H]1C ZINC000924687372 1128109579 /nfs/dbraw/zinc/10/95/79/1128109579.db2.gz OSMAWAVEYUONRL-KBPBESRZSA-N 1 3 293.455 3.597 20 0 CHADHO Cc1noc(C)c1[C@H](C)NCCCC[N@H+]1CCCC[C@@H]1C ZINC000924687372 1128109583 /nfs/dbraw/zinc/10/95/83/1128109583.db2.gz OSMAWAVEYUONRL-KBPBESRZSA-N 1 3 293.455 3.597 20 0 CHADHO CCOc1ccccc1CN[C@H](CCC[NH3+])c1ccccc1 ZINC000925493333 1128130495 /nfs/dbraw/zinc/13/04/95/1128130495.db2.gz KHMPNHVXQLBASQ-GOSISDBHSA-N 1 3 298.430 3.655 20 0 CHADHO COc1cc(C)ccc1CN[C@H](CCC[NH3+])c1ccccc1 ZINC000925551908 1128131778 /nfs/dbraw/zinc/13/17/78/1128131778.db2.gz HXVFBYLWACMJPR-GOSISDBHSA-N 1 3 298.430 3.573 20 0 CHADHO CC1(C)C[C@@H]([NH3+])C[C@@H](NCc2ccc(C(F)F)cc2)C1 ZINC000925638874 1128135690 /nfs/dbraw/zinc/13/56/90/1128135690.db2.gz HONRMEKDIRYLFP-UONOGXRCSA-N 1 3 282.378 3.620 20 0 CHADHO CC1(C)C[C@@H](NCc2ccc(C(F)F)cc2)C[C@@H]([NH3+])C1 ZINC000925638873 1128135702 /nfs/dbraw/zinc/13/57/02/1128135702.db2.gz HONRMEKDIRYLFP-KGLIPLIRSA-N 1 3 282.378 3.620 20 0 CHADHO CC1(C)C[C@H]([NH3+])C[C@@H](NCc2ccc(C(F)F)cc2)C1 ZINC000925638875 1128135841 /nfs/dbraw/zinc/13/58/41/1128135841.db2.gz HONRMEKDIRYLFP-ZIAGYGMSSA-N 1 3 282.378 3.620 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1coc2ccccc12 ZINC000926753214 1128192329 /nfs/dbraw/zinc/19/23/29/1128192329.db2.gz LUYRHVYDJOSSHX-CABCVRRESA-N 1 3 286.419 3.815 20 0 CHADHO Cc1ccc2cc([C@H](C)[NH2+]CC(C)(C)CN(C)C)oc2c1 ZINC000495249374 1128253629 /nfs/dbraw/zinc/25/36/29/1128253629.db2.gz GPKGPVCLDUQCOP-AWEZNQCLSA-N 1 3 288.435 3.980 20 0 CHADHO CCCCCC[C@H](C)[NH+]1C[C@H]2CN(CCC)C[C@@H]2C1 ZINC001257372895 1128284266 /nfs/dbraw/zinc/28/42/66/1128284266.db2.gz QQUBSJXBQODEEY-GVDBMIGSSA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)c1ccccc1C[N@@H+]1CCCC12CCNCC2 ZINC001235143530 1128305498 /nfs/dbraw/zinc/30/54/98/1128305498.db2.gz DVVDDTLJOJZELT-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO CC(C)c1ccccc1C[N@H+]1CCCC12CCNCC2 ZINC001235143530 1128305500 /nfs/dbraw/zinc/30/55/00/1128305500.db2.gz DVVDDTLJOJZELT-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1csc(Cl)c1 ZINC000322703569 1128348205 /nfs/dbraw/zinc/34/82/05/1128348205.db2.gz MKZWQUIURIHEDD-NSNUZPRRSA-N 1 3 284.856 3.677 20 0 CHADHO C[C@H](CN1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)C(C)(C)C ZINC000670265661 1128377259 /nfs/dbraw/zinc/37/72/59/1128377259.db2.gz PAEJAAUEDXDFKP-HLLBOEOZSA-N 1 3 278.484 3.617 20 0 CHADHO C[C@H](CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)C(C)(C)C ZINC000670265661 1128377263 /nfs/dbraw/zinc/37/72/63/1128377263.db2.gz PAEJAAUEDXDFKP-HLLBOEOZSA-N 1 3 278.484 3.617 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]C[C@@H]2CCCC[C@H]2C)C1 ZINC001649175990 1128404736 /nfs/dbraw/zinc/40/47/36/1128404736.db2.gz SYKFQDQYBBGOPE-IKGGRYGDSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@H]1C[C@@H](N(C)Cc2ccc3ccccc3c2)CC[N@@H+]1C ZINC000123343329 1128410719 /nfs/dbraw/zinc/41/07/19/1128410719.db2.gz VDUVNDUAWYGGFI-KXBFYZLASA-N 1 3 282.431 3.754 20 0 CHADHO C[C@H]1C[C@@H](N(C)Cc2ccc3ccccc3c2)CC[N@H+]1C ZINC000123343329 1128410722 /nfs/dbraw/zinc/41/07/22/1128410722.db2.gz VDUVNDUAWYGGFI-KXBFYZLASA-N 1 3 282.431 3.754 20 0 CHADHO C[C@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccc2c(c1)CCCC2 ZINC000124359138 1128444045 /nfs/dbraw/zinc/44/40/45/1128444045.db2.gz FZQQOLQUSGVXGG-JKSUJKDBSA-N 1 3 298.474 3.700 20 0 CHADHO C[C@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc2c(c1)CCCC2 ZINC000124359138 1128444047 /nfs/dbraw/zinc/44/40/47/1128444047.db2.gz FZQQOLQUSGVXGG-JKSUJKDBSA-N 1 3 298.474 3.700 20 0 CHADHO Cc1ccc(C)c([C@H](C)NC[C@H](C)C[NH+]2CCCC2)c1 ZINC000062078166 1128437113 /nfs/dbraw/zinc/43/71/13/1128437113.db2.gz SKTPGEANPDZJIW-RDJZCZTQSA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc(C[N@@H+](C)CC[C@H]2CCCCN2C)c(C)c1 ZINC000565790855 1128533031 /nfs/dbraw/zinc/53/30/31/1128533031.db2.gz BATGLCHELGSNQG-GOSISDBHSA-N 1 3 274.452 3.610 20 0 CHADHO Cc1ccc(C[N@H+](C)CC[C@H]2CCCCN2C)c(C)c1 ZINC000565790855 1128533034 /nfs/dbraw/zinc/53/30/34/1128533034.db2.gz BATGLCHELGSNQG-GOSISDBHSA-N 1 3 274.452 3.610 20 0 CHADHO C[C@@H]1C[C@@H](N[C@@H](c2ccc(Cl)cc2)C2CC2)CC[N@@H+]1C ZINC000129714882 1128554405 /nfs/dbraw/zinc/55/44/05/1128554405.db2.gz CSTGYHICZNBFQO-OAUYIBNBSA-N 1 3 292.854 3.863 20 0 CHADHO C[C@@H]1C[C@@H](N[C@@H](c2ccc(Cl)cc2)C2CC2)CC[N@H+]1C ZINC000129714882 1128554407 /nfs/dbraw/zinc/55/44/07/1128554407.db2.gz CSTGYHICZNBFQO-OAUYIBNBSA-N 1 3 292.854 3.863 20 0 CHADHO CCCCN1CCC([NH2+][C@@H]2CCc3cc(F)ccc32)CC1 ZINC000130015740 1128562133 /nfs/dbraw/zinc/56/21/33/1128562133.db2.gz CWCRHFXARJYXLH-GOSISDBHSA-N 1 3 290.426 3.667 20 0 CHADHO CC[NH+]1CCC(N[C@@H]2C[C@@H](C)c3c2cccc3C)CC1 ZINC000152627434 1128614814 /nfs/dbraw/zinc/61/48/14/1128614814.db2.gz AMGMWHGOZXHJQP-RHSMWYFYSA-N 1 3 272.436 3.617 20 0 CHADHO CC(C)c1ccc(C[N@@H+]2CCC[C@H]3CN(C)CC[C@@H]32)cc1 ZINC000570320067 1128621503 /nfs/dbraw/zinc/62/15/03/1128621503.db2.gz YCUDVRHGEFXMQP-OALUTQOASA-N 1 3 286.463 3.726 20 0 CHADHO CC(C)c1ccc(C[N@H+]2CCC[C@H]3CN(C)CC[C@@H]32)cc1 ZINC000570320067 1128621505 /nfs/dbraw/zinc/62/15/05/1128621505.db2.gz YCUDVRHGEFXMQP-OALUTQOASA-N 1 3 286.463 3.726 20 0 CHADHO CC(C)c1ccc(CN2CCC[C@H]3C[N@H+](C)CC[C@@H]32)cc1 ZINC000570320067 1128621506 /nfs/dbraw/zinc/62/15/06/1128621506.db2.gz YCUDVRHGEFXMQP-OALUTQOASA-N 1 3 286.463 3.726 20 0 CHADHO CC(C)c1ccc(CN2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)cc1 ZINC000570320067 1128621507 /nfs/dbraw/zinc/62/15/07/1128621507.db2.gz YCUDVRHGEFXMQP-OALUTQOASA-N 1 3 286.463 3.726 20 0 CHADHO Cc1cc(CNCc2ccc([C@@H](C)[NH3+])cc2)c(C)s1 ZINC000556934316 1128647985 /nfs/dbraw/zinc/64/79/85/1128647985.db2.gz UWHVHDIAUHQGEP-GFCCVEGCSA-N 1 3 274.433 3.674 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+]C[C@@H](C)CC2CCCCC2)C1 ZINC000578401320 1128717101 /nfs/dbraw/zinc/71/71/01/1128717101.db2.gz GHWWMBRYIOEQRG-WMZOPIPTSA-N 1 3 280.500 3.913 20 0 CHADHO C[C@H]1C[C@H]1c1ccc(CNCCCCC[NH+]2CCCC2)o1 ZINC000339496537 1117808522 /nfs/dbraw/zinc/80/85/22/1117808522.db2.gz CCYKJPFASOWGDX-DOTOQJQBSA-N 1 3 290.451 3.759 20 0 CHADHO Clc1sccc1CNCCCCC[NH+]1CCCC1 ZINC000339499113 1117810433 /nfs/dbraw/zinc/81/04/33/1117810433.db2.gz ZACLSDDDYYYJSO-UHFFFAOYSA-N 1 3 286.872 3.757 20 0 CHADHO CC(C)[C@@H](N[C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(F)cc1 ZINC000623343533 1117835757 /nfs/dbraw/zinc/83/57/57/1117835757.db2.gz YXDNNTHIPYEFSD-IAGOWNOFSA-N 1 3 292.442 3.985 20 0 CHADHO CC(C)[C@@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(F)cc1 ZINC000623343533 1117835764 /nfs/dbraw/zinc/83/57/64/1117835764.db2.gz YXDNNTHIPYEFSD-IAGOWNOFSA-N 1 3 292.442 3.985 20 0 CHADHO CC[C@@H](N[C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1 ZINC000623384665 1117847434 /nfs/dbraw/zinc/84/74/34/1117847434.db2.gz CLARFDOECNKVLE-HZPDHXFCSA-N 1 3 260.425 3.600 20 0 CHADHO CC[C@@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1 ZINC000623384665 1117847437 /nfs/dbraw/zinc/84/74/37/1117847437.db2.gz CLARFDOECNKVLE-HZPDHXFCSA-N 1 3 260.425 3.600 20 0 CHADHO C[N@@H+]1CC[C@@H](NCc2cccc3ccsc32)CC1(C)C ZINC000623558753 1117871226 /nfs/dbraw/zinc/87/12/26/1117871226.db2.gz HSGNZDADABKKDP-OAHLLOKOSA-N 1 3 288.460 3.864 20 0 CHADHO C[N@H+]1CC[C@@H](NCc2cccc3ccsc32)CC1(C)C ZINC000623558753 1117871230 /nfs/dbraw/zinc/87/12/30/1117871230.db2.gz HSGNZDADABKKDP-OAHLLOKOSA-N 1 3 288.460 3.864 20 0 CHADHO CCCc1ccc(C[NH2+]C[C@H]2CCCCN(C)C2)s1 ZINC000623657003 1117885162 /nfs/dbraw/zinc/88/51/62/1117885162.db2.gz HKLVRVDUDGHPNI-CQSZACIVSA-N 1 3 280.481 3.522 20 0 CHADHO CC[C@H]([NH2+]C1CCN(CC2CCCC2)CC1)C(C)C ZINC000178159565 1117887830 /nfs/dbraw/zinc/88/78/30/1117887830.db2.gz UPNVTWAUMBQBBY-KRWDZBQOSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)Oc1cccc([C@H](C)[NH2+]CCCN2CCCC2)c1 ZINC000179674047 1117909823 /nfs/dbraw/zinc/90/98/23/1117909823.db2.gz ILQHICUGMHMMBP-INIZCTEOSA-N 1 3 290.451 3.610 20 0 CHADHO C[C@@H]1C[C@@H](NC2(c3ccc(Cl)cc3)CCC2)CC[N@@H+]1C ZINC000180355571 1117928640 /nfs/dbraw/zinc/92/86/40/1117928640.db2.gz CYPSMFXOKLFXCK-CJNGLKHVSA-N 1 3 292.854 3.792 20 0 CHADHO C[C@@H]1C[C@@H](NC2(c3ccc(Cl)cc3)CCC2)CC[N@H+]1C ZINC000180355571 1117928642 /nfs/dbraw/zinc/92/86/42/1117928642.db2.gz CYPSMFXOKLFXCK-CJNGLKHVSA-N 1 3 292.854 3.792 20 0 CHADHO CCCCN1CCC([NH2+][C@H](C)c2ccc(Cl)nc2)CC1 ZINC000179115283 1117932262 /nfs/dbraw/zinc/93/22/62/1117932262.db2.gz PUNRVQBRSCGIBR-CYBMUJFWSA-N 1 3 295.858 3.650 20 0 CHADHO C[C@@H](NC[C@@H]1CCCC[N@H+](C)C1)c1cc2c(s1)CCC2 ZINC000624122591 1117984647 /nfs/dbraw/zinc/98/46/47/1117984647.db2.gz WKDLXZQFWUSMBR-KGLIPLIRSA-N 1 3 292.492 3.619 20 0 CHADHO C[C@@H](NC[C@@H]1CCCC[N@@H+](C)C1)c1cc2c(s1)CCC2 ZINC000624122591 1117984650 /nfs/dbraw/zinc/98/46/50/1117984650.db2.gz WKDLXZQFWUSMBR-KGLIPLIRSA-N 1 3 292.492 3.619 20 0 CHADHO CN1CCCC[C@@H](C[NH2+][C@H]2CCCc3cc(F)ccc32)C1 ZINC000624122278 1117984667 /nfs/dbraw/zinc/98/46/67/1117984667.db2.gz NPWGTFIRPJKSTN-KSSFIOAISA-N 1 3 290.426 3.525 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccc(F)c(Cl)c1 ZINC000624120711 1117985592 /nfs/dbraw/zinc/98/55/92/1117985592.db2.gz FPMDBIBTOOTLDO-CHWSQXEVSA-N 1 3 298.833 3.862 20 0 CHADHO C[C@@H](NC[C@H]1CCCC[N@H+](C)C1)c1cc2c(s1)CCC2 ZINC000624122593 1117985709 /nfs/dbraw/zinc/98/57/09/1117985709.db2.gz WKDLXZQFWUSMBR-ZIAGYGMSSA-N 1 3 292.492 3.619 20 0 CHADHO C[C@@H](NC[C@H]1CCCC[N@@H+](C)C1)c1cc2c(s1)CCC2 ZINC000624122593 1117985711 /nfs/dbraw/zinc/98/57/11/1117985711.db2.gz WKDLXZQFWUSMBR-ZIAGYGMSSA-N 1 3 292.492 3.619 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@@H]2CCCc3cc(F)ccc32)C1 ZINC000624122279 1117986136 /nfs/dbraw/zinc/98/61/36/1117986136.db2.gz NPWGTFIRPJKSTN-RDTXWAMCSA-N 1 3 290.426 3.525 20 0 CHADHO CC[C@@H](CCc1ccccc1)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000624124831 1117986608 /nfs/dbraw/zinc/98/66/08/1117986608.db2.gz LYBOPJUAEIFHEC-OALUTQOASA-N 1 3 288.479 3.719 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCCN(C)C2)c2ccccc21 ZINC000624123330 1117987609 /nfs/dbraw/zinc/98/76/09/1117987609.db2.gz JYONPNPOVWKHCG-IIDMSEBBSA-N 1 3 272.436 3.556 20 0 CHADHO CC(C)(C)c1ccc(C[NH2+]C[C@H]2CCN(C3CC3)C2)cc1 ZINC000037408233 1118012291 /nfs/dbraw/zinc/01/22/91/1118012291.db2.gz HVYGSQCTGSUPMN-MRXNPFEDSA-N 1 3 286.463 3.558 20 0 CHADHO CC[C@H](c1ccc(F)cc1)N(C)C[C@H]1CCC[N@H+](C)C1 ZINC000247029992 1118065378 /nfs/dbraw/zinc/06/53/78/1118065378.db2.gz RBDBHVOXEIJBHP-WMLDXEAASA-N 1 3 278.415 3.550 20 0 CHADHO CC[C@H](c1ccc(F)cc1)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000247029992 1118065384 /nfs/dbraw/zinc/06/53/84/1118065384.db2.gz RBDBHVOXEIJBHP-WMLDXEAASA-N 1 3 278.415 3.550 20 0 CHADHO CCCCCC[C@@H](C)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000705966995 1118117409 /nfs/dbraw/zinc/11/74/09/1118117409.db2.gz KITSXIYUBBCBMN-HZPDHXFCSA-N 1 3 254.462 3.667 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@@H]2CCCCC23CCCC3)C1 ZINC000706071843 1118141114 /nfs/dbraw/zinc/14/11/14/1118141114.db2.gz WHNAEVLDRASGCO-IAGOWNOFSA-N 1 3 278.484 3.811 20 0 CHADHO C[C@@H]1CC[C@@H]([NH2+]C2CCN(CC3CCCC3)CC2)CS1 ZINC000655703775 1118188294 /nfs/dbraw/zinc/18/82/94/1118188294.db2.gz LHEFFEBVXPIUGU-RHSMWYFYSA-N 1 3 296.524 3.515 20 0 CHADHO Cc1cccc([C@H](C)[NH2+]CCCN2CCCC[C@@H]2C)c1 ZINC000037200202 1118229046 /nfs/dbraw/zinc/22/90/46/1118229046.db2.gz STIGOBVCIFICMA-IRXDYDNUSA-N 1 3 274.452 3.910 20 0 CHADHO CC[C@H](C)[C@@H]1CCCC[N@@H+]1CCCN(CC)CC ZINC001652547107 1118271738 /nfs/dbraw/zinc/27/17/38/1118271738.db2.gz WYCFHWVVRXZAKR-HOTGVXAUSA-N 1 3 254.462 3.619 20 0 CHADHO CC[C@H](C)[C@@H]1CCCC[N@H+]1CCCN(CC)CC ZINC001652547107 1118271745 /nfs/dbraw/zinc/27/17/45/1118271745.db2.gz WYCFHWVVRXZAKR-HOTGVXAUSA-N 1 3 254.462 3.619 20 0 CHADHO CC[C@@H](C)[C@H]1CCCC[N@@H+]1CCCN(CC)CC ZINC001652547108 1118272358 /nfs/dbraw/zinc/27/23/58/1118272358.db2.gz WYCFHWVVRXZAKR-HZPDHXFCSA-N 1 3 254.462 3.619 20 0 CHADHO CC[C@@H](C)[C@H]1CCCC[N@H+]1CCCN(CC)CC ZINC001652547108 1118272359 /nfs/dbraw/zinc/27/23/59/1118272359.db2.gz WYCFHWVVRXZAKR-HZPDHXFCSA-N 1 3 254.462 3.619 20 0 CHADHO CC[C@@H](C)C[N@H+](Cc1ccc(Cl)cc1)C1CCNCC1 ZINC001236453526 1128771204 /nfs/dbraw/zinc/77/12/04/1128771204.db2.gz ROSILYUVZDXTGI-CQSZACIVSA-N 1 3 294.870 3.940 20 0 CHADHO CC[C@@H](C)C[N@@H+](Cc1ccc(Cl)cc1)C1CCNCC1 ZINC001236453526 1128771206 /nfs/dbraw/zinc/77/12/06/1128771206.db2.gz ROSILYUVZDXTGI-CQSZACIVSA-N 1 3 294.870 3.940 20 0 CHADHO Cc1cc2cc(N[C@H]3CCCC[C@@H]3[NH+](C)C)ccc2cn1 ZINC001168602120 1118367613 /nfs/dbraw/zinc/36/76/13/1118367613.db2.gz CRMRDFIKMCPPLF-ROUUACIJSA-N 1 3 283.419 3.828 20 0 CHADHO CCCC[C@H](C)[C@H](C)[NH2+]CCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000580120646 1118383087 /nfs/dbraw/zinc/38/30/87/1118383087.db2.gz GLMNAHSZPIPTDC-FJIDUMEYSA-N 1 3 298.515 3.680 20 0 CHADHO CN1CCCC[C@@H]1CC[N@H+](C)Cc1ccc2cnccc2c1 ZINC000683831435 1118398080 /nfs/dbraw/zinc/39/80/80/1118398080.db2.gz XOGXBKHZSILDBV-LJQANCHMSA-N 1 3 297.446 3.541 20 0 CHADHO CN1CCCC[C@@H]1CC[N@@H+](C)Cc1ccc2cnccc2c1 ZINC000683831435 1118398085 /nfs/dbraw/zinc/39/80/85/1118398085.db2.gz XOGXBKHZSILDBV-LJQANCHMSA-N 1 3 297.446 3.541 20 0 CHADHO CC(C)[N@H+](C)CC1CCN(Cc2cc3ccccc3[nH]2)CC1 ZINC000684020536 1118489935 /nfs/dbraw/zinc/48/99/35/1118489935.db2.gz KEWKNFMJYCFKOY-UHFFFAOYSA-N 1 3 299.462 3.720 20 0 CHADHO CC(C)[N@@H+](C)CC1CCN(Cc2cc3ccccc3[nH]2)CC1 ZINC000684020536 1118489937 /nfs/dbraw/zinc/48/99/37/1118489937.db2.gz KEWKNFMJYCFKOY-UHFFFAOYSA-N 1 3 299.462 3.720 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@@H](C)CCC(C)(C)C)C1 ZINC000306041021 1118584018 /nfs/dbraw/zinc/58/40/18/1118584018.db2.gz NGRJOWRHOPDJFB-GJZGRUSLSA-N 1 3 254.462 3.521 20 0 CHADHO Clc1sccc1CN1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000656781972 1118654627 /nfs/dbraw/zinc/65/46/27/1118654627.db2.gz BKMXFRAGDHFNDG-CYBMUJFWSA-N 1 3 298.883 3.613 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCCc3cc(F)ccc32)C1 ZINC000341719569 1118814000 /nfs/dbraw/zinc/81/40/00/1118814000.db2.gz CJNHZWPFNRDGFO-NUJGCVRESA-N 1 3 290.426 3.666 20 0 CHADHO Cc1ccc(C(C)(C)C[N@@H+](C)CC[C@H]2CCCN2C)cc1 ZINC001167504129 1118944255 /nfs/dbraw/zinc/94/42/55/1118944255.db2.gz IFVHUQMSLNNZJA-GOSISDBHSA-N 1 3 288.479 3.689 20 0 CHADHO Cc1ccc(C(C)(C)C[N@H+](C)CC[C@H]2CCCN2C)cc1 ZINC001167504129 1118944259 /nfs/dbraw/zinc/94/42/59/1118944259.db2.gz IFVHUQMSLNNZJA-GOSISDBHSA-N 1 3 288.479 3.689 20 0 CHADHO C[NH+](C)CC(C)(C)CN1CCC(c2ccc(F)cc2)CC1 ZINC001207285299 1119047126 /nfs/dbraw/zinc/04/71/26/1119047126.db2.gz FJVMQSPOYMKSFP-UHFFFAOYSA-N 1 3 292.442 3.593 20 0 CHADHO C[C@@H](C[NH2+][C@H]1CCC[C@@H](C)CC1)CN1CCCCC1 ZINC000226500521 1119052265 /nfs/dbraw/zinc/05/22/65/1119052265.db2.gz BLMYSAUQCHXVLC-IKGGRYGDSA-N 1 3 266.473 3.667 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H]2C[C@@H](C)c3ccccc32)C1 ZINC000582383126 1119064140 /nfs/dbraw/zinc/06/41/40/1119064140.db2.gz MHZPQVAWNXHILB-JTDSTZFVSA-N 1 3 286.463 3.945 20 0 CHADHO Cc1ccc([C@H](C)C[N@@H+]2CC[C@@H]3[C@H](CCCN3C)C2)cc1 ZINC000628190948 1128824238 /nfs/dbraw/zinc/82/42/38/1128824238.db2.gz VPYNNEGENMZAIL-BHIYHBOVSA-N 1 3 286.463 3.515 20 0 CHADHO Cc1ccc([C@H](C)C[N@H+]2CC[C@@H]3[C@H](CCCN3C)C2)cc1 ZINC000628190948 1128824244 /nfs/dbraw/zinc/82/42/44/1128824244.db2.gz VPYNNEGENMZAIL-BHIYHBOVSA-N 1 3 286.463 3.515 20 0 CHADHO C[C@@H](NC1(c2ccccc2Cl)CC1)C1CC[NH+](C)CC1 ZINC000647316175 1119441659 /nfs/dbraw/zinc/44/16/59/1119441659.db2.gz SRBKUVQPCVYNTF-CYBMUJFWSA-N 1 3 292.854 3.649 20 0 CHADHO CC(C)[NH2+]CCCN[C@H](C)c1cccc2ccccc21 ZINC000584047211 1119466276 /nfs/dbraw/zinc/46/62/76/1119466276.db2.gz SWIXMVMLXONRHT-OAHLLOKOSA-N 1 3 270.420 3.879 20 0 CHADHO Cc1ccc([C@H](C)CN2CC[C@H](C[NH+]3CCCC3)C2)cc1 ZINC000628182039 1119492926 /nfs/dbraw/zinc/49/29/26/1119492926.db2.gz AMJQGOUHZLBPTA-QZTJIDSGSA-N 1 3 286.463 3.516 20 0 CHADHO C1CCC(N2CCC([NH2+][C@H]3CCCSCC3)CC2)CC1 ZINC000657898495 1119619346 /nfs/dbraw/zinc/61/93/46/1119619346.db2.gz PGMBUERTPWUSMR-HNNXBMFYSA-N 1 3 296.524 3.659 20 0 CHADHO CC1(C)[C@H]([NH2+]C2CCN(C3CCCC3)CC2)[C@@H]2CCC[C@@H]21 ZINC000657900657 1119620065 /nfs/dbraw/zinc/62/00/65/1119620065.db2.gz LNCCWQGMQKNAAD-FGTMMUONSA-N 1 3 290.495 3.808 20 0 CHADHO Cc1cc([C@@H](C)[NH2+]CCCN2CCCCC2)cs1 ZINC000381475056 1119698280 /nfs/dbraw/zinc/69/82/80/1119698280.db2.gz MELZNGZYSXZQBB-CQSZACIVSA-N 1 3 266.454 3.583 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2c(C)cc(C)cc2C)C[C@H]1C ZINC000531139902 1119793319 /nfs/dbraw/zinc/79/33/19/1119793319.db2.gz BQXAETJUODIXPL-QZTJIDSGSA-N 1 3 288.479 3.916 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2c(C)cc(C)cc2C)C[C@H]1C ZINC000531139902 1119793322 /nfs/dbraw/zinc/79/33/22/1119793322.db2.gz BQXAETJUODIXPL-QZTJIDSGSA-N 1 3 288.479 3.916 20 0 CHADHO CC[C@H]([NH2+]C1CCN(C2CCCCC2)CC1)[C@H]1C[C@@H]1C ZINC000414092838 1119895049 /nfs/dbraw/zinc/89/50/49/1119895049.db2.gz FJFUOKZEURGFMQ-WBAXXEDZSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@@H]1C[C@H](NC2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)CS1 ZINC000414230396 1119948623 /nfs/dbraw/zinc/94/86/23/1119948623.db2.gz NWFBFLABTJCDMK-JHNDHUHGSA-N 1 3 296.524 3.513 20 0 CHADHO CCc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)cc1 ZINC000624120221 1120056539 /nfs/dbraw/zinc/05/65/39/1120056539.db2.gz UOKPMHVXUIUPNQ-WBVHZDCISA-N 1 3 274.452 3.632 20 0 CHADHO C[C@@H](C[NH2+]C[C@@H]1CCCCN(C)C1)c1cccc(Cl)c1 ZINC000623657333 1120065351 /nfs/dbraw/zinc/06/53/51/1120065351.db2.gz NXGXUACVWBIDCO-GJZGRUSLSA-N 1 3 294.870 3.765 20 0 CHADHO CCC[C@H](C)[C@H](CC)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000624120915 1120068179 /nfs/dbraw/zinc/06/81/79/1120068179.db2.gz KAAZRAFTEMAVBA-JYJNAYRXSA-N 1 3 254.462 3.523 20 0 CHADHO CC(C)[C@@H]1C[C@H](N[C@H](C)C[C@@H](C)[NH3+])c2ccccc21 ZINC000629532219 1128914197 /nfs/dbraw/zinc/91/41/97/1128914197.db2.gz RMNTUERPGLUAFA-OMNBBPDLSA-N 1 3 260.425 3.586 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)[C@@H]1C[C@H]1c1cccs1)CN1CCCC1 ZINC000417309405 1120424884 /nfs/dbraw/zinc/42/48/84/1120424884.db2.gz GGOINQBWZWNPAX-FXUDXRNXSA-N 1 3 292.492 3.562 20 0 CHADHO c1ccc([C@H]2C[C@H]([NH2+][C@H]3CCNC[C@@H]3C3CCCC3)C2)cc1 ZINC000925604112 1120445339 /nfs/dbraw/zinc/44/53/39/1120445339.db2.gz HOCFQPMSIDEAIE-WTGUMLROSA-N 1 3 298.474 3.691 20 0 CHADHO C[NH+](C)CCCN[C@@H](Cc1ccccc1)c1ccccc1 ZINC000019959399 1120498248 /nfs/dbraw/zinc/49/82/48/1120498248.db2.gz KCPLBRXLWLXBGZ-IBGZPJMESA-N 1 3 282.431 3.512 20 0 CHADHO CC[C@H]1CCC[C@H](CN2CCC([NH2+]C(C)C)CC2)C1 ZINC000543393963 1120506543 /nfs/dbraw/zinc/50/65/43/1120506543.db2.gz DHRSIUZNLIPAAH-HOTGVXAUSA-N 1 3 266.473 3.665 20 0 CHADHO Cc1ccccc1[C@H](C)[NH2+]CCCN1CCCC[C@@H]1C ZINC000019913126 1120549482 /nfs/dbraw/zinc/54/94/82/1120549482.db2.gz DETXMEJAXMRPJH-IRXDYDNUSA-N 1 3 274.452 3.910 20 0 CHADHO C[N@H+](CCCN1CCCC1)Cc1cccc2ccccc21 ZINC000499912799 1120550113 /nfs/dbraw/zinc/55/01/13/1120550113.db2.gz LFZMRIUJJQAUFL-UHFFFAOYSA-N 1 3 282.431 3.758 20 0 CHADHO C[N@@H+](CCCN1CCCC1)Cc1cccc2ccccc21 ZINC000499912799 1120550117 /nfs/dbraw/zinc/55/01/17/1120550117.db2.gz LFZMRIUJJQAUFL-UHFFFAOYSA-N 1 3 282.431 3.758 20 0 CHADHO C[C@@H](C[NH2+][C@@H](Cc1ccccc1)c1ccccc1)CN(C)C ZINC000390708387 1120609099 /nfs/dbraw/zinc/60/90/99/1120609099.db2.gz GZZYEJWITHBSFQ-PXNSSMCTSA-N 1 3 296.458 3.758 20 0 CHADHO C[C@@H](CN[C@@H](Cc1ccccc1)c1ccccc1)C[NH+](C)C ZINC000390708387 1120609101 /nfs/dbraw/zinc/60/91/01/1120609101.db2.gz GZZYEJWITHBSFQ-PXNSSMCTSA-N 1 3 296.458 3.758 20 0 CHADHO CC[C@H](CN[C@@H](c1ccccc1)[C@H](C)[NH3+])CC(F)(F)F ZINC000925697427 1120622581 /nfs/dbraw/zinc/62/25/81/1120622581.db2.gz NLOWJSCFNRWVCD-SGMGOOAPSA-N 1 3 288.357 3.643 20 0 CHADHO CC(C)C[C@H](N[C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(F)cc1 ZINC000652154381 1120792360 /nfs/dbraw/zinc/79/23/60/1120792360.db2.gz DDHAOJHSKNJQGL-QGTPRVQTSA-N 1 3 292.442 3.985 20 0 CHADHO CC(C)C[C@H](N[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(F)cc1 ZINC000652154381 1120792362 /nfs/dbraw/zinc/79/23/62/1120792362.db2.gz DDHAOJHSKNJQGL-QGTPRVQTSA-N 1 3 292.442 3.985 20 0 CHADHO CCCSC[C@H](C)[NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000893487723 1120794606 /nfs/dbraw/zinc/79/46/06/1120794606.db2.gz LWGZRHBCSWEDQD-ARFHVFGLSA-N 1 3 298.540 3.761 20 0 CHADHO CC(C)CN1CCC([NH2+][C@@H](C)c2cccc(F)c2)CC1 ZINC000221689074 1120900305 /nfs/dbraw/zinc/90/03/05/1120900305.db2.gz UNMOVDWUATZIBP-AWEZNQCLSA-N 1 3 278.415 3.597 20 0 CHADHO CC(C)CN1CCC([NH2+][C@H](C)c2ccc(F)cc2)CC1 ZINC000221766024 1120903983 /nfs/dbraw/zinc/90/39/83/1120903983.db2.gz COIPWULODJFLQJ-CQSZACIVSA-N 1 3 278.415 3.597 20 0 CHADHO C[C@@H](N[C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000221818942 1120907886 /nfs/dbraw/zinc/90/78/86/1120907886.db2.gz HMAVMKMHARSIKG-KHYOSLBOSA-N 1 3 286.463 3.699 20 0 CHADHO C[C@@H](N[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000221818942 1120907887 /nfs/dbraw/zinc/90/78/87/1120907887.db2.gz HMAVMKMHARSIKG-KHYOSLBOSA-N 1 3 286.463 3.699 20 0 CHADHO c1ccc([C@H](NC[C@H]2CCC[N@H+](CC3CC3)C2)C2CC2)cc1 ZINC000663467683 1120983542 /nfs/dbraw/zinc/98/35/42/1120983542.db2.gz HCMWFCXJRLIGPC-XLIONFOSSA-N 1 3 298.474 3.849 20 0 CHADHO c1ccc([C@H](NC[C@H]2CCC[N@@H+](CC3CC3)C2)C2CC2)cc1 ZINC000663467683 1120983546 /nfs/dbraw/zinc/98/35/46/1120983546.db2.gz HCMWFCXJRLIGPC-XLIONFOSSA-N 1 3 298.474 3.849 20 0 CHADHO c1ccc([C@H]([NH2+]C[C@H]2CCCN(CC3CC3)C2)C2CC2)cc1 ZINC000663467683 1120983548 /nfs/dbraw/zinc/98/35/48/1120983548.db2.gz HCMWFCXJRLIGPC-XLIONFOSSA-N 1 3 298.474 3.849 20 0 CHADHO CC(C)(C[NH2+]C1CCN(C(C)(C)C)CC1)CC(F)(F)F ZINC000663479132 1120989324 /nfs/dbraw/zinc/98/93/24/1120989324.db2.gz NOFGETCDAVKZOS-UHFFFAOYSA-N 1 3 294.405 3.818 20 0 CHADHO CC(C)CC[C@@H]1CC[C@@H]([NH2+][C@H]2CCNC3(CCC3)C2)C1 ZINC000643548134 1121012127 /nfs/dbraw/zinc/01/21/27/1121012127.db2.gz MWTDKUGGECSQDJ-ZACQAIPSSA-N 1 3 278.484 3.856 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N1CCc2ccc(F)cc2C1 ZINC001167837494 1121041274 /nfs/dbraw/zinc/04/12/74/1121041274.db2.gz LMTWKGSEVZMNDK-OAHLLOKOSA-N 1 3 292.442 3.694 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N(C)Cc1ccc(F)cc1F ZINC001167840030 1121046574 /nfs/dbraw/zinc/04/65/74/1121046574.db2.gz DIHQGSSQOWQMDP-CQSZACIVSA-N 1 3 298.421 3.907 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](CC2CCC2)c2ccccc2)C1 ZINC000344035137 1121062001 /nfs/dbraw/zinc/06/20/01/1121062001.db2.gz PYQHZNZKUQRKSI-MJGOQNOKSA-N 1 3 286.463 3.849 20 0 CHADHO c1ccc([C@H](CC2CCC2)NCCC[NH+]2CCCC2)cc1 ZINC000344088162 1121077176 /nfs/dbraw/zinc/07/71/76/1121077176.db2.gz NSOCWGRFYFQFRE-IBGZPJMESA-N 1 3 286.463 3.993 20 0 CHADHO c1ccc([C@H](CC2CCC2)[NH2+]CCCN2CCCC2)cc1 ZINC000344088162 1121077183 /nfs/dbraw/zinc/07/71/83/1121077183.db2.gz NSOCWGRFYFQFRE-IBGZPJMESA-N 1 3 286.463 3.993 20 0 CHADHO Cc1oc2ccccc2c1CCN[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000344134127 1121098308 /nfs/dbraw/zinc/09/83/08/1121098308.db2.gz OUCLHONSGGSAJC-HZPDHXFCSA-N 1 3 298.430 3.500 20 0 CHADHO Cc1oc2ccccc2c1CCN[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000344134127 1121098316 /nfs/dbraw/zinc/09/83/16/1121098316.db2.gz OUCLHONSGGSAJC-HZPDHXFCSA-N 1 3 298.430 3.500 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCCc3ccccc32)C1 ZINC000344199039 1121117928 /nfs/dbraw/zinc/11/79/28/1121117928.db2.gz LMGXSYIHJNAOJE-JZXOWHBKSA-N 1 3 272.436 3.526 20 0 CHADHO c1ccc(C[N@@H+]2CC[C@]3(CCN([C@@H]4C=CCCC4)C3)C2)cc1 ZINC000512245951 1121224218 /nfs/dbraw/zinc/22/42/18/1121224218.db2.gz UDSZPGWSHSKQRB-UXHICEINSA-N 1 3 296.458 3.693 20 0 CHADHO c1ccc(C[N@H+]2CC[C@]3(CCN([C@@H]4C=CCCC4)C3)C2)cc1 ZINC000512245951 1121224223 /nfs/dbraw/zinc/22/42/23/1121224223.db2.gz UDSZPGWSHSKQRB-UXHICEINSA-N 1 3 296.458 3.693 20 0 CHADHO [NH3+][C@@H]1C[C@H](N[C@@H]2CCSC3(CCC3)C2)c2ccccc21 ZINC000925857788 1121293675 /nfs/dbraw/zinc/29/36/75/1121293675.db2.gz IOSDUSWETHWPNJ-WQVCFCJDSA-N 1 3 288.460 3.539 20 0 CHADHO CC[C@@H](c1ccc(F)cc1)[N@@H+]1CCC[C@@]2(CCN(C)C2)C1 ZINC000660658603 1121359394 /nfs/dbraw/zinc/35/93/94/1121359394.db2.gz HUGWAQJHTTVYIF-ROUUACIJSA-N 1 3 290.426 3.695 20 0 CHADHO CC[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@@]2(CCN(C)C2)C1 ZINC000660658603 1121359405 /nfs/dbraw/zinc/35/94/05/1121359405.db2.gz HUGWAQJHTTVYIF-ROUUACIJSA-N 1 3 290.426 3.695 20 0 CHADHO CSCC[C@H](C)[NH2+]C1CCN(C[C@@H]2CC=CCC2)CC1 ZINC001258213049 1128983518 /nfs/dbraw/zinc/98/35/18/1128983518.db2.gz NCNOLPZMCZODGZ-JKSUJKDBSA-N 1 3 296.524 3.538 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21)C1CC1 ZINC000512615255 1121493914 /nfs/dbraw/zinc/49/39/14/1121493914.db2.gz YWUKVMIOUHKGTD-KCUHQSDYSA-N 1 3 298.474 3.675 20 0 CHADHO CCN1CC[C@@H](C[NH2+]CC[C@@H](C)CCC=C(C)C)C1 ZINC000512844341 1121622608 /nfs/dbraw/zinc/62/26/08/1121622608.db2.gz HHHLLOMNYVCMRX-IRXDYDNUSA-N 1 3 266.473 3.690 20 0 CHADHO CC[N@@H+]1CC[C@@H](CNC/C(C)=C\c2ccc(Cl)cc2)C1 ZINC000513030688 1121665661 /nfs/dbraw/zinc/66/56/61/1121665661.db2.gz IFXJXDXWNBLWOA-DNXIFWLFSA-N 1 3 292.854 3.675 20 0 CHADHO CC[N@H+]1CC[C@@H](CNC/C(C)=C\c2ccc(Cl)cc2)C1 ZINC000513030688 1121665665 /nfs/dbraw/zinc/66/56/65/1121665665.db2.gz IFXJXDXWNBLWOA-DNXIFWLFSA-N 1 3 292.854 3.675 20 0 CHADHO Cc1cc(C)c(/C=C/CNC[C@H]2CCC[N@@H+](C)C2)c(C)c1 ZINC001177795140 1121750891 /nfs/dbraw/zinc/75/08/91/1121750891.db2.gz OJEMHLGXXCDQPU-KRZKXXONSA-N 1 3 286.463 3.556 20 0 CHADHO Cc1cc(C)c(/C=C/CNC[C@H]2CCC[N@H+](C)C2)c(C)c1 ZINC001177795140 1121750897 /nfs/dbraw/zinc/75/08/97/1121750897.db2.gz OJEMHLGXXCDQPU-KRZKXXONSA-N 1 3 286.463 3.556 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@@H+]1CCC[C@@](C)(N)C1 ZINC001204939039 1121756283 /nfs/dbraw/zinc/75/62/83/1121756283.db2.gz PENPFZSAISFXLM-HZPDHXFCSA-N 1 3 252.446 3.572 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@H+]1CCC[C@@](C)(N)C1 ZINC001204939039 1121756290 /nfs/dbraw/zinc/75/62/90/1121756290.db2.gz PENPFZSAISFXLM-HZPDHXFCSA-N 1 3 252.446 3.572 20 0 CHADHO CCCCN1CCC([NH2+]Cc2ccc3cnccc3c2)CC1 ZINC000168626306 1121771955 /nfs/dbraw/zinc/77/19/55/1121771955.db2.gz VZXDWGCZACGEGK-UHFFFAOYSA-N 1 3 297.446 3.589 20 0 CHADHO CC[C@@H](c1ccccc1)N1C[C@@H](c2ccccc2)[C@H]([NH3+])C1 ZINC000261886441 1129008625 /nfs/dbraw/zinc/00/86/25/1129008625.db2.gz ZCQKKPXKQGUOBG-OTWHNJEPSA-N 1 3 280.415 3.564 20 0 CHADHO c1cc(CNCCC[NH+]2CCC2)cc(C2CCCC2)c1 ZINC001178397879 1121783021 /nfs/dbraw/zinc/78/30/21/1121783021.db2.gz HBLKXVYOFNDQHM-UHFFFAOYSA-N 1 3 272.436 3.530 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN(C[C@@H](C)c2ccc(C)cc2)C1 ZINC001179855702 1121917225 /nfs/dbraw/zinc/91/72/25/1121917225.db2.gz ZXNCDWKHERAEGS-QZTJIDSGSA-N 1 3 288.479 3.762 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN(C[C@@H](C)c2ccc(C)cc2)C1 ZINC001179855702 1121917232 /nfs/dbraw/zinc/91/72/32/1121917232.db2.gz ZXNCDWKHERAEGS-QZTJIDSGSA-N 1 3 288.479 3.762 20 0 CHADHO CC(C)(C)[C@H](NCCC[NH3+])c1cccc(C(F)(F)F)c1 ZINC000420419808 1122005979 /nfs/dbraw/zinc/00/59/79/1122005979.db2.gz XUCWUDUZTPISIA-CYBMUJFWSA-N 1 3 288.357 3.731 20 0 CHADHO CC(C)[C@@H]1CCC[C@H]1[NH2+]CC[C@H](C)N1CCCCC1 ZINC001180811143 1122017817 /nfs/dbraw/zinc/01/78/17/1122017817.db2.gz QSBGYEYTBSIGLC-YESZJQIVSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@@H]1CC[C@H](C)[C@@H]([NH2+]C[C@@H]2CCCN(CC3CC3)C2)C1 ZINC001183093439 1122205914 /nfs/dbraw/zinc/20/59/14/1122205914.db2.gz BQEAZAXEKJYOIP-FZCLSBEQSA-N 1 3 278.484 3.523 20 0 CHADHO CC(C)c1cccc(C[N@H+](C)CC(C)(C)CN(C)C)c1 ZINC001184197345 1122259462 /nfs/dbraw/zinc/25/94/62/1122259462.db2.gz NJQGMQMTZLDPRS-UHFFFAOYSA-N 1 3 276.468 3.830 20 0 CHADHO CC(C)c1cccc(C[N@@H+](C)CC(C)(C)CN(C)C)c1 ZINC001184197345 1122259465 /nfs/dbraw/zinc/25/94/65/1122259465.db2.gz NJQGMQMTZLDPRS-UHFFFAOYSA-N 1 3 276.468 3.830 20 0 CHADHO CCN(CC)Cc1cc([C@@H](C)[NH2+]CCCF)ccc1OC ZINC000183350114 1129047503 /nfs/dbraw/zinc/04/75/03/1129047503.db2.gz MOFVXKXBXHCGGC-CQSZACIVSA-N 1 3 296.430 3.547 20 0 CHADHO CC(C)[C@@H](c1ccc(F)cc1)N(C)CC[C@H]1CCC[N@@H+]1C ZINC000434623339 1122385994 /nfs/dbraw/zinc/38/59/94/1122385994.db2.gz LCEXWPIAPJFCIX-MSOLQXFVSA-N 1 3 292.442 3.939 20 0 CHADHO CC(C)[C@@H](c1ccc(F)cc1)N(C)CC[C@H]1CCC[N@H+]1C ZINC000434623339 1122386000 /nfs/dbraw/zinc/38/60/00/1122386000.db2.gz LCEXWPIAPJFCIX-MSOLQXFVSA-N 1 3 292.442 3.939 20 0 CHADHO CN(Cc1ccco1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001203285313 1122507981 /nfs/dbraw/zinc/50/79/81/1122507981.db2.gz GKGJMLDLIDZKOM-UHFFFAOYSA-N 1 3 298.430 3.624 20 0 CHADHO CCN(CC)Cc1cc([C@@H](C)[NH2+]C2CCC2)ccc1OC ZINC000775407205 1122551003 /nfs/dbraw/zinc/55/10/03/1122551003.db2.gz NGFXLECZZBIIDE-CQSZACIVSA-N 1 3 290.451 3.740 20 0 CHADHO CC(C)CN1CCC[C@@H](C[NH2+][C@@H]2CCC(C)(C)C2)C1 ZINC000516038658 1122564022 /nfs/dbraw/zinc/56/40/22/1122564022.db2.gz WVUHWDXTIGIHKM-JKSUJKDBSA-N 1 3 266.473 3.523 20 0 CHADHO Cc1cc2c(cc1C)[C@@H]([NH2+]C[C@H](C)CN(C)C)CCS2 ZINC000425913628 1122658522 /nfs/dbraw/zinc/65/85/22/1122658522.db2.gz AGVXCDXHUWZQNI-LRDDRELGSA-N 1 3 292.492 3.628 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H](C)C(C)(C)c1ccccc1 ZINC001192901299 1122660816 /nfs/dbraw/zinc/66/08/16/1122660816.db2.gz JRAGBMWWSOFGBH-INIZCTEOSA-N 1 3 276.468 3.674 20 0 CHADHO Cc1ccccc1C1CC[NH+](CCCN2CCCC2)CC1 ZINC000153612544 1129072699 /nfs/dbraw/zinc/07/26/99/1129072699.db2.gz NGURYMWRHYMJQV-UHFFFAOYSA-N 1 3 286.463 3.660 20 0 CHADHO c1ccc([C@@H]2C[C@@H]2NC2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167965813 1122817445 /nfs/dbraw/zinc/81/74/45/1122817445.db2.gz NGDNLINFNQUUOQ-HLKUOHOZSA-N 1 3 296.458 3.538 20 0 CHADHO c1ccc([C@@H]2C[C@@H]2NC2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167965813 1122817448 /nfs/dbraw/zinc/81/74/48/1122817448.db2.gz NGDNLINFNQUUOQ-HLKUOHOZSA-N 1 3 296.458 3.538 20 0 CHADHO CCC[C@@H](C)N1CCC(CC)([NH+]2CCCC2)CC1 ZINC001196727830 1122931206 /nfs/dbraw/zinc/93/12/06/1122931206.db2.gz LMBBMMVEUHGSIP-OAHLLOKOSA-N 1 3 252.446 3.515 20 0 CHADHO Cc1cccc([C@@H]([NH2+]CC[C@H]2CCCN2C)C(C)C)c1 ZINC001196781363 1122934560 /nfs/dbraw/zinc/93/45/60/1122934560.db2.gz ACNYZZOUBNKQSP-MSOLQXFVSA-N 1 3 274.452 3.766 20 0 CHADHO Cc1cccc([C@@H](NCC[C@H]2CCC[N@@H+]2C)C(C)C)c1 ZINC001196781363 1122934561 /nfs/dbraw/zinc/93/45/61/1122934561.db2.gz ACNYZZOUBNKQSP-MSOLQXFVSA-N 1 3 274.452 3.766 20 0 CHADHO Cc1cccc([C@@H](NCC[C@H]2CCC[N@H+]2C)C(C)C)c1 ZINC001196781363 1122934563 /nfs/dbraw/zinc/93/45/63/1122934563.db2.gz ACNYZZOUBNKQSP-MSOLQXFVSA-N 1 3 274.452 3.766 20 0 CHADHO Cc1cccc(C[N@H+]2CCCC[C@H]2C[C@@H]2CCCN2C)c1 ZINC001203894985 1122982018 /nfs/dbraw/zinc/98/20/18/1122982018.db2.gz PQCRGYIDHIAEGL-OALUTQOASA-N 1 3 286.463 3.834 20 0 CHADHO Cc1cccc(C[N@@H+]2CCCC[C@H]2C[C@@H]2CCCN2C)c1 ZINC001203894985 1122982021 /nfs/dbraw/zinc/98/20/21/1122982021.db2.gz PQCRGYIDHIAEGL-OALUTQOASA-N 1 3 286.463 3.834 20 0 CHADHO Cc1cccc(CN2CCCC[C@H]2C[C@@H]2CCC[N@H+]2C)c1 ZINC001203894985 1122982025 /nfs/dbraw/zinc/98/20/25/1122982025.db2.gz PQCRGYIDHIAEGL-OALUTQOASA-N 1 3 286.463 3.834 20 0 CHADHO Cc1cccc(CN2CCCC[C@H]2C[C@@H]2CCC[N@@H+]2C)c1 ZINC001203894985 1122982028 /nfs/dbraw/zinc/98/20/28/1122982028.db2.gz PQCRGYIDHIAEGL-OALUTQOASA-N 1 3 286.463 3.834 20 0 CHADHO Cc1cc(Cl)cc(CN2CCC(CC[NH+](C)C)CC2)c1 ZINC000507721851 1122992504 /nfs/dbraw/zinc/99/25/04/1122992504.db2.gz BOJJEXGTDNOKQJ-UHFFFAOYSA-N 1 3 294.870 3.812 20 0 CHADHO CCCN1CCC([NH2+]Cc2c(C)cc(Cl)cc2C)CC1 ZINC001199021858 1123017639 /nfs/dbraw/zinc/01/76/39/1123017639.db2.gz OGANZUKBUKGMGS-UHFFFAOYSA-N 1 3 294.870 3.921 20 0 CHADHO CC[C@H](F)CN1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000440774567 1123037094 /nfs/dbraw/zinc/03/70/94/1123037094.db2.gz YFQFIKQKPJULGO-WBVHZDCISA-N 1 3 284.463 3.711 20 0 CHADHO CC[C@H](F)CN1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000440774567 1123037098 /nfs/dbraw/zinc/03/70/98/1123037098.db2.gz YFQFIKQKPJULGO-WBVHZDCISA-N 1 3 284.463 3.711 20 0 CHADHO C[C@@H]1[C@H](CN)CCC[N@@H+]1C[C@H]1C[C@H]1c1ccc(Cl)cc1 ZINC001205901714 1123059894 /nfs/dbraw/zinc/05/98/94/1123059894.db2.gz FNHRYOPWCDGUAO-JWDQPFGJSA-N 1 3 292.854 3.503 20 0 CHADHO C[C@@H]1[C@H](CN)CCC[N@H+]1C[C@H]1C[C@H]1c1ccc(Cl)cc1 ZINC001205901714 1123059897 /nfs/dbraw/zinc/05/98/97/1123059897.db2.gz FNHRYOPWCDGUAO-JWDQPFGJSA-N 1 3 292.854 3.503 20 0 CHADHO Cc1cc(N2CCN(CC(C)(C)C)CC2)c2ccccc2[nH+]1 ZINC001201432480 1123100630 /nfs/dbraw/zinc/10/06/30/1123100630.db2.gz BZBNPIKSYCJFBV-UHFFFAOYSA-N 1 3 297.446 3.711 20 0 CHADHO C[C@H]1CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)[C@H]1C ZINC001167995454 1123107131 /nfs/dbraw/zinc/10/71/31/1123107131.db2.gz GGICYWNGBWVFPM-KSTANIPCSA-N 1 3 276.468 3.512 20 0 CHADHO C[C@H]1CCC[N@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)[C@H]1C ZINC001167995454 1123107134 /nfs/dbraw/zinc/10/71/34/1123107134.db2.gz GGICYWNGBWVFPM-KSTANIPCSA-N 1 3 276.468 3.512 20 0 CHADHO CC(C)[C@@H]1CCC[N@@H+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001168002941 1123173037 /nfs/dbraw/zinc/17/30/37/1123173037.db2.gz FQYMELZDJIWXPV-WFFDWFOESA-N 1 3 276.468 3.512 20 0 CHADHO CC(C)[C@@H]1CCC[N@H+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001168002941 1123173040 /nfs/dbraw/zinc/17/30/40/1123173040.db2.gz FQYMELZDJIWXPV-WFFDWFOESA-N 1 3 276.468 3.512 20 0 CHADHO CC[C@@H](c1ccc(F)cc1F)[N@H+](C)C[C@@H]1CCCN(C)C1 ZINC000152362676 1123183225 /nfs/dbraw/zinc/18/32/25/1123183225.db2.gz GRATUCOPKOSWEC-DYVFJYSZSA-N 1 3 296.405 3.690 20 0 CHADHO CC[C@@H](c1ccc(F)cc1F)[N@@H+](C)C[C@@H]1CCCN(C)C1 ZINC000152362676 1123183227 /nfs/dbraw/zinc/18/32/27/1123183227.db2.gz GRATUCOPKOSWEC-DYVFJYSZSA-N 1 3 296.405 3.690 20 0 CHADHO CC(C)[C@H](Cc1ccccc1)[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000427695297 1123242111 /nfs/dbraw/zinc/24/21/11/1123242111.db2.gz LSHIHNONSAEYOE-QRVBRYPASA-N 1 3 288.479 3.716 20 0 CHADHO CCSc1ccccc1[C@H](C)[NH2+]C[C@@H]1CCN(CC)C1 ZINC000163250541 1129109298 /nfs/dbraw/zinc/10/92/98/1129109298.db2.gz AWYOBQLHXUPCPR-GJZGRUSLSA-N 1 3 292.492 3.791 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@@H](C)c1cc2ccccc2s1 ZINC000665281969 1123313340 /nfs/dbraw/zinc/31/33/40/1123313340.db2.gz NOTXFVQQWCTDHG-GXTWGEPZSA-N 1 3 276.449 3.925 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@H](C)c1cccc(-c2ccncc2)c1 ZINC000665280520 1123313976 /nfs/dbraw/zinc/31/39/76/1123313976.db2.gz FCQCOKOGISWHEY-DNVCBOLYSA-N 1 3 297.446 3.773 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@@H]1CC[C@H](C)c2ccsc21 ZINC000665282499 1123316339 /nfs/dbraw/zinc/31/63/39/1123316339.db2.gz ZGMIYHLZATYXSK-IACUBPJLSA-N 1 3 266.454 3.650 20 0 CHADHO C[C@H]1CCC[C@H]1C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000467442418 1123318988 /nfs/dbraw/zinc/31/89/88/1123318988.db2.gz FULAOZYQGASBBT-HOTGVXAUSA-N 1 3 278.484 3.809 20 0 CHADHO CCC[C@H](N[C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccsc1 ZINC000443086644 1123355162 /nfs/dbraw/zinc/35/51/62/1123355162.db2.gz NJUWAAKHODYPFQ-CFVMTHIKSA-N 1 3 266.454 3.662 20 0 CHADHO CCC[C@H](N[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccsc1 ZINC000443086644 1123355165 /nfs/dbraw/zinc/35/51/65/1123355165.db2.gz NJUWAAKHODYPFQ-CFVMTHIKSA-N 1 3 266.454 3.662 20 0 CHADHO C[C@@H](CC(C)(C)C)[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000853240247 1123429309 /nfs/dbraw/zinc/42/93/09/1123429309.db2.gz NRODDDNKPPFWHZ-GOEBONIOSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)CSCCCN1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000443608274 1123443816 /nfs/dbraw/zinc/44/38/16/1123443816.db2.gz YHPBHOZTOJKYLH-QGZVFWFLSA-N 1 3 298.540 3.574 20 0 CHADHO CC(C)C[C@@H](C[N@@H+]1C[C@@H]2CCCN[C@@H]2C1)c1ccccc1 ZINC000474272477 1123498937 /nfs/dbraw/zinc/49/89/37/1123498937.db2.gz HATIKHGGGUCRBA-GBESFXJTSA-N 1 3 286.463 3.500 20 0 CHADHO CC(C)C[C@@H](C[N@H+]1C[C@@H]2CCCN[C@@H]2C1)c1ccccc1 ZINC000474272477 1123498938 /nfs/dbraw/zinc/49/89/38/1123498938.db2.gz HATIKHGGGUCRBA-GBESFXJTSA-N 1 3 286.463 3.500 20 0 CHADHO CC/C=C\CCCCCCN1CCC[C@@H](C[NH2+]C)C1 ZINC001205008407 1123636815 /nfs/dbraw/zinc/63/68/15/1123636815.db2.gz AAKMUHATMXUVFR-CHYADLBTSA-N 1 3 266.473 3.835 20 0 CHADHO CC(C)c1ccccc1C[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000858245844 1123639335 /nfs/dbraw/zinc/63/93/35/1123639335.db2.gz PPOKOHVDSJURPC-INIZCTEOSA-N 1 3 274.452 3.632 20 0 CHADHO C[C@]1(N)CC[N@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001204782675 1123813352 /nfs/dbraw/zinc/81/33/52/1123813352.db2.gz IJWAXLFEFDOYEN-SFHVURJKSA-N 1 3 296.439 3.978 20 0 CHADHO C[C@]1(N)CC[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001204782675 1123813355 /nfs/dbraw/zinc/81/33/55/1123813355.db2.gz IJWAXLFEFDOYEN-SFHVURJKSA-N 1 3 296.439 3.978 20 0 CHADHO CCc1ccccc1CCN(C)[C@H]1CC[N@@H+](CC)[C@H](C)C1 ZINC000444647399 1124047753 /nfs/dbraw/zinc/04/77/53/1124047753.db2.gz FBIIKHMWDUPKJU-APWZRJJASA-N 1 3 288.479 3.596 20 0 CHADHO CCc1ccccc1CCN(C)[C@H]1CC[N@H+](CC)[C@H](C)C1 ZINC000444647399 1124047756 /nfs/dbraw/zinc/04/77/56/1124047756.db2.gz FBIIKHMWDUPKJU-APWZRJJASA-N 1 3 288.479 3.596 20 0 CHADHO Cc1ccccc1-c1cccc(CNC2CC[NH+](C)CC2)c1 ZINC000525180811 1124117231 /nfs/dbraw/zinc/11/72/31/1124117231.db2.gz OXCYFLJNTGILHI-UHFFFAOYSA-N 1 3 294.442 3.846 20 0 CHADHO CC[C@@H](N[C@H]1CC[NH2+]CC(C)(C)C1)c1cccs1 ZINC000635008994 1129169972 /nfs/dbraw/zinc/16/99/72/1129169972.db2.gz FTLIYPKDGXRCJR-QWHCGFSZSA-N 1 3 266.454 3.567 20 0 CHADHO CCC[C@@H]([NH2+]C[C@@H]1CCCN(CC)C1)c1cc(C)ccn1 ZINC001118991241 1131244872 /nfs/dbraw/zinc/24/48/72/1131244872.db2.gz JPCVFGAOJBWKMY-DLBZAZTESA-N 1 3 289.467 3.553 20 0 CHADHO CC(C)[C@@H]1C[C@@H](NC[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc21 ZINC000447536963 1124484356 /nfs/dbraw/zinc/48/43/56/1124484356.db2.gz ROSSZUNULRCPHG-RYGJVYDSSA-N 1 3 298.474 3.945 20 0 CHADHO CC(C)[C@@H]1C[C@@H](NC[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc21 ZINC000447536963 1124484358 /nfs/dbraw/zinc/48/43/58/1124484358.db2.gz ROSSZUNULRCPHG-RYGJVYDSSA-N 1 3 298.474 3.945 20 0 CHADHO Cc1ccc(CN2CCC(CC[NH+](C)C)CC2)cc1Cl ZINC000447734980 1124518312 /nfs/dbraw/zinc/51/83/12/1124518312.db2.gz AUKSQMPTDIDGSX-UHFFFAOYSA-N 1 3 294.870 3.812 20 0 CHADHO CCN1CCC[C@H](C[NH2+]CC[C@@H](C)c2ccccc2)C1 ZINC000447820969 1124527379 /nfs/dbraw/zinc/52/73/79/1124527379.db2.gz IUUAGFILIKDIEB-IAGOWNOFSA-N 1 3 274.452 3.502 20 0 CHADHO C[NH+]1CCC(N[C@@H]2CC(C)(C)Sc3ccccc32)CC1 ZINC000872018114 1124656560 /nfs/dbraw/zinc/65/65/60/1124656560.db2.gz INUBFINFIYUDCU-OAHLLOKOSA-N 1 3 290.476 3.686 20 0 CHADHO CC(C)(C)CC(C)(C)[NH+]1CCC(N[C@@H]2CCSC2)CC1 ZINC000449178526 1124661643 /nfs/dbraw/zinc/66/16/43/1124661643.db2.gz XNAUMSPSRXYZOJ-OAHLLOKOSA-N 1 3 298.540 3.761 20 0 CHADHO CC[C@H](CCC(F)(F)F)[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000872041584 1124664445 /nfs/dbraw/zinc/66/44/45/1124664445.db2.gz UPYOHMHIBMQPIZ-JHJVBQTASA-N 1 3 280.378 3.570 20 0 CHADHO CC[C@H]([NH2+]C[C@H]1CCCN(CC(C)C)C1)C1CCC1 ZINC000449212463 1124670784 /nfs/dbraw/zinc/67/07/84/1124670784.db2.gz SQJPIBFIPBLMTE-WBVHZDCISA-N 1 3 266.473 3.523 20 0 CHADHO COc1ccc(CN[C@@H](C)c2cccc(C[NH+](C)C)c2)cc1 ZINC000820805575 1131302808 /nfs/dbraw/zinc/30/28/08/1131302808.db2.gz NGBBQPPMDHCPSQ-HNNXBMFYSA-N 1 3 298.430 3.608 20 0 CHADHO CCC[C@H](C)CC[C@H](C)NC[C@]1(C(F)(F)F)CC[NH2+]C1 ZINC001246111160 1131328357 /nfs/dbraw/zinc/32/83/57/1131328357.db2.gz KQZCKGNZIAUBPO-IHRRRGAJSA-N 1 3 294.405 3.723 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2c(C)cccc2C)C[C@@H]1C ZINC000530663047 1125170650 /nfs/dbraw/zinc/17/06/50/1125170650.db2.gz CLUQXIPNNIGNLN-DLBZAZTESA-N 1 3 274.452 3.608 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2c(C)cccc2C)C[C@@H]1C ZINC000530663047 1125170655 /nfs/dbraw/zinc/17/06/55/1125170655.db2.gz CLUQXIPNNIGNLN-DLBZAZTESA-N 1 3 274.452 3.608 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1)CN1CCCCC1 ZINC000251554267 1125196776 /nfs/dbraw/zinc/19/67/76/1125196776.db2.gz BCUSXYCZYGAUMO-QBPKDAKJSA-N 1 3 266.473 3.523 20 0 CHADHO CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2Cc1ccc2ccccc2c1 ZINC000531201856 1125200205 /nfs/dbraw/zinc/20/02/05/1125200205.db2.gz QDQLFLMDCGPRLK-UXHICEINSA-N 1 3 294.442 3.898 20 0 CHADHO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2Cc1ccc2ccccc2c1 ZINC000531201856 1125200208 /nfs/dbraw/zinc/20/02/08/1125200208.db2.gz QDQLFLMDCGPRLK-UXHICEINSA-N 1 3 294.442 3.898 20 0 CHADHO Cc1ccc(-c2ccccc2CN2CCC([NH3+])CC2)cc1 ZINC001239481972 1131339447 /nfs/dbraw/zinc/33/94/47/1131339447.db2.gz XRUIZUPKOBYVNW-UHFFFAOYSA-N 1 3 280.415 3.585 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC[C@H]2CCCC2(F)F)CC1 ZINC000883273365 1125390712 /nfs/dbraw/zinc/39/07/12/1125390712.db2.gz JWMWCELIZCYLBR-CYBMUJFWSA-N 1 3 288.426 3.664 20 0 CHADHO Cc1cccc([C@@H]2CCCN2CC[C@H]2CCCC[NH2+]2)c1 ZINC001204849220 1125432177 /nfs/dbraw/zinc/43/21/77/1125432177.db2.gz ZAXJDYUCZQGDQI-MSOLQXFVSA-N 1 3 272.436 3.664 20 0 CHADHO CCc1oc2ccccc2c1C[NH2+]C1C[C@H]2CC[C@@H](C1)N2C ZINC000294978437 1129217485 /nfs/dbraw/zinc/21/74/85/1129217485.db2.gz JQCVRZJMKHLFKG-GOOCMWNKSA-N 1 3 298.430 3.710 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2cccc3ncccc23)C[C@@H]1C ZINC000638111125 1129243458 /nfs/dbraw/zinc/24/34/58/1129243458.db2.gz RIYXVLOEGZHUDD-RDJZCZTQSA-N 1 3 297.446 3.539 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2cccc3ncccc23)C[C@@H]1C ZINC000638111125 1129243461 /nfs/dbraw/zinc/24/34/61/1129243461.db2.gz RIYXVLOEGZHUDD-RDJZCZTQSA-N 1 3 297.446 3.539 20 0 CHADHO C[C@H]([NH2+]C(C)(C)CN[C@@H](C)[C@H]1CC1(F)F)c1ccccc1 ZINC000638602032 1129263141 /nfs/dbraw/zinc/26/31/41/1129263141.db2.gz RHUUALXEPORNPT-KCQAQPDRSA-N 1 3 296.405 3.749 20 0 CHADHO C/C=C\CN[C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000639353622 1129305002 /nfs/dbraw/zinc/30/50/02/1129305002.db2.gz VNCJJDTZPABANW-HMDTVDTHSA-N 1 3 270.420 3.520 20 0 CHADHO C/C=C\CN[C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000639353622 1129305007 /nfs/dbraw/zinc/30/50/07/1129305007.db2.gz VNCJJDTZPABANW-HMDTVDTHSA-N 1 3 270.420 3.520 20 0 CHADHO C/C=C\CN[C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000639353623 1129305724 /nfs/dbraw/zinc/30/57/24/1129305724.db2.gz VNCJJDTZPABANW-IFEGVLKZSA-N 1 3 270.420 3.520 20 0 CHADHO C/C=C\CN[C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000639353623 1129305730 /nfs/dbraw/zinc/30/57/30/1129305730.db2.gz VNCJJDTZPABANW-IFEGVLKZSA-N 1 3 270.420 3.520 20 0 CHADHO CCCC[C@@H]1C[C@H]([NH2+]C2CCC(CC)CC2)CCN1 ZINC001246169234 1131370927 /nfs/dbraw/zinc/37/09/27/1131370927.db2.gz BTJYNGUIOYQLFC-BHUNQDJPSA-N 1 3 266.473 3.856 20 0 CHADHO [NH3+][C@@H]1C[C@H](NCCCCc2ccccc2)c2ccccc21 ZINC000643458338 1129442098 /nfs/dbraw/zinc/44/20/98/1129442098.db2.gz NTTUMECJVJFHQK-MOPGFXCFSA-N 1 3 280.415 3.744 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3N[C@H]1CCC[NH2+]CC1 ZINC000643522909 1129443829 /nfs/dbraw/zinc/44/38/29/1129443829.db2.gz URIJDFXOEPYHTI-KBXCAEBGSA-N 1 3 297.446 3.585 20 0 CHADHO C1CC2(C1)C[C@@H]([NH2+][C@@H]1CCCCC13CCCC3)CCN2 ZINC000643548154 1129445110 /nfs/dbraw/zinc/44/51/10/1129445110.db2.gz NCKVPRSXRYERRZ-JKSUJKDBSA-N 1 3 276.468 3.754 20 0 CHADHO CCCC1CCC([NH+]2C[C@@H]3CN(CCC)C[C@H]3C2)CC1 ZINC001258534668 1129449805 /nfs/dbraw/zinc/44/98/05/1129449805.db2.gz NKZHSRBJLMBXNZ-SAGYGOJTSA-N 1 3 278.484 3.619 20 0 CHADHO CN(CC1=CCCC1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000645810838 1129507521 /nfs/dbraw/zinc/50/75/21/1129507521.db2.gz AWSJZRISWPYRGQ-IBGZPJMESA-N 1 3 284.447 3.551 20 0 CHADHO CN(CC1=CCCC1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000645810838 1129507522 /nfs/dbraw/zinc/50/75/22/1129507522.db2.gz AWSJZRISWPYRGQ-IBGZPJMESA-N 1 3 284.447 3.551 20 0 CHADHO CN1CCC[C@H]1CC[N@@H+]1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC000646117955 1129524031 /nfs/dbraw/zinc/52/40/31/1129524031.db2.gz BUEOROLNWVHFFY-RBUKOAKNSA-N 1 3 296.458 3.864 20 0 CHADHO CN1CCC[C@H]1CC[N@H+]1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC000646117955 1129524034 /nfs/dbraw/zinc/52/40/34/1129524034.db2.gz BUEOROLNWVHFFY-RBUKOAKNSA-N 1 3 296.458 3.864 20 0 CHADHO CC(C)C[C@H](Cc1ccccc1)[NH2+]CCCN1CCCC1 ZINC001169049965 1129692013 /nfs/dbraw/zinc/69/20/13/1129692013.db2.gz MQPKBKLGFNEPLZ-LJQANCHMSA-N 1 3 288.479 3.719 20 0 CHADHO CC(C)[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001169100725 1129697777 /nfs/dbraw/zinc/69/77/77/1129697777.db2.gz MAMULAUWASPGRH-FJIDUMEYSA-N 1 3 290.426 3.738 20 0 CHADHO CC(C)[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001169100725 1129697779 /nfs/dbraw/zinc/69/77/79/1129697779.db2.gz MAMULAUWASPGRH-FJIDUMEYSA-N 1 3 290.426 3.738 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](N[C@H](CC1CC1)c1ccccc1)C2 ZINC001169116322 1129699985 /nfs/dbraw/zinc/69/99/85/1129699985.db2.gz PXQNNQZVWLOROW-FCGDIQPGSA-N 1 3 284.447 3.743 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](N[C@H](CC1CC1)c1ccccc1)C2 ZINC001169116322 1129699987 /nfs/dbraw/zinc/69/99/87/1129699987.db2.gz PXQNNQZVWLOROW-FCGDIQPGSA-N 1 3 284.447 3.743 20 0 CHADHO CN1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1csc3ccccc13)C2 ZINC001169106869 1129703738 /nfs/dbraw/zinc/70/37/38/1129703738.db2.gz APPMBXBTRHFCBA-QDMKHBRRSA-N 1 3 286.444 3.616 20 0 CHADHO C[C@@H](c1ccc(Cl)cc1)N(C)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169147160 1129704560 /nfs/dbraw/zinc/70/45/60/1129704560.db2.gz SWPRZCMKHLBVHJ-KKBVYLPWSA-N 1 3 292.854 3.958 20 0 CHADHO C[C@@H](c1ccc(Cl)cc1)N(C)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169147160 1129704562 /nfs/dbraw/zinc/70/45/62/1129704562.db2.gz SWPRZCMKHLBVHJ-KKBVYLPWSA-N 1 3 292.854 3.958 20 0 CHADHO CC[NH+]1CCC(NC/C=C(\C)CCC=C(C)C)CC1 ZINC001169231196 1129710444 /nfs/dbraw/zinc/71/04/44/1129710444.db2.gz WPJAMGXPGLYJBX-CXUHLZMHSA-N 1 3 264.457 3.753 20 0 CHADHO CC[NH+]1CCC(N[C@H](c2cccc(F)c2)C2CCC2)CC1 ZINC001169230345 1129710805 /nfs/dbraw/zinc/71/08/05/1129710805.db2.gz YRVKZSDTUIVDFF-SFHVURJKSA-N 1 3 290.426 3.741 20 0 CHADHO C(C1CCCCC1)N1CCC([NH2+][C@@H]2CCC[C@H]3C[C@H]32)CC1 ZINC000800969084 1129900808 /nfs/dbraw/zinc/90/08/08/1129900808.db2.gz GWWLDQLYRYCSLK-QXAKKESOSA-N 1 3 290.495 3.809 20 0 CHADHO c1ccc(C2CC(NC3C[C@H]4CC[C@@H](C3)[N@H+]4C3CC3)C2)cc1 ZINC000903118826 1130115930 /nfs/dbraw/zinc/11/59/30/1130115930.db2.gz ZTADDVZXFQVJFX-MUBKNYBQSA-N 1 3 296.458 3.680 20 0 CHADHO c1ccc(C2CC(NC3C[C@H]4CC[C@@H](C3)[N@@H+]4C3CC3)C2)cc1 ZINC000903118826 1130115931 /nfs/dbraw/zinc/11/59/31/1130115931.db2.gz ZTADDVZXFQVJFX-MUBKNYBQSA-N 1 3 296.458 3.680 20 0 CHADHO [NH3+]CC1([C@H]2CCCCN2CCCCC(F)(F)F)CCC1 ZINC000903811317 1130200442 /nfs/dbraw/zinc/20/04/42/1130200442.db2.gz KYODMNVXXWAPIZ-CYBMUJFWSA-N 1 3 292.389 3.703 20 0 CHADHO CN(C)Cc1ccnc(-c2ccc(C[NH2+]C(C)(C)C)cc2)c1 ZINC001240366957 1130279813 /nfs/dbraw/zinc/27/98/13/1130279813.db2.gz XEXLSFXRRUZLPR-UHFFFAOYSA-N 1 3 297.446 3.698 20 0 CHADHO c1ccc2c(c1)cccc2CCN[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000677237046 1130296988 /nfs/dbraw/zinc/29/69/88/1130296988.db2.gz ZFSMNINRYARVEO-RBUKOAKNSA-N 1 3 294.442 3.599 20 0 CHADHO c1ccc2c(c1)cccc2CCN[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000677237046 1130296992 /nfs/dbraw/zinc/29/69/92/1130296992.db2.gz ZFSMNINRYARVEO-RBUKOAKNSA-N 1 3 294.442 3.599 20 0 CHADHO CC(C)c1ccc(CCN[C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000678580366 1130431333 /nfs/dbraw/zinc/43/13/33/1130431333.db2.gz AAERCHQOVLGVDY-RBUKOAKNSA-N 1 3 286.463 3.569 20 0 CHADHO CC(C)c1ccc(CCN[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000678580366 1130431340 /nfs/dbraw/zinc/43/13/40/1130431340.db2.gz AAERCHQOVLGVDY-RBUKOAKNSA-N 1 3 286.463 3.569 20 0 CHADHO CC1=C[C@H](C)[C@H](C[N@@H+](C(C)C)[C@@H]2CCCNCC2)CC1 ZINC001206580569 1130537346 /nfs/dbraw/zinc/53/73/46/1130537346.db2.gz FCJDFVADZOZECY-OKZBNKHCSA-N 1 3 278.484 3.831 20 0 CHADHO CC1=C[C@H](C)[C@H](C[N@H+](C(C)C)[C@@H]2CCCNCC2)CC1 ZINC001206580569 1130537356 /nfs/dbraw/zinc/53/73/56/1130537356.db2.gz FCJDFVADZOZECY-OKZBNKHCSA-N 1 3 278.484 3.831 20 0 CHADHO CC(C)CC[C@H](C)N1CCC(C)([NH+]2CCCC2)CC1 ZINC001256374145 1130666667 /nfs/dbraw/zinc/66/66/67/1130666667.db2.gz XKHSNWVLQIZILN-INIZCTEOSA-N 1 3 266.473 3.761 20 0 CHADHO c1cc2cccc(CN3CCC[C@@]4(CCC[NH2+]4)CC3)c2o1 ZINC001235041000 1130705624 /nfs/dbraw/zinc/70/56/24/1130705624.db2.gz WBRPXHKMKZMAJW-SFHVURJKSA-N 1 3 284.403 3.541 20 0 CHADHO CC1=CC[C@@H](CC[N@@H+]2CCCC23CCNCC3)C1(C)C ZINC001235141800 1130714344 /nfs/dbraw/zinc/71/43/44/1130714344.db2.gz ZBKIKBFBKJZADW-INIZCTEOSA-N 1 3 276.468 3.587 20 0 CHADHO CC1=CC[C@@H](CC[N@H+]2CCCC23CCNCC3)C1(C)C ZINC001235141800 1130714349 /nfs/dbraw/zinc/71/43/49/1130714349.db2.gz ZBKIKBFBKJZADW-INIZCTEOSA-N 1 3 276.468 3.587 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@@H+]1CCCC12CCNCC2 ZINC001235139771 1130715006 /nfs/dbraw/zinc/71/50/06/1130715006.db2.gz DATWRHJDQZZHTM-INIZCTEOSA-N 1 3 264.457 3.587 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@H+]1CCCC12CCNCC2 ZINC001235139771 1130715010 /nfs/dbraw/zinc/71/50/10/1130715010.db2.gz DATWRHJDQZZHTM-INIZCTEOSA-N 1 3 264.457 3.587 20 0 CHADHO C(CC1CCCCC1)C[N@@H+]1CCCC12CCNCC2 ZINC001235141340 1130715315 /nfs/dbraw/zinc/71/53/15/1130715315.db2.gz RGNHCOYRCIVXMP-UHFFFAOYSA-N 1 3 264.457 3.565 20 0 CHADHO C(CC1CCCCC1)C[N@H+]1CCCC12CCNCC2 ZINC001235141340 1130715321 /nfs/dbraw/zinc/71/53/21/1130715321.db2.gz RGNHCOYRCIVXMP-UHFFFAOYSA-N 1 3 264.457 3.565 20 0 CHADHO CC1=C[C@H](C)[C@H](C[N@@H+]2CCCC[C@@]23CCCNC3)CC1 ZINC001235171267 1130717805 /nfs/dbraw/zinc/71/78/05/1130717805.db2.gz IHKLNJCNUVTFIK-BZSNNMDCSA-N 1 3 276.468 3.587 20 0 CHADHO CC1=C[C@H](C)[C@H](C[N@H+]2CCCC[C@@]23CCCNC3)CC1 ZINC001235171267 1130717812 /nfs/dbraw/zinc/71/78/12/1130717812.db2.gz IHKLNJCNUVTFIK-BZSNNMDCSA-N 1 3 276.468 3.587 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CC[C@@]2(C1)CNCC[C@H]2F ZINC001235403556 1130739580 /nfs/dbraw/zinc/73/95/80/1130739580.db2.gz LALPFNBYJQMTAC-GUDHTMSVSA-N 1 3 296.474 3.927 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CC[C@@]2(C1)CNCC[C@H]2F ZINC001235403556 1130739584 /nfs/dbraw/zinc/73/95/84/1130739584.db2.gz LALPFNBYJQMTAC-GUDHTMSVSA-N 1 3 296.474 3.927 20 0 CHADHO CC/C=C\CCCCCCN1CC[C@@]2(C1)C[NH2+]CC[C@H]2F ZINC001235403556 1130739589 /nfs/dbraw/zinc/73/95/89/1130739589.db2.gz LALPFNBYJQMTAC-GUDHTMSVSA-N 1 3 296.474 3.927 20 0 CHADHO Cc1ccccc1N(C)c1ccc(CN(C)CCC[NH3+])cc1 ZINC001235435328 1130744145 /nfs/dbraw/zinc/74/41/45/1130744145.db2.gz JNCNFXNRQUHALA-UHFFFAOYSA-N 1 3 297.446 3.544 20 0 CHADHO Cc1ccccc1[C@H]1CCCN1CC[C@H]1CCCC[NH2+]1 ZINC001235446279 1130745264 /nfs/dbraw/zinc/74/52/64/1130745264.db2.gz XNNXGZJPYGALAC-SJLPKXTDSA-N 1 3 272.436 3.664 20 0 CHADHO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccc2c(c1)CNC2 ZINC001235443379 1130745974 /nfs/dbraw/zinc/74/59/74/1130745974.db2.gz NAROENKMYGANTP-FQEVSTJZSA-N 1 3 292.426 3.935 20 0 CHADHO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccc2c(c1)CNC2 ZINC001235443379 1130745977 /nfs/dbraw/zinc/74/59/77/1130745977.db2.gz NAROENKMYGANTP-FQEVSTJZSA-N 1 3 292.426 3.935 20 0 CHADHO C[C@H](C[N@@H+]1CCC[C@H](CN)C1)c1cccc2ccccc21 ZINC001235675322 1130766579 /nfs/dbraw/zinc/76/65/79/1130766579.db2.gz VQKGUASDKMXFAQ-HZPDHXFCSA-N 1 3 282.431 3.614 20 0 CHADHO C[C@H](C[N@H+]1CCC[C@H](CN)C1)c1cccc2ccccc21 ZINC001235675322 1130766582 /nfs/dbraw/zinc/76/65/82/1130766582.db2.gz VQKGUASDKMXFAQ-HZPDHXFCSA-N 1 3 282.431 3.614 20 0 CHADHO [NH3+]CCCCN1CC[C@@H](c2cccc(Cl)c2Cl)C1 ZINC001235885736 1130793542 /nfs/dbraw/zinc/79/35/42/1130793542.db2.gz XGCHPCVCDSFSBQ-LLVKDONJSA-N 1 3 287.234 3.522 20 0 CHADHO c1cc(C2CCCCC2)ccc1CN1C[C@@H]2CC[NH2+]C[C@H]2C1 ZINC001235934777 1130811575 /nfs/dbraw/zinc/81/15/75/1130811575.db2.gz ALEYGGSCMXRREM-PMACEKPBSA-N 1 3 298.474 3.776 20 0 CHADHO CC/C=C\CCCCCCN1C[C@H]2CC[C@@H](C1)[C@@H]2[NH3+] ZINC001235959993 1130817450 /nfs/dbraw/zinc/81/74/50/1130817450.db2.gz RDLLYUVJCYVINC-HKMHDUOASA-N 1 3 264.457 3.572 20 0 CHADHO CCC(C)(C)c1ccc(CN2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])cc1 ZINC001235960100 1130817634 /nfs/dbraw/zinc/81/76/34/1130817634.db2.gz PLZRTRRQZOAPHB-ALXJQNPVSA-N 1 3 286.463 3.543 20 0 CHADHO CC[C@H]1CO[C@@](C)(CCC(C)C)N1CCC12CC([NH3+])(C1)C2 ZINC001235962556 1130818711 /nfs/dbraw/zinc/81/87/11/1130818711.db2.gz MRANZFBWEXNNSX-VYMRPNJYSA-N 1 3 294.483 3.521 20 0 CHADHO [NH3+][C@@H]1[C@@H]2CC[C@H]1CN(Cc1ccc(-c3cccs3)cc1)C2 ZINC001235960749 1130819181 /nfs/dbraw/zinc/81/91/81/1130819181.db2.gz YMJOMYRVBIWEML-ALXJQNPVSA-N 1 3 298.455 3.584 20 0 CHADHO C[NH2+]C[C@@H]1CCN(Cc2cccc3c4ccccc4oc32)C1 ZINC001236068908 1130847780 /nfs/dbraw/zinc/84/77/80/1130847780.db2.gz YQVQBFNOSYNXLX-AWEZNQCLSA-N 1 3 294.398 3.627 20 0 CHADHO C[C@H]1C[N@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)CCCN1 ZINC001236095781 1130860125 /nfs/dbraw/zinc/86/01/25/1130860125.db2.gz YRIIPJVVPPDWKJ-AWEZNQCLSA-N 1 3 299.462 3.649 20 0 CHADHO C[C@H]1C[N@@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)CCCN1 ZINC001236095781 1130860130 /nfs/dbraw/zinc/86/01/30/1130860130.db2.gz YRIIPJVVPPDWKJ-AWEZNQCLSA-N 1 3 299.462 3.649 20 0 CHADHO CN(CCCC[NH3+])Cc1sccc1Oc1ccccc1 ZINC001236142387 1130873792 /nfs/dbraw/zinc/87/37/92/1130873792.db2.gz WVTGXAZCOXYTHY-UHFFFAOYSA-N 1 3 290.432 3.711 20 0 CHADHO C[N@H+](Cc1c[nH]c2c1cccc2Cl)[C@@H]1CCCC[C@@H]1N ZINC001236214731 1130890667 /nfs/dbraw/zinc/89/06/67/1130890667.db2.gz DWSNVQLURBLEJU-LSDHHAIUSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@@H+](Cc1c[nH]c2c1cccc2Cl)[C@@H]1CCCC[C@@H]1N ZINC001236214731 1130890671 /nfs/dbraw/zinc/89/06/71/1130890671.db2.gz DWSNVQLURBLEJU-LSDHHAIUSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@H+](Cc1c[nH]c2cc(Cl)ccc12)[C@@H]1CCCC[C@H]1N ZINC001236217389 1130892799 /nfs/dbraw/zinc/89/27/99/1130892799.db2.gz OUSOCJBSSISPIC-GDBMZVCRSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@@H+](Cc1c[nH]c2cc(Cl)ccc12)[C@@H]1CCCC[C@H]1N ZINC001236217389 1130892805 /nfs/dbraw/zinc/89/28/05/1130892805.db2.gz OUSOCJBSSISPIC-GDBMZVCRSA-N 1 3 291.826 3.523 20 0 CHADHO CC(C)c1ccccc1C[N@H+](C)[C@@H]1CCCC[C@H]1N ZINC001236219144 1130894210 /nfs/dbraw/zinc/89/42/10/1130894210.db2.gz VCKDPIIMHRAOEP-IAGOWNOFSA-N 1 3 260.425 3.512 20 0 CHADHO CC(C)c1ccccc1C[N@@H+](C)[C@@H]1CCCC[C@H]1N ZINC001236219144 1130894215 /nfs/dbraw/zinc/89/42/15/1130894215.db2.gz VCKDPIIMHRAOEP-IAGOWNOFSA-N 1 3 260.425 3.512 20 0 CHADHO Cc1c(C)c(C)c(C[N@@H+](C)C2(C)CCNCC2)c(C)c1C ZINC001236226855 1130896395 /nfs/dbraw/zinc/89/63/95/1130896395.db2.gz VGNPMUSYRKCTLZ-UHFFFAOYSA-N 1 3 288.479 3.803 20 0 CHADHO Cc1c(C)c(C)c(C[N@H+](C)C2(C)CCNCC2)c(C)c1C ZINC001236226855 1130896401 /nfs/dbraw/zinc/89/64/01/1130896401.db2.gz VGNPMUSYRKCTLZ-UHFFFAOYSA-N 1 3 288.479 3.803 20 0 CHADHO CCCCCC[N@H+](Cc1ccccc1)C1CCNCC1 ZINC001236287369 1130911370 /nfs/dbraw/zinc/91/13/70/1130911370.db2.gz SIGMLFJKPKWCOI-UHFFFAOYSA-N 1 3 274.452 3.821 20 0 CHADHO CCCCCC[N@@H+](Cc1ccccc1)C1CCNCC1 ZINC001236287369 1130911373 /nfs/dbraw/zinc/91/13/73/1130911373.db2.gz SIGMLFJKPKWCOI-UHFFFAOYSA-N 1 3 274.452 3.821 20 0 CHADHO CCCCCCN(Cc1ccccc1)C1CC[NH2+]CC1 ZINC001236287369 1130911377 /nfs/dbraw/zinc/91/13/77/1130911377.db2.gz SIGMLFJKPKWCOI-UHFFFAOYSA-N 1 3 274.452 3.821 20 0 CHADHO CCN(Cc1ccc(C(C)(C)CC)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236407410 1130931056 /nfs/dbraw/zinc/93/10/56/1130931056.db2.gz FAHAZOAMARSDSK-QGZVFWFLSA-N 1 3 288.479 3.806 20 0 CHADHO Cc1c(C)c(C)c(C[N@H+]2CCC[C@@H](N)[C@@H]2C)c(C)c1C ZINC001236421397 1130935945 /nfs/dbraw/zinc/93/59/45/1130935945.db2.gz QRRJPLBXVFBYAG-FUHWJXTLSA-N 1 3 274.452 3.540 20 0 CHADHO Cc1c(C)c(C)c(C[N@@H+]2CCC[C@@H](N)[C@@H]2C)c(C)c1C ZINC001236421397 1130935950 /nfs/dbraw/zinc/93/59/50/1130935950.db2.gz QRRJPLBXVFBYAG-FUHWJXTLSA-N 1 3 274.452 3.540 20 0 CHADHO CC(C)C[NH2+]Cc1ccc(-c2cncc3cc[nH]c32)cc1 ZINC001236437421 1130941585 /nfs/dbraw/zinc/94/15/85/1130941585.db2.gz QRKSATRAXKILGM-UHFFFAOYSA-N 1 3 279.387 3.976 20 0 CHADHO CC/C=C\CCCCC[N@H+](C[C@H]1CCCNC1)C1CC1 ZINC001236584702 1130981050 /nfs/dbraw/zinc/98/10/50/1130981050.db2.gz QCHPHPMLSAGQOS-LIMHQNJXSA-N 1 3 278.484 3.977 20 0 CHADHO CC/C=C\CCCCC[N@@H+](C[C@H]1CCCNC1)C1CC1 ZINC001236584702 1130981055 /nfs/dbraw/zinc/98/10/55/1130981055.db2.gz QCHPHPMLSAGQOS-LIMHQNJXSA-N 1 3 278.484 3.977 20 0 CHADHO CCCc1ccc(C[N@H+](C2CCC2)C2CCNCC2)cc1 ZINC001236636185 1130986824 /nfs/dbraw/zinc/98/68/24/1130986824.db2.gz ASWJOEOLBGLNDZ-UHFFFAOYSA-N 1 3 286.463 3.746 20 0 CHADHO CCCc1ccc(C[N@@H+](C2CCC2)C2CCNCC2)cc1 ZINC001236636185 1130986827 /nfs/dbraw/zinc/98/68/27/1130986827.db2.gz ASWJOEOLBGLNDZ-UHFFFAOYSA-N 1 3 286.463 3.746 20 0 CHADHO CCCc1ccc(CN(C2CCC2)C2CC[NH2+]CC2)cc1 ZINC001236636185 1130986831 /nfs/dbraw/zinc/98/68/31/1130986831.db2.gz ASWJOEOLBGLNDZ-UHFFFAOYSA-N 1 3 286.463 3.746 20 0 CHADHO Cc1cc(Cl)ccc1CN(C1CCC1)C1CC[NH2+]CC1 ZINC001236637496 1130987802 /nfs/dbraw/zinc/98/78/02/1130987802.db2.gz QVXQNASDKPSNIH-UHFFFAOYSA-N 1 3 292.854 3.755 20 0 CHADHO Cc1cc(Cl)ccc1C[N@H+](C1CCC1)C1CCNCC1 ZINC001236637496 1130987805 /nfs/dbraw/zinc/98/78/05/1130987805.db2.gz QVXQNASDKPSNIH-UHFFFAOYSA-N 1 3 292.854 3.755 20 0 CHADHO Cc1cc(Cl)ccc1C[N@@H+](C1CCC1)C1CCNCC1 ZINC001236637496 1130987809 /nfs/dbraw/zinc/98/78/09/1130987809.db2.gz QVXQNASDKPSNIH-UHFFFAOYSA-N 1 3 292.854 3.755 20 0 CHADHO Cc1cc(F)ccc1[C@H](C)[NH2+]C1CCN(CC(C)C)CC1 ZINC000815557196 1130999185 /nfs/dbraw/zinc/99/91/85/1130999185.db2.gz OLNSWVAGGXJPKI-HNNXBMFYSA-N 1 3 292.442 3.905 20 0 CHADHO CCCN(CCc1ccc(C(C)C)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236829480 1131016706 /nfs/dbraw/zinc/01/67/06/1131016706.db2.gz KONDSEDACURVIN-GOSISDBHSA-N 1 3 288.479 3.674 20 0 CHADHO CCCCc1ccc(CN2CCC[C@@](C)(C[NH3+])C2)cc1 ZINC001237083130 1131046986 /nfs/dbraw/zinc/04/69/86/1131046986.db2.gz VYSXOYHVOQEVSU-SFHVURJKSA-N 1 3 274.452 3.590 20 0 CHADHO CCCCc1ccc(CN2CCC[C@](C)(C[NH3+])C2)cc1 ZINC001237083128 1131047618 /nfs/dbraw/zinc/04/76/18/1131047618.db2.gz VYSXOYHVOQEVSU-GOSISDBHSA-N 1 3 274.452 3.590 20 0 CHADHO Cc1cnc2ccccc2c1N1CCC[N@@H+](C(C)(C)C)CC1 ZINC001116271250 1131138789 /nfs/dbraw/zinc/13/87/89/1131138789.db2.gz BFZLIWLPWKKODR-UHFFFAOYSA-N 1 3 297.446 3.854 20 0 CHADHO Cc1cnc2ccccc2c1N1CCC[N@H+](C(C)(C)C)CC1 ZINC001116271250 1131138792 /nfs/dbraw/zinc/13/87/92/1131138792.db2.gz BFZLIWLPWKKODR-UHFFFAOYSA-N 1 3 297.446 3.854 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+]3C[C@@H]4CCC[C@@H]4C3)cc21 ZINC001237875714 1131146633 /nfs/dbraw/zinc/14/66/33/1131146633.db2.gz CPRLZLZBBYAGNF-HDICACEKSA-N 1 3 296.458 3.920 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+]3C[C@@H]4CCC[C@@H]4C3)cc21 ZINC001237875714 1131146634 /nfs/dbraw/zinc/14/66/34/1131146634.db2.gz CPRLZLZBBYAGNF-HDICACEKSA-N 1 3 296.458 3.920 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+]3CCC[C@H]3C)cc21 ZINC001237881022 1131147831 /nfs/dbraw/zinc/14/78/31/1131147831.db2.gz NFYZQQQHDIECKR-CQSZACIVSA-N 1 3 270.420 3.672 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+]3CCC[C@H]3C)cc21 ZINC001237881022 1131147834 /nfs/dbraw/zinc/14/78/34/1131147834.db2.gz NFYZQQQHDIECKR-CQSZACIVSA-N 1 3 270.420 3.672 20 0 CHADHO CC[NH+](CC)Cc1ccc2c(c1)C(C(C)C)=NCC2 ZINC001237881459 1131149048 /nfs/dbraw/zinc/14/90/48/1131149048.db2.gz SGCIUBCORHLDHG-UHFFFAOYSA-N 1 3 258.409 3.530 20 0 CHADHO CCN(CC)Cc1cc([C@@H](C)[NH2+]C2(C)CC2)ccc1OC ZINC001116494578 1131151398 /nfs/dbraw/zinc/15/13/98/1131151398.db2.gz GFTYFUMMTNGFCW-CQSZACIVSA-N 1 3 290.451 3.740 20 0 CHADHO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(CN)nc2C)s1 ZINC000817895384 1131186573 /nfs/dbraw/zinc/18/65/73/1131186573.db2.gz URFDJEUUCOYGMR-AAEUAGOBSA-N 1 3 289.448 3.630 20 0 CHADHO C[C@@H](N[C@@H](C)C[C@H](C)[NH3+])c1csc2ccccc12 ZINC000817898120 1131187161 /nfs/dbraw/zinc/18/71/61/1131187161.db2.gz CYUKMSWKYSNANE-SDDRHHMPSA-N 1 3 262.422 3.678 20 0 CHADHO C[C@]1(CCN[C@@H]2C[C@H]([NH3+])c3ccccc32)CC1(Cl)Cl ZINC000817935825 1131187934 /nfs/dbraw/zinc/18/79/34/1131187934.db2.gz FAIBXGITOSXONM-MJBXVCDLSA-N 1 3 299.245 3.695 20 0 CHADHO C[C@]1(CCN[C@H]2C[C@@H]([NH3+])c3ccccc32)CC1(Cl)Cl ZINC000817935827 1131188107 /nfs/dbraw/zinc/18/81/07/1131188107.db2.gz FAIBXGITOSXONM-RDBSUJKOSA-N 1 3 299.245 3.695 20 0 CHADHO CCOc1cccc([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000817962154 1131192658 /nfs/dbraw/zinc/19/26/58/1131192658.db2.gz GOGMOHOPCCQDHL-CABCVRRESA-N 1 3 298.430 3.956 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2ccnc(Cl)c2)cc1 ZINC000817961885 1131192845 /nfs/dbraw/zinc/19/28/45/1131192845.db2.gz CCEYNFRLOJWBGH-RYUDHWBXSA-N 1 3 289.810 3.606 20 0 CHADHO Cc1cc(F)ccc1[C@@H](C)NCc1ccc2c(c1)C[NH2+]C2 ZINC000817969057 1131193594 /nfs/dbraw/zinc/19/35/94/1131193594.db2.gz QLGJYHWUHFAXNZ-CYBMUJFWSA-N 1 3 284.378 3.588 20 0 CHADHO CC1(C)C[C@@H]([NH2+]CCC2CCCCCCC2)CCN1 ZINC001246236183 1131421522 /nfs/dbraw/zinc/42/15/22/1131421522.db2.gz KSKQGKAQXDCBSI-INIZCTEOSA-N 1 3 266.473 3.857 20 0 CHADHO CC[C@H](C)C1CCC([NH2+]C2C[C@H](C)N[C@@H](C)C2)CC1 ZINC001246340563 1131478838 /nfs/dbraw/zinc/47/88/38/1131478838.db2.gz VCMITRHWFDVUPE-QHSYURCPSA-N 1 3 266.473 3.710 20 0 CHADHO CCCC[C@H]1C[C@H]([NH2+]CC(C)(C)CC(F)(F)F)CCN1 ZINC001246447108 1131503875 /nfs/dbraw/zinc/50/38/75/1131503875.db2.gz ONVCDFWGRQITDW-QWHCGFSZSA-N 1 3 294.405 3.865 20 0 CHADHO CCCC[C@@H](CC(C)C)NC[C@]1(CC)CCC[NH2+]1 ZINC001246455172 1131504493 /nfs/dbraw/zinc/50/44/93/1131504493.db2.gz HIUAGMWKUOZSFB-HOTGVXAUSA-N 1 3 254.462 3.713 20 0 CHADHO C[C@H]1C[C@@H]([NH2+][C@H]2CCCC3(CCCCC3)C2)CCN1 ZINC001246493100 1131525506 /nfs/dbraw/zinc/52/55/06/1131525506.db2.gz ADIQLTUOTPDGOG-JYJNAYRXSA-N 1 3 264.457 3.610 20 0 CHADHO N[C@H]1CCC[N@@H+](C2CCC3(CCCCC3)CC2)CC1 ZINC001246543053 1131586162 /nfs/dbraw/zinc/58/61/62/1131586162.db2.gz RTYUSZBMARFMCM-HNNXBMFYSA-N 1 3 264.457 3.693 20 0 CHADHO N[C@H]1CCC[N@H+](C2CCC3(CCCCC3)CC2)CC1 ZINC001246543053 1131586165 /nfs/dbraw/zinc/58/61/65/1131586165.db2.gz RTYUSZBMARFMCM-HNNXBMFYSA-N 1 3 264.457 3.693 20 0 CHADHO CCCC[C@@H](CC(C)C)[N@@H+]1CCC(F)(F)[C@H](CN)C1 ZINC001246555810 1131617137 /nfs/dbraw/zinc/61/71/37/1131617137.db2.gz HUJUTRVSUNMIPV-KGLIPLIRSA-N 1 3 276.415 3.507 20 0 CHADHO CCCC[C@@H](CC(C)C)[N@H+]1CCC(F)(F)[C@H](CN)C1 ZINC001246555810 1131617139 /nfs/dbraw/zinc/61/71/39/1131617139.db2.gz HUJUTRVSUNMIPV-KGLIPLIRSA-N 1 3 276.415 3.507 20 0 CHADHO CCCC[C@H](CC(C)C)[N@@H+]1CCC[C@@H](CN)[C@H]1C ZINC001246566720 1131633682 /nfs/dbraw/zinc/63/36/82/1131633682.db2.gz UYZUMAIXQIOVLP-OWCLPIDISA-N 1 3 254.462 3.651 20 0 CHADHO CCCC[C@H](CC(C)C)[N@H+]1CCC[C@@H](CN)[C@H]1C ZINC001246566720 1131633684 /nfs/dbraw/zinc/63/36/84/1131633684.db2.gz UYZUMAIXQIOVLP-OWCLPIDISA-N 1 3 254.462 3.651 20 0 CHADHO CCCCC[C@@H](C)[N@H+](C(C)C)[C@@H]1CCCNCC1 ZINC001246592733 1131707345 /nfs/dbraw/zinc/70/73/45/1131707345.db2.gz LHNYFHCDSBNLRR-HZPDHXFCSA-N 1 3 254.462 3.808 20 0 CHADHO CCCCC[C@@H](C)[N@@H+](C(C)C)[C@@H]1CCCNCC1 ZINC001246592733 1131707349 /nfs/dbraw/zinc/70/73/49/1131707349.db2.gz LHNYFHCDSBNLRR-HZPDHXFCSA-N 1 3 254.462 3.808 20 0 CHADHO CC[C@H]1CC[C@H](C2CCC(N3CC(C[NH3+])C3)CC2)CC1 ZINC001246593474 1131708849 /nfs/dbraw/zinc/70/88/49/1131708849.db2.gz IBVHKBKXAGUIOP-SVOYEFRLSA-N 1 3 278.484 3.652 20 0 CHADHO CCC1CCC(C2CCC(N3CC(C[NH3+])C3)CC2)CC1 ZINC001246593475 1131709214 /nfs/dbraw/zinc/70/92/14/1131709214.db2.gz IBVHKBKXAGUIOP-UHFFFAOYSA-N 1 3 278.484 3.652 20 0 CHADHO C[N@H+](CC1CCCCC1)[C@H]1CCN[C@H](C(C)(C)C)C1 ZINC001246847277 1131789242 /nfs/dbraw/zinc/78/92/42/1131789242.db2.gz RTQHYWRZLVJFLT-HOTGVXAUSA-N 1 3 266.473 3.665 20 0 CHADHO C[N@@H+](CC1CCCCC1)[C@H]1CCN[C@H](C(C)(C)C)C1 ZINC001246847277 1131789247 /nfs/dbraw/zinc/78/92/47/1131789247.db2.gz RTQHYWRZLVJFLT-HOTGVXAUSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)(C)[C@H]1C[C@@H]([NH+]2CCCCCCCC2)CCN1 ZINC001246920303 1131816965 /nfs/dbraw/zinc/81/69/65/1131816965.db2.gz MEKIOXYNERZKIJ-JKSUJKDBSA-N 1 3 266.473 3.809 20 0 CHADHO CCCCC(CCCC)N1CC[C@@H]([NH3+])[C@H](C(F)(F)F)C1 ZINC001246936118 1131822810 /nfs/dbraw/zinc/82/28/10/1131822810.db2.gz KKHILDQRWOHCCC-ZIAGYGMSSA-N 1 3 294.405 3.947 20 0 CHADHO Cc1ccc2ccccc2c1C[N@@H+]1CCCC[C@H](CN)C1 ZINC001206624662 1132026715 /nfs/dbraw/zinc/02/67/15/1132026715.db2.gz YMQWSFOTYASJFJ-MRXNPFEDSA-N 1 3 282.431 3.709 20 0 CHADHO Cc1ccc2ccccc2c1C[N@H+]1CCCC[C@H](CN)C1 ZINC001206624662 1132026723 /nfs/dbraw/zinc/02/67/23/1132026723.db2.gz YMQWSFOTYASJFJ-MRXNPFEDSA-N 1 3 282.431 3.709 20 0 CHADHO C=C/C=C\CC[NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000716703096 1132028503 /nfs/dbraw/zinc/02/85/03/1132028503.db2.gz XNQITIVWFZXMOE-IQUHNSSXSA-N 1 3 296.458 3.761 20 0 CHADHO CC[C@@H]([NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)C1CC1 ZINC000716727470 1132030167 /nfs/dbraw/zinc/03/01/67/1132030167.db2.gz LGTSGQBTJDKTNI-FRYIKTPZSA-N 1 3 298.474 3.818 20 0 CHADHO CN1C(C)(C)CC([N@@H+]2CCC[C@@](C)(F)CC2)CC1(C)C ZINC001171630769 1132060472 /nfs/dbraw/zinc/06/04/72/1132060472.db2.gz BCMPLPOKDPWXBS-QGZVFWFLSA-N 1 3 284.463 3.852 20 0 CHADHO CN1C(C)(C)CC([N@H+]2CCC[C@@](C)(F)CC2)CC1(C)C ZINC001171630769 1132060479 /nfs/dbraw/zinc/06/04/79/1132060479.db2.gz BCMPLPOKDPWXBS-QGZVFWFLSA-N 1 3 284.463 3.852 20 0 CHADHO CN1C(C)(C)CC([N@@H+]2CCCC(F)(F)CC2)CC1(C)C ZINC001171631894 1132062670 /nfs/dbraw/zinc/06/26/70/1132062670.db2.gz PCCKQEOCUUKEFQ-UHFFFAOYSA-N 1 3 288.426 3.759 20 0 CHADHO CN1C(C)(C)CC([NH2+]CCCc2cccs2)CC1(C)C ZINC001171620147 1132064634 /nfs/dbraw/zinc/06/46/34/1132064634.db2.gz VFRZUAFPDJUVTC-UHFFFAOYSA-N 1 3 294.508 3.922 20 0 CHADHO CC(C)C[C@H](C)[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001171621558 1132064651 /nfs/dbraw/zinc/06/46/51/1132064651.db2.gz MSBFIQCCIABWKR-ZDUSSCGKSA-N 1 3 254.462 3.662 20 0 CHADHO C[C@@H]1CCCC[C@H]1[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001171617531 1132065534 /nfs/dbraw/zinc/06/55/34/1132065534.db2.gz MXIHFMCLJKSYAT-UKRRQHHQSA-N 1 3 266.473 3.806 20 0 CHADHO C[C@@H]([NH2+]C1CC(C)(C)N(C)C(C)(C)C1)c1ccc(N)cc1 ZINC001171623638 1132066843 /nfs/dbraw/zinc/06/68/43/1132066843.db2.gz FEVNQAHSIVROGZ-CYBMUJFWSA-N 1 3 289.467 3.571 20 0 CHADHO CC(C)OC1CC[NH+](C2CC(C)(C)N(C)C(C)(C)C2)CC1 ZINC001171636906 1132080849 /nfs/dbraw/zinc/08/08/49/1132080849.db2.gz KAGSUDZTEBMFMI-UHFFFAOYSA-N 1 3 296.499 3.527 20 0 CHADHO CCC[C@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccncc1 ZINC001172113601 1132131463 /nfs/dbraw/zinc/13/14/63/1132131463.db2.gz DSRNFHWLIDSUEK-MHORFTMASA-N 1 3 287.451 3.528 20 0 CHADHO CCC[C@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccncc1 ZINC001172113601 1132131467 /nfs/dbraw/zinc/13/14/67/1132131467.db2.gz DSRNFHWLIDSUEK-MHORFTMASA-N 1 3 287.451 3.528 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC3(CCCC3)CC1)C2 ZINC001172120758 1132136090 /nfs/dbraw/zinc/13/60/90/1132136090.db2.gz MNDCITVVXTVNKJ-FVQHAEBGSA-N 1 3 276.468 3.658 20 0 CHADHO CC[C@@H](C)OCC[C@H](C)[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001172324987 1132160516 /nfs/dbraw/zinc/16/05/16/1132160516.db2.gz PMXWZFUPBHXZAT-LSDHHAIUSA-N 1 3 298.515 3.821 20 0 CHADHO C(C1CCCCC1)N1CCC([NH2+][C@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000839190501 1132189843 /nfs/dbraw/zinc/18/98/43/1132189843.db2.gz GWWLDQLYRYCSLK-NEWSRXKRSA-N 1 3 290.495 3.809 20 0 CHADHO C[C@@H]1CC[C@@H]([NH+]2CCC(N3CCCCC3)CC2)C[C@H]1C ZINC001172366701 1132192130 /nfs/dbraw/zinc/19/21/30/1132192130.db2.gz OWUBRQQCYGHMGT-JFIYKMOQSA-N 1 3 278.484 3.761 20 0 CHADHO C[C@H]1C[C@H]([NH2+]C2CCN(CC3CCCCC3)CC2)CS1 ZINC000840856033 1132295706 /nfs/dbraw/zinc/29/57/06/1132295706.db2.gz OWCDHMKSGPBFSR-YOEHRIQHSA-N 1 3 296.524 3.515 20 0 CHADHO C[C@H]1C[C@H](NC2CC[NH+](CC3CCCCC3)CC2)CS1 ZINC000840856033 1132295712 /nfs/dbraw/zinc/29/57/12/1132295712.db2.gz OWCDHMKSGPBFSR-YOEHRIQHSA-N 1 3 296.524 3.515 20 0 CHADHO CC[NH+](CC)C1CCC(N[C@@H](C)c2csc(C)n2)CC1 ZINC001173101988 1132390873 /nfs/dbraw/zinc/39/08/73/1132390873.db2.gz RQMHEAVUXWQHDI-GRTSSRMGSA-N 1 3 295.496 3.755 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)c1 ZINC001232146712 1132427428 /nfs/dbraw/zinc/42/74/28/1132427428.db2.gz ZWEDBQNMIHHUAE-AEFFLSMTSA-N 1 3 290.426 3.652 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c1 ZINC001232146712 1132427431 /nfs/dbraw/zinc/42/74/31/1132427431.db2.gz ZWEDBQNMIHHUAE-AEFFLSMTSA-N 1 3 290.426 3.652 20 0 CHADHO C[C@@H]1CCC[N@H+](Cc2cc(F)cc(CN(C)C)c2)C[C@@H]1C ZINC001232144346 1132427999 /nfs/dbraw/zinc/42/79/99/1132427999.db2.gz IYUODTKZBWVXMF-CABCVRRESA-N 1 3 292.442 3.755 20 0 CHADHO C[C@@H]1CCC[N@@H+](Cc2cc(F)cc(CN(C)C)c2)C[C@@H]1C ZINC001232144346 1132428005 /nfs/dbraw/zinc/42/80/05/1132428005.db2.gz IYUODTKZBWVXMF-CABCVRRESA-N 1 3 292.442 3.755 20 0 CHADHO CCCC[N@H+](CC)Cc1cc(F)cc(CN(C)C)c1 ZINC001232143307 1132428415 /nfs/dbraw/zinc/42/84/15/1132428415.db2.gz AUEUKQZFWHHVLX-UHFFFAOYSA-N 1 3 266.404 3.509 20 0 CHADHO CCCC[N@@H+](CC)Cc1cc(F)cc(CN(C)C)c1 ZINC001232143307 1132428417 /nfs/dbraw/zinc/42/84/17/1132428417.db2.gz AUEUKQZFWHHVLX-UHFFFAOYSA-N 1 3 266.404 3.509 20 0 CHADHO CC[C@@H]1CC[C@@H]([NH2+]C2CCN(CC3CCCC3)CC2)C1 ZINC001173270070 1132435313 /nfs/dbraw/zinc/43/53/13/1132435313.db2.gz AGVDDSPGAQCTSK-CRAIPNDOSA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)C[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1ccncc1 ZINC000842847925 1132468693 /nfs/dbraw/zinc/46/86/93/1132468693.db2.gz DUWLYJKPLNVDGW-KURKYZTESA-N 1 3 289.467 3.631 20 0 CHADHO CC(C)(C)c1cc(Nc2ccc3c(c2)CC[NH2+]C3)ccn1 ZINC001159240319 1132818115 /nfs/dbraw/zinc/81/81/15/1132818115.db2.gz CZQOETGAXCNDBR-UHFFFAOYSA-N 1 3 281.403 3.768 20 0 CHADHO CC(C)(C)c1cc(Nc2ccc3c(c2)C[NH2+]CCO3)ccn1 ZINC001159796546 1132910655 /nfs/dbraw/zinc/91/06/55/1132910655.db2.gz AZWHTRFIBIEMID-UHFFFAOYSA-N 1 3 297.402 3.605 20 0 CHADHO CCCCCOc1ccc(C[N@H+](C)CCCN(C)C)cc1 ZINC001204311224 1133435100 /nfs/dbraw/zinc/43/51/00/1133435100.db2.gz XEZBYCRMEKDLBL-UHFFFAOYSA-N 1 3 292.467 3.639 20 0 CHADHO CCCCCOc1ccc(C[N@@H+](C)CCCN(C)C)cc1 ZINC001204311224 1133435104 /nfs/dbraw/zinc/43/51/04/1133435104.db2.gz XEZBYCRMEKDLBL-UHFFFAOYSA-N 1 3 292.467 3.639 20 0 CHADHO CCCCN1CCC([N@H+](C)Cc2cccc(F)c2C)CC1 ZINC001204514326 1133456697 /nfs/dbraw/zinc/45/66/97/1133456697.db2.gz UTIVVQQQZFDYQW-UHFFFAOYSA-N 1 3 292.442 3.830 20 0 CHADHO CCCCN1CCC([N@@H+](C)Cc2cccc(F)c2C)CC1 ZINC001204514326 1133456702 /nfs/dbraw/zinc/45/67/02/1133456702.db2.gz UTIVVQQQZFDYQW-UHFFFAOYSA-N 1 3 292.442 3.830 20 0 CHADHO C[NH2+]C[C@@H]1CCCN(Cc2c(C)sc3ccccc32)C1 ZINC001205009244 1133515833 /nfs/dbraw/zinc/51/58/33/1133515833.db2.gz KGVFCVFUIJSEGI-AWEZNQCLSA-N 1 3 288.460 3.641 20 0 CHADHO CCOc1ccc2ccccc2c1CN1CCC[C@H]([NH3+])CC1 ZINC001205102639 1133530322 /nfs/dbraw/zinc/53/03/22/1133530322.db2.gz UZHOCTIBNDZRPB-INIZCTEOSA-N 1 3 298.430 3.552 20 0 CHADHO [NH3+][C@H]1CCCN(Cc2ccc(Cc3ccccc3)cc2)CC1 ZINC001205116559 1133532297 /nfs/dbraw/zinc/53/22/97/1133532297.db2.gz CNIQRXDYAXEQFX-FQEVSTJZSA-N 1 3 294.442 3.591 20 0 CHADHO CC1=CCC[C@@H](C)[C@@H]1C[NH+]1CCC(N2CCCCC2)CC1 ZINC001205192983 1133544242 /nfs/dbraw/zinc/54/42/42/1133544242.db2.gz GRXNAYUIMDAAJE-IEBWSBKVSA-N 1 3 290.495 3.929 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1C[NH+]1CCC(N2CCCCC2)CC1 ZINC001205192981 1133544383 /nfs/dbraw/zinc/54/43/83/1133544383.db2.gz GRXNAYUIMDAAJE-HKUYNNGSSA-N 1 3 290.495 3.929 20 0 CHADHO C[C@]1([NH3+])CCCN(Cc2c[nH]c3cc(Cl)ccc23)CC1 ZINC001205273266 1133553751 /nfs/dbraw/zinc/55/37/51/1133553751.db2.gz JBHDFWUILWYZNB-INIZCTEOSA-N 1 3 291.826 3.525 20 0 CHADHO CC(C)c1cccc(CN2CCC[C@](C)([NH3+])CC2)c1 ZINC001205288388 1133555069 /nfs/dbraw/zinc/55/50/69/1133555069.db2.gz KBXJPSMHCQROOK-KRWDZBQOSA-N 1 3 260.425 3.513 20 0 CHADHO C[C@@H]1CCN(Cc2cccc(-c3ccccc3)c2)C[C@H]1C[NH3+] ZINC001205305035 1133558284 /nfs/dbraw/zinc/55/82/84/1133558284.db2.gz QOTXRWUJYAUALK-OXQOHEQNSA-N 1 3 294.442 3.770 20 0 CHADHO CC(C)(C[NH2+][C@H]1CCCCC1(C)C)CN1CCCC1 ZINC001205645429 1133598204 /nfs/dbraw/zinc/59/82/04/1133598204.db2.gz HHFAKFIGKKGQQQ-HNNXBMFYSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@H]1[C@H](C[NH3+])CCCN1Cc1ccc(F)c2ccccc12 ZINC001205903008 1133629158 /nfs/dbraw/zinc/62/91/58/1133629158.db2.gz MSGAWBXZRIQQNL-KBPBESRZSA-N 1 3 286.394 3.538 20 0 CHADHO Cc1ccc2ccccc2c1C[N@H+]1CCC[C@@H](CN)[C@H]1C ZINC001205917430 1133630013 /nfs/dbraw/zinc/63/00/13/1133630013.db2.gz YOSVWKMBDXXAFQ-WBVHZDCISA-N 1 3 282.431 3.707 20 0 CHADHO Cc1ccc2ccccc2c1C[N@@H+]1CCC[C@@H](CN)[C@H]1C ZINC001205917430 1133630017 /nfs/dbraw/zinc/63/00/17/1133630017.db2.gz YOSVWKMBDXXAFQ-WBVHZDCISA-N 1 3 282.431 3.707 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](CN2C[C@@H](C)[C@H]([NH3+])C2)CC1 ZINC001206053221 1133650531 /nfs/dbraw/zinc/65/05/31/1133650531.db2.gz NSZMWWQBSUMOJK-KBAYOESNSA-N 1 3 276.468 3.738 20 0 CHADHO CCn1ccc2ccc(CN3CCCC[C@@](C)(C[NH3+])C3)cc21 ZINC001206548097 1133715682 /nfs/dbraw/zinc/71/56/82/1133715682.db2.gz GFPLPZOFUABRPN-IBGZPJMESA-N 1 3 299.462 3.612 20 0 CHADHO C[C@H](CC[N@@H+]1CCCC[C@H](CN)C1)CC(C)(C)C ZINC001206606455 1133727160 /nfs/dbraw/zinc/72/71/60/1133727160.db2.gz NOXNNASPNSHQMX-HUUCEWRRSA-N 1 3 254.462 3.510 20 0 CHADHO C[C@H](CC[N@H+]1CCCC[C@H](CN)C1)CC(C)(C)C ZINC001206606455 1133727164 /nfs/dbraw/zinc/72/71/64/1133727164.db2.gz NOXNNASPNSHQMX-HUUCEWRRSA-N 1 3 254.462 3.510 20 0 CHADHO CC(C)(C)c1cccc(CN2CCCC[C@@H](C[NH3+])C2)c1 ZINC001206624886 1133729364 /nfs/dbraw/zinc/72/93/64/1133729364.db2.gz ZOFJXWFOSMPSDB-INIZCTEOSA-N 1 3 274.452 3.545 20 0 CHADHO C[C@@H]1CC[C@H](CN)C[N@@H+]1C[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC001206761156 1133743341 /nfs/dbraw/zinc/74/33/41/1133743341.db2.gz VDYWENKSBOMRBF-LGWLGOQQSA-N 1 3 292.854 3.503 20 0 CHADHO C[C@@H]1CC[C@H](CN)C[N@H+]1C[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC001206761156 1133743346 /nfs/dbraw/zinc/74/33/46/1133743346.db2.gz VDYWENKSBOMRBF-LGWLGOQQSA-N 1 3 292.854 3.503 20 0 CHADHO C(C[NH+]1CCC(N2CCCCC2)CC1)C1CCCCC1 ZINC001207254223 1133782442 /nfs/dbraw/zinc/78/24/42/1133782442.db2.gz BQEZXJIPRTVMPH-UHFFFAOYSA-N 1 3 278.484 3.907 20 0 CHADHO CC1=CC[C@H](CCN2CCC([NH+]3CCCC3)CC2)C1(C)C ZINC001207267286 1133784141 /nfs/dbraw/zinc/78/41/41/1133784141.db2.gz DHLWXXMEPGBXMW-QGZVFWFLSA-N 1 3 290.495 3.929 20 0 CHADHO CCCN1C[C@@H]2C[N@@H+](CC[C@H]3CC=C(C)C3(C)C)C[C@@H]2C1 ZINC001207274617 1133785081 /nfs/dbraw/zinc/78/50/81/1133785081.db2.gz DDRNFSHSERVDMF-FGTMMUONSA-N 1 3 290.495 3.643 20 0 CHADHO CCCN1C[C@@H]2C[N@H+](CC[C@H]3CC=C(C)C3(C)C)C[C@@H]2C1 ZINC001207274617 1133785087 /nfs/dbraw/zinc/78/50/87/1133785087.db2.gz DDRNFSHSERVDMF-FGTMMUONSA-N 1 3 290.495 3.643 20 0 CHADHO CC[NH+](CC)C1CCN(C[C@H]2CCC(C)=C[C@@H]2C)CC1 ZINC001208179446 1133899784 /nfs/dbraw/zinc/89/97/84/1133899784.db2.gz YHYSMMTUJWSMLF-DLBZAZTESA-N 1 3 278.484 3.785 20 0 CHADHO CN(C)CC1(C[N@@H+]2CC[C@H]2c2ccccc2)CCCC1 ZINC001208186121 1133903500 /nfs/dbraw/zinc/90/35/00/1133903500.db2.gz MTTJYCWZKVSDPU-KRWDZBQOSA-N 1 3 272.436 3.555 20 0 CHADHO CN(C)CC1(C[N@H+]2CC[C@H]2c2ccccc2)CCCC1 ZINC001208186121 1133903503 /nfs/dbraw/zinc/90/35/03/1133903503.db2.gz MTTJYCWZKVSDPU-KRWDZBQOSA-N 1 3 272.436 3.555 20 0 CHADHO CC(C)N(CCC[NH+]1CCCCC1)Cc1ccccc1 ZINC001209447932 1134024675 /nfs/dbraw/zinc/02/46/75/1134024675.db2.gz HKSIKTSIXPSURA-UHFFFAOYSA-N 1 3 274.452 3.773 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CCC[C@]12CCCNC2 ZINC001222232518 1135210877 /nfs/dbraw/zinc/21/08/77/1135210877.db2.gz VVAFFQJRHOLYCZ-ROUUACIJSA-N 1 3 278.484 3.977 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CCC[C@]12CCCNC2 ZINC001222232518 1135210881 /nfs/dbraw/zinc/21/08/81/1135210881.db2.gz VVAFFQJRHOLYCZ-ROUUACIJSA-N 1 3 278.484 3.977 20 0 CHADHO C[C@@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1ccccc1 ZINC000037786204 260118136 /nfs/dbraw/zinc/11/81/36/260118136.db2.gz WTXJTAGNIMESRX-CQSZACIVSA-N 1 3 260.425 3.600 20 0 CHADHO C[N@@H+]1CC[C@H](N[C@@H]2CCCc3sccc32)[C@@H]2CCC[C@H]21 ZINC000353668104 529807117 /nfs/dbraw/zinc/80/71/17/529807117.db2.gz FTDGOSHKNZVOQN-DRPJVOAASA-N 1 3 290.476 3.588 20 0 CHADHO C[N@H+]1CC[C@H](N[C@@H]2CCCc3sccc32)[C@@H]2CCC[C@H]21 ZINC000353668104 529807119 /nfs/dbraw/zinc/80/71/19/529807119.db2.gz FTDGOSHKNZVOQN-DRPJVOAASA-N 1 3 290.476 3.588 20 0 CHADHO CC(C)C[C@H](N[C@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000129023012 260380902 /nfs/dbraw/zinc/38/09/02/260380902.db2.gz ZAFQNNGSXZZUPO-IRXDYDNUSA-N 1 3 260.425 3.506 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)[NH2+][C@H]2CCC[C@H](N)C2)cc1 ZINC000574290123 335007699 /nfs/dbraw/zinc/00/76/99/335007699.db2.gz HJQPJJBDGGTVHQ-JLSDUUJJSA-N 1 3 274.452 3.601 20 0 CHADHO c1ccc2c(c1)CCCC[C@H]2NCCC[NH+]1CCCC1 ZINC000020553038 171248242 /nfs/dbraw/zinc/24/82/42/171248242.db2.gz APIBGELLTQLWIX-GOSISDBHSA-N 1 3 272.436 3.530 20 0 CHADHO c1ccc2c(c1)CCCC[C@H]2[NH2+]CCCN1CCCC1 ZINC000020553038 171248244 /nfs/dbraw/zinc/24/82/44/171248244.db2.gz APIBGELLTQLWIX-GOSISDBHSA-N 1 3 272.436 3.530 20 0 CHADHO CCCCCN1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000078775213 177386043 /nfs/dbraw/zinc/38/60/43/177386043.db2.gz UEZDVZOPGUTSGG-DLBZAZTESA-N 1 3 266.473 3.763 20 0 CHADHO CCCCCN1CCC[C@@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000078775213 177386044 /nfs/dbraw/zinc/38/60/44/177386044.db2.gz UEZDVZOPGUTSGG-DLBZAZTESA-N 1 3 266.473 3.763 20 0 CHADHO CCCCC[N@@H+]1CCC[C@@H](CN2CCCC[C@@H]2C)C1 ZINC000078775213 177386045 /nfs/dbraw/zinc/38/60/45/177386045.db2.gz UEZDVZOPGUTSGG-DLBZAZTESA-N 1 3 266.473 3.763 20 0 CHADHO CCCCC[N@H+]1CCC[C@@H](CN2CCCC[C@@H]2C)C1 ZINC000078775213 177386046 /nfs/dbraw/zinc/38/60/46/177386046.db2.gz UEZDVZOPGUTSGG-DLBZAZTESA-N 1 3 266.473 3.763 20 0 CHADHO Cc1ccccc1[C@@H](CC(C)C)[NH2+]CC1=CCN(C)CC1 ZINC000344300787 225021060 /nfs/dbraw/zinc/02/10/60/225021060.db2.gz QMIXOOKKONPRAJ-LJQANCHMSA-N 1 3 286.463 3.934 20 0 CHADHO C[C@H]([NH3+])C1CCN(Cc2c(Cl)oc3ccccc32)CC1 ZINC000347117562 226032090 /nfs/dbraw/zinc/03/20/90/226032090.db2.gz UUWZGKAOWQECHT-NSHDSACASA-N 1 3 292.810 3.645 20 0 CHADHO C[C@H]1CCC[N@H+](CCCCN[C@@H]2CCCc3occc32)C1 ZINC000192677685 227261784 /nfs/dbraw/zinc/26/17/84/227261784.db2.gz JTMBPZWVAHTFEE-DOTOQJQBSA-N 1 3 290.451 3.759 20 0 CHADHO C[C@H]1CCC[N@@H+](CCCCN[C@@H]2CCCc3occc32)C1 ZINC000192677685 227261791 /nfs/dbraw/zinc/26/17/91/227261791.db2.gz JTMBPZWVAHTFEE-DOTOQJQBSA-N 1 3 290.451 3.759 20 0 CHADHO CC[C@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(Cl)cc1 ZINC000037649141 260115198 /nfs/dbraw/zinc/11/51/98/260115198.db2.gz MBWCJTLJAHBZCI-DYVFJYSZSA-N 1 3 292.854 3.865 20 0 CHADHO CC[C@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1 ZINC000037649141 260115199 /nfs/dbraw/zinc/11/51/99/260115199.db2.gz MBWCJTLJAHBZCI-DYVFJYSZSA-N 1 3 292.854 3.865 20 0 CHADHO CC[C@@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(Cl)cc1 ZINC000037649140 260115529 /nfs/dbraw/zinc/11/55/29/260115529.db2.gz MBWCJTLJAHBZCI-SUMWQHHRSA-N 1 3 292.854 3.865 20 0 CHADHO CC[C@@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1 ZINC000037649140 260115531 /nfs/dbraw/zinc/11/55/31/260115531.db2.gz MBWCJTLJAHBZCI-SUMWQHHRSA-N 1 3 292.854 3.865 20 0 CHADHO C1CCC2(C1)CCCC[C@H]2[NH2+][C@H]1CCN2CCC[C@H]2C1 ZINC000312510721 260135817 /nfs/dbraw/zinc/13/58/17/260135817.db2.gz GQUPAMMYNXXQBC-YESZJQIVSA-N 1 3 276.468 3.706 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCCC[C@H]1c1ccccc1)CN(C)C ZINC000394246687 260192909 /nfs/dbraw/zinc/19/29/09/260192909.db2.gz SPAPFVUCEVFOLM-BPQIPLTHSA-N 1 3 274.452 3.500 20 0 CHADHO C[C@@H](CCCC[NH3+])NCc1cc(Cl)sc1Cl ZINC000312755137 260197528 /nfs/dbraw/zinc/19/75/28/260197528.db2.gz BKCGIWCRTJLABS-QMMMGPOBSA-N 1 3 281.252 3.662 20 0 CHADHO CC[C@H](N[C@H]1CC[N@H+](C)[C@H](C)C1)c1cccc(Cl)c1 ZINC000091959942 260267399 /nfs/dbraw/zinc/26/73/99/260267399.db2.gz GPADXURDIJDRIU-KCXAZCMYSA-N 1 3 280.843 3.863 20 0 CHADHO CC[C@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc(Cl)c1 ZINC000091959942 260267400 /nfs/dbraw/zinc/26/74/00/260267400.db2.gz GPADXURDIJDRIU-KCXAZCMYSA-N 1 3 280.843 3.863 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000093212583 260273126 /nfs/dbraw/zinc/27/31/26/260273126.db2.gz DKEDPEYPSYGBHD-RRQGHBQHSA-N 1 3 260.425 3.731 20 0 CHADHO CC(C)(C)[C@@H](N[C@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000129012314 260380687 /nfs/dbraw/zinc/38/06/87/260380687.db2.gz AZRFESRJHKCIDK-HOTGVXAUSA-N 1 3 260.425 3.506 20 0 CHADHO C[C@H]1C[C@H](NCc2ccc(C(C)(C)C)cc2)CC[N@@H+]1C ZINC000090721266 260393259 /nfs/dbraw/zinc/39/32/59/260393259.db2.gz ODHSOFJSMAUKQW-WMLDXEAASA-N 1 3 274.452 3.556 20 0 CHADHO C[C@H]1C[C@H](NCc2ccc(C(C)(C)C)cc2)CC[N@H+]1C ZINC000090721266 260393260 /nfs/dbraw/zinc/39/32/60/260393260.db2.gz ODHSOFJSMAUKQW-WMLDXEAASA-N 1 3 274.452 3.556 20 0 CHADHO CC(C)CC(CC(C)C)[NH2+][C@@H]1CCN2CCC[C@@H]2C1 ZINC000130189949 260395022 /nfs/dbraw/zinc/39/50/22/260395022.db2.gz VIJHZOKCTOVOJG-NVXWUHKLSA-N 1 3 266.473 3.664 20 0 CHADHO CC1(C)CCCC[C@H]1[NH2+]C1CCN(c2ccncc2)CC1 ZINC000094323921 261371930 /nfs/dbraw/zinc/37/19/30/261371930.db2.gz GZDPSCQUZSEJHK-QGZVFWFLSA-N 1 3 287.451 3.609 20 0 CHADHO C[C@H](CCCC[NH3+])N[C@H](C)c1ccccc1Br ZINC000310500491 262162162 /nfs/dbraw/zinc/16/21/62/262162162.db2.gz HTIZENCTGZIJQR-VXGBXAGGSA-N 1 3 299.256 3.617 20 0 CHADHO CCCC1CCC([NH2+]CCCN(C)C(C)C)CC1 ZINC000221792288 262297106 /nfs/dbraw/zinc/29/71/06/262297106.db2.gz YJYWXCLVFNTNGT-UHFFFAOYSA-N 1 3 254.462 3.665 20 0 CHADHO Cc1cc(C)cc([C@@H](C)[NH2+]CCCN(C)C(C)C)c1 ZINC000221908848 262322902 /nfs/dbraw/zinc/32/29/02/262322902.db2.gz QXMSLETVHAJHDZ-MRXNPFEDSA-N 1 3 262.441 3.684 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H]2CS[C@H](C(C)(C)C)C2)C1 ZINC000488449050 262324616 /nfs/dbraw/zinc/32/46/16/262324616.db2.gz OMGVIBYKJAIXSW-PMPSAXMXSA-N 1 3 298.540 3.617 20 0 CHADHO CC(C)[N@@H+]1CCC[C@H](CN[C@@H]2CS[C@H](C(C)(C)C)C2)C1 ZINC000488449050 262324618 /nfs/dbraw/zinc/32/46/18/262324618.db2.gz OMGVIBYKJAIXSW-PMPSAXMXSA-N 1 3 298.540 3.617 20 0 CHADHO CC(C)[N@H+]1CCC[C@H](CN[C@@H]2CS[C@H](C(C)(C)C)C2)C1 ZINC000488449050 262324619 /nfs/dbraw/zinc/32/46/19/262324619.db2.gz OMGVIBYKJAIXSW-PMPSAXMXSA-N 1 3 298.540 3.617 20 0 CHADHO C[C@H]1C[N@H+](C)CC[C@H]1NCc1ccc(-c2ccccc2)cc1 ZINC000319700957 262350982 /nfs/dbraw/zinc/35/09/82/262350982.db2.gz TWZTVUHRUZIFTK-OXJNMPFZSA-N 1 3 294.442 3.783 20 0 CHADHO C[C@H]1C[N@@H+](C)CC[C@H]1NCc1ccc(-c2ccccc2)cc1 ZINC000319700957 262350983 /nfs/dbraw/zinc/35/09/83/262350983.db2.gz TWZTVUHRUZIFTK-OXJNMPFZSA-N 1 3 294.442 3.783 20 0 CHADHO CC[C@H]([NH2+]C1CCN(C2CCCC2)CC1)[C@@H]1CC1(C)C ZINC000414116367 262812100 /nfs/dbraw/zinc/81/21/00/262812100.db2.gz QRGCNSDKCMHIGR-IRXDYDNUSA-N 1 3 278.484 3.808 20 0 CHADHO CCCN(Cc1cccc(SCC)c1)C1CC[NH2+]CC1 ZINC000414656068 263021836 /nfs/dbraw/zinc/02/18/36/263021836.db2.gz MHSCSEDLMKHPOZ-UHFFFAOYSA-N 1 3 292.492 3.763 20 0 CHADHO CCC[N@H+](Cc1cccc(SCC)c1)C1CCNCC1 ZINC000414656068 263021837 /nfs/dbraw/zinc/02/18/37/263021837.db2.gz MHSCSEDLMKHPOZ-UHFFFAOYSA-N 1 3 292.492 3.763 20 0 CHADHO CCC[N@@H+](Cc1cccc(SCC)c1)C1CCNCC1 ZINC000414656068 263021838 /nfs/dbraw/zinc/02/18/38/263021838.db2.gz MHSCSEDLMKHPOZ-UHFFFAOYSA-N 1 3 292.492 3.763 20 0 CHADHO [NH3+][C@@H]1CCC[C@H]2CN(Cc3ccc(-c4ccccc4)o3)C[C@@H]21 ZINC000414671234 263029390 /nfs/dbraw/zinc/02/93/90/263029390.db2.gz NLEQZFIRDKOCOD-RYQLBKOJSA-N 1 3 296.414 3.506 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H]2CN(Cc3ccc(-c4ccccc4)o3)C[C@H]21 ZINC000414671231 263029467 /nfs/dbraw/zinc/02/94/67/263029467.db2.gz NLEQZFIRDKOCOD-KBAYOESNSA-N 1 3 296.414 3.506 20 0 CHADHO CCC([NH3+])(CC)CN[C@H](C)CCc1ccc(Cl)s1 ZINC000414811581 263053266 /nfs/dbraw/zinc/05/32/66/263053266.db2.gz PTTAMPVIWVMKTR-LLVKDONJSA-N 1 3 288.888 3.830 20 0 CHADHO c1ccc([C@@H]2CCCC[C@@H]([NH2+]C[C@@H]3CCCNC3)C2)cc1 ZINC000414825724 263055873 /nfs/dbraw/zinc/05/58/73/263055873.db2.gz HPDHGNGXQUAZEM-BHIYHBOVSA-N 1 3 286.463 3.692 20 0 CHADHO Clc1ccccc1[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCCNC1 ZINC000414829313 263056072 /nfs/dbraw/zinc/05/60/72/263056072.db2.gz NRBWMFXQTIEMDM-JLJPHGGASA-N 1 3 292.854 3.565 20 0 CHADHO C[C@@H](CC[NH3+])NCc1ccc(Sc2ccccc2)cc1 ZINC000414896595 263104447 /nfs/dbraw/zinc/10/44/47/263104447.db2.gz PNWABUOIHODPDD-AWEZNQCLSA-N 1 3 286.444 3.665 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCCNCC2)C[C@@H](c2ccccc2)C1 ZINC000414910699 263117235 /nfs/dbraw/zinc/11/72/35/263117235.db2.gz FXKIRCRTTZYGMD-KANFNMMFSA-N 1 3 286.463 3.691 20 0 CHADHO C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@@H]2CCC[C@@H](N)C2)C1 ZINC000414925131 263129696 /nfs/dbraw/zinc/12/96/96/263129696.db2.gz LAPAMEMQCHYMHW-IJCBKZNRSA-N 1 3 286.463 3.818 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@@H]1C[C@H](c2ccccc2)C[C@H](C)C1 ZINC000414944938 263154379 /nfs/dbraw/zinc/15/43/79/263154379.db2.gz QSUIPHKOPPICPC-CSQLCUNESA-N 1 3 286.463 3.546 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2c2ccc(Cl)cc2)CCN1 ZINC000414953866 263159441 /nfs/dbraw/zinc/15/94/41/263159441.db2.gz RZVZEXFXHYFZNJ-YYQUZTFQSA-N 1 3 292.854 3.706 20 0 CHADHO C[C@H]1CNCC[C@H]1[NH2+]Cc1ccc(-c2ccccc2)s1 ZINC000414959648 263164949 /nfs/dbraw/zinc/16/49/49/263164949.db2.gz QALNFRAQGAQKHG-XJKSGUPXSA-N 1 3 286.444 3.503 20 0 CHADHO CCCC[C@@H](C)[NH2+]C[C@@H]1CNCC[C@@H]1c1ccc(F)cc1 ZINC000414998178 263197186 /nfs/dbraw/zinc/19/71/86/263197186.db2.gz IANAHSMFDJZEEM-UWWQBHOKSA-N 1 3 292.442 3.687 20 0 CHADHO Cc1cc(C)cc(CN[C@H](CCC[NH3+])c2ccccc2)c1 ZINC000415048961 263255791 /nfs/dbraw/zinc/25/57/91/263255791.db2.gz GWINVOQWCIMHIW-LJQANCHMSA-N 1 3 282.431 3.873 20 0 CHADHO [NH3+]CCC[C@@H](NCc1ccc(F)c(F)c1)c1ccccc1 ZINC000415069032 263259426 /nfs/dbraw/zinc/25/94/26/263259426.db2.gz SAYUAIMRGDZTEK-QGZVFWFLSA-N 1 3 290.357 3.535 20 0 CHADHO Cc1ccc2cc(C[NH2+]CCCN3CCCCC3)ccc2n1 ZINC000187635835 263262426 /nfs/dbraw/zinc/26/24/26/263262426.db2.gz ZXZSEKIJBKZAAU-UHFFFAOYSA-N 1 3 297.446 3.509 20 0 CHADHO Cc1cc(N[C@@H]2CCC[C@@H]([NH+](C)C)C2)c2ccccc2n1 ZINC000301519825 265982126 /nfs/dbraw/zinc/98/21/26/265982126.db2.gz HJVIVWHFLIRWTE-HUUCEWRRSA-N 1 3 283.419 3.828 20 0 CHADHO CCN1CC[C@@H]([N@H+](C)Cc2ccc(SC)s2)C[C@H]1C ZINC000356130766 266056461 /nfs/dbraw/zinc/05/64/61/266056461.db2.gz DYGTUPBKBGXNRM-CHWSQXEVSA-N 1 3 298.521 3.775 20 0 CHADHO CCN1CC[C@@H]([N@@H+](C)Cc2ccc(SC)s2)C[C@H]1C ZINC000356130766 266056462 /nfs/dbraw/zinc/05/64/62/266056462.db2.gz DYGTUPBKBGXNRM-CHWSQXEVSA-N 1 3 298.521 3.775 20 0 CHADHO CCN1CC[C@H]([NH2+]Cc2ccc(-c3ccccc3)o2)[C@@H](C)C1 ZINC000531683892 328021091 /nfs/dbraw/zinc/02/10/91/328021091.db2.gz SEJBQIMSLBZVEA-YJBOKZPZSA-N 1 3 298.430 3.767 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000041075209 328026569 /nfs/dbraw/zinc/02/65/69/328026569.db2.gz CTKHJMYHDKYEGI-APWZRJJASA-N 1 3 286.463 3.992 20 0 CHADHO C[C@H]1CCCCN1CCC[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000041075210 328026609 /nfs/dbraw/zinc/02/66/09/328026609.db2.gz CTKHJMYHDKYEGI-LPHOPBHVSA-N 1 3 286.463 3.992 20 0 CHADHO CC[NH+]1CCC(N[C@H]2CCCc3ccc(Cl)cc32)CC1 ZINC000534236534 328039590 /nfs/dbraw/zinc/03/95/90/328039590.db2.gz XBNLCZSJHNNEEI-KRWDZBQOSA-N 1 3 292.854 3.791 20 0 CHADHO Cc1cccc([C@H](C)NCc2ccc3c(c2)C[NH2+]CC3)c1C ZINC000563542841 328072574 /nfs/dbraw/zinc/07/25/74/328072574.db2.gz MDBASEDVHOXDDD-INIZCTEOSA-N 1 3 294.442 3.800 20 0 CHADHO CC[N@@H+](C/C=C\c1ccc(F)cc1)CCCN1CCCC1 ZINC000571091296 328085877 /nfs/dbraw/zinc/08/58/77/328085877.db2.gz RMOMQPDGGDVWIF-ALCCZGGFSA-N 1 3 290.426 3.647 20 0 CHADHO CC[N@H+](C/C=C\c1ccc(F)cc1)CCCN1CCCC1 ZINC000571091296 328085878 /nfs/dbraw/zinc/08/58/78/328085878.db2.gz RMOMQPDGGDVWIF-ALCCZGGFSA-N 1 3 290.426 3.647 20 0 CHADHO CC(C)(C)c1ccc(CNCc2ccc(C[NH3+])cc2)s1 ZINC000571446413 328121786 /nfs/dbraw/zinc/12/17/86/328121786.db2.gz UYPSCYHUBVJURT-UHFFFAOYSA-N 1 3 288.460 3.794 20 0 CHADHO C[C@H]1CCCC[C@@H]1C[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000394863725 329158332 /nfs/dbraw/zinc/15/83/32/329158332.db2.gz RVYWCVJNJDMTSM-UONOGXRCSA-N 1 3 266.473 3.712 20 0 CHADHO CCC(N)(CC)C[NH2+]Cc1csc2ccccc12 ZINC000414799783 328231024 /nfs/dbraw/zinc/23/10/24/328231024.db2.gz HFBBBBAIYBJKJH-UHFFFAOYSA-N 1 3 262.422 3.508 20 0 CHADHO CC(C)C[C@H](Cc1cccc(Cl)c1)NC[C@H]([NH3+])C1CC1 ZINC000414884488 328249854 /nfs/dbraw/zinc/24/98/54/328249854.db2.gz FIWZFGFFHPMVSB-SJORKVTESA-N 1 3 294.870 3.624 20 0 CHADHO Cc1ccsc1CN[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415084335 328302873 /nfs/dbraw/zinc/30/28/73/328302873.db2.gz OTUSGAHRCXOPPJ-HZPDHXFCSA-N 1 3 286.444 3.639 20 0 CHADHO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1ccc(CN(C)C)cc1 ZINC000531944502 328323397 /nfs/dbraw/zinc/32/33/97/328323397.db2.gz XVQYUVTZQLQNGJ-HWWDLCQESA-N 1 3 274.452 3.663 20 0 CHADHO c1ccc([C@@H](CC2CC2)NC[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000531937766 328319648 /nfs/dbraw/zinc/31/96/48/328319648.db2.gz UDHUOACEFPSEIX-VQIMIIECSA-N 1 3 284.447 3.602 20 0 CHADHO c1ccc([C@@H](CC2CC2)NC[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000531937766 328319649 /nfs/dbraw/zinc/31/96/49/328319649.db2.gz UDHUOACEFPSEIX-VQIMIIECSA-N 1 3 284.447 3.602 20 0 CHADHO C[N@@H+]1CCC[C@H](CN[C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC000534973198 328372269 /nfs/dbraw/zinc/37/22/69/328372269.db2.gz BZPBISDWAUXOKP-CXAGYDPISA-N 1 3 292.854 3.649 20 0 CHADHO C[N@H+]1CCC[C@H](CN[C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC000534973198 328372271 /nfs/dbraw/zinc/37/22/71/328372271.db2.gz BZPBISDWAUXOKP-CXAGYDPISA-N 1 3 292.854 3.649 20 0 CHADHO CN1CCC[C@@H]2C[N@H+](Cc3cccc4ccccc43)CC[C@@H]21 ZINC000531988605 328383016 /nfs/dbraw/zinc/38/30/16/328383016.db2.gz LLLHCOHOUZQLPK-QUCCMNQESA-N 1 3 294.442 3.756 20 0 CHADHO CN1CCC[C@@H]2C[N@@H+](Cc3cccc4ccccc43)CC[C@@H]21 ZINC000531988605 328383017 /nfs/dbraw/zinc/38/30/17/328383017.db2.gz LLLHCOHOUZQLPK-QUCCMNQESA-N 1 3 294.442 3.756 20 0 CHADHO C[N@@H+]1CCC[C@@H]2CN(Cc3cccc4ccccc43)CC[C@@H]21 ZINC000531988605 328383018 /nfs/dbraw/zinc/38/30/18/328383018.db2.gz LLLHCOHOUZQLPK-QUCCMNQESA-N 1 3 294.442 3.756 20 0 CHADHO C[N@H+]1CCC[C@@H]2CN(Cc3cccc4ccccc43)CC[C@@H]21 ZINC000531988605 328383019 /nfs/dbraw/zinc/38/30/19/328383019.db2.gz LLLHCOHOUZQLPK-QUCCMNQESA-N 1 3 294.442 3.756 20 0 CHADHO CC1CCC([NH2+]CCCN2C[C@H](C)C[C@H](C)C2)CC1 ZINC000568930671 327024598 /nfs/dbraw/zinc/02/45/98/327024598.db2.gz ACVOWLPDUFCBIU-HPZPOOBXSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@H](c1ccccc1Cl)N(C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000261567166 327142418 /nfs/dbraw/zinc/14/24/18/327142418.db2.gz HPUOHNFHOKPNHY-MGPQQGTHSA-N 1 3 280.843 3.721 20 0 CHADHO C([NH2+]C1CCN(C2CCCCC2)CC1)C(C1CC1)C1CC1 ZINC000569411256 327174179 /nfs/dbraw/zinc/17/41/79/327174179.db2.gz WEONDAOZINYGID-UHFFFAOYSA-N 1 3 290.495 3.809 20 0 CHADHO CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000560550154 327323739 /nfs/dbraw/zinc/32/37/39/327323739.db2.gz VAXHAPCYSUGSNW-LMSBXDPUSA-N 1 3 278.484 3.664 20 0 CHADHO CC[C@H]1CC[C@@H]1[NH2+]CC1CCN(Cc2cccs2)CC1 ZINC000562019477 327440508 /nfs/dbraw/zinc/44/05/08/327440508.db2.gz LJNOMVONVSKVFS-RDJZCZTQSA-N 1 3 292.492 3.738 20 0 CHADHO C[C@H](CCC1CC1)[NH2+]C1CCN(C2CCCC2)CC1 ZINC000186374463 329343758 /nfs/dbraw/zinc/34/37/58/329343758.db2.gz JLVSQBWFNMURNF-CQSZACIVSA-N 1 3 264.457 3.562 20 0 CHADHO CC[C@H](c1ccc(F)cc1F)N1CCC(CC[NH2+]C)CC1 ZINC000262015307 329997511 /nfs/dbraw/zinc/99/75/11/329997511.db2.gz VVZFRORAMKEMPH-QGZVFWFLSA-N 1 3 296.405 3.737 20 0 CHADHO C[C@@H](CN1CCC(CC[NH3+])CC1)c1cccc(Cl)c1 ZINC000580452634 330138977 /nfs/dbraw/zinc/13/89/77/330138977.db2.gz AXVSMPXFHCETGS-ZDUSSCGKSA-N 1 3 280.843 3.504 20 0 CHADHO C[C@@H](CCC[NH3+])N[C@@H](C)c1c(Cl)ccc(F)c1Cl ZINC000422706350 330151107 /nfs/dbraw/zinc/15/11/07/330151107.db2.gz DWXBXPYRGHMABY-IUCAKERBSA-N 1 3 293.213 3.911 20 0 CHADHO [NH3+][C@H]1CCCCC[C@@H]1NCC1(c2ccc(Cl)cc2)CC1 ZINC000422703999 330151187 /nfs/dbraw/zinc/15/11/87/330151187.db2.gz OKKCLIDEBKUKMZ-HOTGVXAUSA-N 1 3 292.854 3.621 20 0 CHADHO NC[C@@H]1CCCC[C@H]1[NH2+]CCCCCOC1CCCCC1 ZINC000422710147 330151337 /nfs/dbraw/zinc/15/13/37/330151337.db2.gz LAICYMDDYLZTPN-FUHWJXTLSA-N 1 3 296.499 3.613 20 0 CHADHO c1ccc(C[C@@H]2CCCC[C@@H]2NC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000422712025 330151407 /nfs/dbraw/zinc/15/14/07/330151407.db2.gz NRQTWCVIAXYAKS-BYDNXPSSSA-N 1 3 298.474 3.661 20 0 CHADHO CC[C@H](Cc1ccccc1)N[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422713777 330151747 /nfs/dbraw/zinc/15/17/47/330151747.db2.gz QCPGGXJQSHCQPV-AYOQOUSVSA-N 1 3 280.415 3.742 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H](C)CCCC(C)C ZINC000422734167 330152881 /nfs/dbraw/zinc/15/28/81/330152881.db2.gz SCWPHHFGXBHQDY-KBPBESRZSA-N 1 3 277.456 3.714 20 0 CHADHO N[C@@H]1CCCCC[C@H]1[NH2+]Cc1csc2ccccc12 ZINC000422752364 330153202 /nfs/dbraw/zinc/15/32/02/330153202.db2.gz DYARFAJJHVTURQ-HUUCEWRRSA-N 1 3 274.433 3.651 20 0 CHADHO C[C@H](CCCC[NH3+])N[C@@H](C)c1ccc(F)cc1Cl ZINC000422752091 330153452 /nfs/dbraw/zinc/15/34/52/330153452.db2.gz GWCBWUBPQZUVLZ-MNOVXSKESA-N 1 3 272.795 3.647 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@@H]1NCC1(c2cccc(Cl)c2)CC1 ZINC000422757996 330153631 /nfs/dbraw/zinc/15/36/31/330153631.db2.gz DMBVTDWNOAZGFY-CVEARBPZSA-N 1 3 292.854 3.621 20 0 CHADHO Clc1ccc([C@@H](N[C@@H]2CCC[NH2+]CC2)C2CC2)cc1 ZINC000422761688 330153885 /nfs/dbraw/zinc/15/38/85/330153885.db2.gz MCDXQLAFRCRDOI-CVEARBPZSA-N 1 3 278.827 3.523 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCc1ccc(-c2ccccc2)cc1 ZINC000422791028 330155236 /nfs/dbraw/zinc/15/52/36/330155236.db2.gz YCRJLKSTKQQBOO-LSDHHAIUSA-N 1 3 268.404 3.569 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCc1ccc(-c2ccccc2)cc1 ZINC000422791027 330155281 /nfs/dbraw/zinc/15/52/81/330155281.db2.gz YCRJLKSTKQQBOO-HUUCEWRRSA-N 1 3 268.404 3.569 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CCCCC1CCCC1 ZINC000422798735 330155652 /nfs/dbraw/zinc/15/56/52/330155652.db2.gz SPOHOZUFXLZJBN-AWEZNQCLSA-N 1 3 289.467 3.860 20 0 CHADHO C[C@H](c1ccccc1)[C@H](C)N[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422818287 330156195 /nfs/dbraw/zinc/15/61/95/330156195.db2.gz FZXLJOACPQRDIZ-YXUGBTPSSA-N 1 3 280.415 3.913 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2CN[C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000422809880 330156206 /nfs/dbraw/zinc/15/62/06/330156206.db2.gz SOIUKBFDVNMFAB-VBSBHUPXSA-N 1 3 298.474 3.617 20 0 CHADHO CC[C@H](N[C@@H](C)C[C@H](C)[NH3+])c1ccc(Cl)cc1 ZINC000422824833 330156644 /nfs/dbraw/zinc/15/66/44/330156644.db2.gz OPQOMZZRUYBRDD-MJVIPROJSA-N 1 3 254.805 3.507 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@H](c1ccccc1F)C1CCCC1 ZINC000422869867 330158181 /nfs/dbraw/zinc/15/81/81/330158181.db2.gz AWBLMSUZBIGYNP-DCGLDWPTSA-N 1 3 278.415 3.772 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CC1(CC(C)C)CCC1 ZINC000422870202 330158297 /nfs/dbraw/zinc/15/82/97/330158297.db2.gz BMAYSMDTFKOYJL-CQSZACIVSA-N 1 3 289.467 3.716 20 0 CHADHO C[C@H](CCC[NH3+])N[C@@H](c1ccccc1)c1cccc(F)c1 ZINC000422873309 330158521 /nfs/dbraw/zinc/15/85/21/330158521.db2.gz KZECMQNLYUMCGO-KDOFPFPSSA-N 1 3 286.394 3.632 20 0 CHADHO c1ccc([C@@H]2CCCC[C@@H]2NC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000422896056 330159340 /nfs/dbraw/zinc/15/93/40/330159340.db2.gz HFBYXJKYXFULJN-VUXNLXKLSA-N 1 3 284.447 3.585 20 0 CHADHO N[C@@H]1C[C@H]([NH2+]CCc2cc3ccccc3o2)c2ccccc21 ZINC000422923898 330160628 /nfs/dbraw/zinc/16/06/28/330160628.db2.gz SYFMXFMTCSQGRU-MSOLQXFVSA-N 1 3 292.382 3.710 20 0 CHADHO CCC[C@@H]([NH2+]C1CCNCC1)c1ccc(Cl)cc1 ZINC000422930256 330161131 /nfs/dbraw/zinc/16/11/31/330161131.db2.gz SPDRVOOIGDDTPN-OAHLLOKOSA-N 1 3 266.816 3.523 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+]CCc1csc2ccccc12 ZINC000422935636 330161383 /nfs/dbraw/zinc/16/13/83/330161383.db2.gz LGXQIEKHSCMHGS-BBRMVZONSA-N 1 3 288.460 3.551 20 0 CHADHO COc1ccccc1[C@H](N[C@H](C)CCC[NH3+])c1ccccc1 ZINC000422958325 330164301 /nfs/dbraw/zinc/16/43/01/330164301.db2.gz PGSWXFJRHJPTSQ-DNVCBOLYSA-N 1 3 298.430 3.502 20 0 CHADHO C[C@@H]1CC[C@H](N[C@H]2CC[NH2+]CC[C@@H]2C)c2ccccc21 ZINC000423004504 330164932 /nfs/dbraw/zinc/16/49/32/330164932.db2.gz PGXHPVSSODKTCW-BODMPHMZSA-N 1 3 272.436 3.603 20 0 CHADHO NC[C@@H]1CCC[C@H]1[NH2+]CC1(Cc2ccccc2)CCCC1 ZINC000423049476 330167234 /nfs/dbraw/zinc/16/72/34/330167234.db2.gz XSBCGSBBYREHDY-ZWKOTPCHSA-N 1 3 286.463 3.507 20 0 CHADHO CC(C)[C@H]1CCc2ccccc2[C@@H]1NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423052519 330167499 /nfs/dbraw/zinc/16/74/99/330167499.db2.gz QOJALBLJLBRPEC-RUBXOHKTSA-N 1 3 298.474 3.819 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H](C)c1cc2ccccc2s1 ZINC000423058671 330167706 /nfs/dbraw/zinc/16/77/06/330167706.db2.gz KBXPILSWCUZMOS-QJPTWQEYSA-N 1 3 262.422 3.678 20 0 CHADHO C[C@@H](N[C@@H](C)c1cc2ccccc2s1)[C@H]1CCC[NH2+]C1 ZINC000423063219 330168029 /nfs/dbraw/zinc/16/80/29/330168029.db2.gz WAHNGQMGLQRNDK-IPYPFGDCSA-N 1 3 288.460 3.940 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)c1cc2ccccc2s1)[C@H]1CCCNC1 ZINC000423063219 330168030 /nfs/dbraw/zinc/16/80/30/330168030.db2.gz WAHNGQMGLQRNDK-IPYPFGDCSA-N 1 3 288.460 3.940 20 0 CHADHO Cc1cc(C[NH2+][C@@H]2CCC[C@@H]2N)ccc1-c1ccccc1 ZINC000423066775 330168303 /nfs/dbraw/zinc/16/83/03/330168303.db2.gz XVMPBMUZSULZSI-RBUKOAKNSA-N 1 3 280.415 3.631 20 0 CHADHO C[C@@H](N)C[C@H](C)[NH2+]C1CCC2(CCCCC2)CC1 ZINC000423076776 330168578 /nfs/dbraw/zinc/16/85/78/330168578.db2.gz ZSOBFDHLPISNEB-KGLIPLIRSA-N 1 3 252.446 3.595 20 0 CHADHO C[C@H]1CCNCC[C@@H]1[NH2+]C1CC(c2cccc(Cl)c2)C1 ZINC000423112987 330170728 /nfs/dbraw/zinc/17/07/28/330170728.db2.gz XXJBAOGUNAWYPG-XNPDXQRHSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@H]1CC[NH2+]CC[C@@H]1NC1CC(c2cccc(Cl)c2)C1 ZINC000423112987 330170730 /nfs/dbraw/zinc/17/07/30/330170730.db2.gz XXJBAOGUNAWYPG-XNPDXQRHSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@H](C[C@H]1CCCCC[NH2+]1)NCC1(C(F)(F)F)CCC1 ZINC000423111253 330170854 /nfs/dbraw/zinc/17/08/54/330170854.db2.gz QKRYYFVEYOGQFD-CHWSQXEVSA-N 1 3 292.389 3.619 20 0 CHADHO Cc1c2cc(Cl)ccc2sc1CN[C@@H](C)C1C[NH2+]C1 ZINC000423111428 330170892 /nfs/dbraw/zinc/17/08/92/330170892.db2.gz WUUCDRAELVESBP-JTQLQIEISA-N 1 3 294.851 3.561 20 0 CHADHO C[C@@H]1CCNCC[C@H]1[NH2+]C1CC(c2cccc(Cl)c2)C1 ZINC000423112984 330170913 /nfs/dbraw/zinc/17/09/13/330170913.db2.gz XXJBAOGUNAWYPG-BZVDIIDJSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@@H]1CC[NH2+]CC[C@H]1NC1CC(c2cccc(Cl)c2)C1 ZINC000423112984 330170915 /nfs/dbraw/zinc/17/09/15/330170915.db2.gz XXJBAOGUNAWYPG-BZVDIIDJSA-N 1 3 292.854 3.564 20 0 CHADHO [NH3+]C[C@@H]1CCCC[C@H]1NCc1ccc2sccc2c1 ZINC000423121864 330171285 /nfs/dbraw/zinc/17/12/85/330171285.db2.gz JLIJOVGJAZRSEI-LSDHHAIUSA-N 1 3 274.433 3.508 20 0 CHADHO CCC[C@@H]([NH2+][C@@H](C)c1ccc(CN)nc1C)C1CCCC1 ZINC000423169033 330174121 /nfs/dbraw/zinc/17/41/21/330174121.db2.gz IPTOQCNYSFKCQU-KBXCAEBGSA-N 1 3 289.467 3.858 20 0 CHADHO Cc1cccc(COc2ccc([C@@H](C)NCCC[NH3+])cc2)c1 ZINC000423178102 330174993 /nfs/dbraw/zinc/17/49/93/330174993.db2.gz KBZXIOVGQUSTAL-MRXNPFEDSA-N 1 3 298.430 3.573 20 0 CHADHO CC[C@H]([NH2+]C1CCNCC1)c1ccc2cc(OC)ccc2c1 ZINC000423178414 330175001 /nfs/dbraw/zinc/17/50/01/330175001.db2.gz FXUWUGMDVSEMJY-IBGZPJMESA-N 1 3 298.430 3.641 20 0 CHADHO Cc1ccccc1C[C@H](NCC1([NH3+])CCCCC1)C1CC1 ZINC000423179915 330175376 /nfs/dbraw/zinc/17/53/76/330175376.db2.gz MYXCESJMGDHLKG-SFHVURJKSA-N 1 3 286.463 3.567 20 0 CHADHO CC(C)[C@H](CCc1ccc(Cl)cc1)[NH2+]C1CCNCC1 ZINC000423185874 330175703 /nfs/dbraw/zinc/17/57/03/330175703.db2.gz NUBYORPLZNEUGU-KRWDZBQOSA-N 1 3 294.870 3.639 20 0 CHADHO C[C@@H](NCCC[NH3+])c1ccc(-c2ccccc2F)s1 ZINC000423185040 330175818 /nfs/dbraw/zinc/17/58/18/330175818.db2.gz UPJCLFPCXFPACH-LLVKDONJSA-N 1 3 278.396 3.554 20 0 CHADHO Clc1ccc([C@H]([NH2+]C2CCNCC2)C2CC2)cc1Cl ZINC000423194290 330176381 /nfs/dbraw/zinc/17/63/81/330176381.db2.gz XORTZFPUQHLNOG-OAHLLOKOSA-N 1 3 299.245 3.786 20 0 CHADHO Cc1ccsc1[C@H](C)[NH2+]CC1(N)CCCCCC1 ZINC000423198825 330176485 /nfs/dbraw/zinc/17/64/85/330176485.db2.gz ICUPBZUQVGUGDE-ZDUSSCGKSA-N 1 3 266.454 3.759 20 0 CHADHO C[C@H](NCC1([NH3+])CCCCCC1)[C@@H]1C[C@H]1c1ccccc1 ZINC000423202567 330176718 /nfs/dbraw/zinc/17/67/18/330176718.db2.gz RCPTXICYZQXZKI-SZMVWBNQSA-N 1 3 286.463 3.820 20 0 CHADHO CNCCC[NH2+][C@@H]1CCC[C@@H](c2ccc(Cl)cc2)C1 ZINC000423208074 330177320 /nfs/dbraw/zinc/17/73/20/330177320.db2.gz YQXKUQLQEDKBHU-GDBMZVCRSA-N 1 3 280.843 3.565 20 0 CHADHO C[NH2+]CCCN[C@@H]1CCC[C@@H](c2ccc(Cl)cc2)C1 ZINC000423208074 330177321 /nfs/dbraw/zinc/17/73/21/330177321.db2.gz YQXKUQLQEDKBHU-GDBMZVCRSA-N 1 3 280.843 3.565 20 0 CHADHO CNCCC[NH2+][C@H]1CCC[C@H](c2ccc(Cl)cc2)C1 ZINC000423208076 330177323 /nfs/dbraw/zinc/17/73/23/330177323.db2.gz YQXKUQLQEDKBHU-HOCLYGCPSA-N 1 3 280.843 3.565 20 0 CHADHO C[NH2+]CCCN[C@H]1CCC[C@H](c2ccc(Cl)cc2)C1 ZINC000423208076 330177324 /nfs/dbraw/zinc/17/73/24/330177324.db2.gz YQXKUQLQEDKBHU-HOCLYGCPSA-N 1 3 280.843 3.565 20 0 CHADHO Cc1cc(C)c([C@H](C)N[C@H](C)[C@@H]2CCC[NH2+]C2)cc1C ZINC000423210885 330178111 /nfs/dbraw/zinc/17/81/11/330178111.db2.gz GOWDQHODINRQSM-IXDOHACOSA-N 1 3 274.452 3.651 20 0 CHADHO Cc1cc(C)c([C@H](C)[NH2+][C@H](C)[C@@H]2CCCNC2)cc1C ZINC000423210885 330178113 /nfs/dbraw/zinc/17/81/13/330178113.db2.gz GOWDQHODINRQSM-IXDOHACOSA-N 1 3 274.452 3.651 20 0 CHADHO Fc1ccc([C@@H](NC[C@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC000423212725 330178300 /nfs/dbraw/zinc/17/83/00/330178300.db2.gz MEPRFVCUHALLFP-KSSFIOAISA-N 1 3 290.426 3.646 20 0 CHADHO Fc1ccc([C@@H]([NH2+]C[C@H]2CCCNC2)C2CCCC2)cc1 ZINC000423212725 330178302 /nfs/dbraw/zinc/17/83/02/330178302.db2.gz MEPRFVCUHALLFP-KSSFIOAISA-N 1 3 290.426 3.646 20 0 CHADHO C[C@@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@@H](C)c1ccc(Cl)cc1 ZINC000423212804 330178383 /nfs/dbraw/zinc/17/83/83/330178383.db2.gz KALZMWAFLCEBHU-WVKAWXBWSA-N 1 3 292.854 3.705 20 0 CHADHO CCc1ccc([C@H](CC)N[C@@H](C)[C@@H]2CCC[NH2+]C2)cc1 ZINC000423221917 330179713 /nfs/dbraw/zinc/17/97/13/330179713.db2.gz YRQZVBQNPKEVNM-QGTPRVQTSA-N 1 3 274.452 3.678 20 0 CHADHO CCc1ccc([C@H](CC)[NH2+][C@@H](C)[C@@H]2CCCNC2)cc1 ZINC000423221917 330179715 /nfs/dbraw/zinc/17/97/15/330179715.db2.gz YRQZVBQNPKEVNM-QGTPRVQTSA-N 1 3 274.452 3.678 20 0 CHADHO CC(C)[C@@H](NCC[C@H](C)[NH3+])c1cccc(C(F)(F)F)c1 ZINC000423223944 330179971 /nfs/dbraw/zinc/17/99/71/330179971.db2.gz IATYHYROUYUALO-SMDDNHRTSA-N 1 3 288.357 3.729 20 0 CHADHO C[C@@H](NCC[C@H](C)[NH3+])c1ccc(-c2ccccc2)s1 ZINC000423227412 330180393 /nfs/dbraw/zinc/18/03/93/330180393.db2.gz VPBIRUYWBQSDNE-QWHCGFSZSA-N 1 3 274.433 3.803 20 0 CHADHO C[C@@H](NCC[C@H]1CC[NH2+]C1)c1cc(Cl)ccc1Cl ZINC000423249615 330182556 /nfs/dbraw/zinc/18/25/56/330182556.db2.gz PAIVBGVLWKEHBB-GHMZBOCLSA-N 1 3 287.234 3.644 20 0 CHADHO Cc1ccsc1[C@H](C)N[C@@H](C[NH3+])C1CCCCC1 ZINC000423259162 330183551 /nfs/dbraw/zinc/18/35/51/330183551.db2.gz DDFYZWHWHORPCK-JSGCOSHPSA-N 1 3 266.454 3.615 20 0 CHADHO C[NH2+]C[C@H](C)CN[C@@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423269168 330184459 /nfs/dbraw/zinc/18/44/59/330184459.db2.gz GWCQGOTWHKVWTM-LRDDRELGSA-N 1 3 280.843 3.626 20 0 CHADHO CC(C)[C@H]([NH3+])CN[C@@H]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000423279544 330185370 /nfs/dbraw/zinc/18/53/70/330185370.db2.gz SGWSRHMTUPRFRY-FVQBIDKESA-N 1 3 280.843 3.549 20 0 CHADHO C[C@@H]([NH2+]CC(C)(C)N)c1ccc(-c2ccc(F)cc2)s1 ZINC000423288875 330186594 /nfs/dbraw/zinc/18/65/94/330186594.db2.gz VMZMFXFGSFVRBO-LLVKDONJSA-N 1 3 292.423 3.942 20 0 CHADHO CCC([NH3+])(CC)CN[C@@H]1C[C@@H](c2ccccc2)C1(C)C ZINC000423290359 330186791 /nfs/dbraw/zinc/18/67/91/330186791.db2.gz ZTYMNNZRUHHIGI-JKSUJKDBSA-N 1 3 274.452 3.676 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2cccs2)cc1 ZINC000423293201 330187722 /nfs/dbraw/zinc/18/77/22/330187722.db2.gz QGODFZZKUSYPIV-VXGBXAGGSA-N 1 3 260.406 3.619 20 0 CHADHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1cccs1 ZINC000423293199 330187823 /nfs/dbraw/zinc/18/78/23/330187823.db2.gz QGODFZZKUSYPIV-NWDGAFQWSA-N 1 3 260.406 3.619 20 0 CHADHO CCC[C@H](NC[C@H](C)C[NH3+])c1cccc(C(F)(F)F)c1 ZINC000423296098 330188314 /nfs/dbraw/zinc/18/83/14/330188314.db2.gz GCZZXACNSLVYMZ-RISCZKNCSA-N 1 3 288.357 3.731 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H]2CCCc3ccc(O)cc32)cc1 ZINC000423295167 330188385 /nfs/dbraw/zinc/18/83/85/330188385.db2.gz WHDIJLGFUAVOIL-BFUOFWGJSA-N 1 3 296.414 3.579 20 0 CHADHO C[C@@H](C[NH3+])CN[C@@H](C)c1cccc(-c2ccccc2)c1 ZINC000423297729 330188679 /nfs/dbraw/zinc/18/86/79/330188679.db2.gz LMZWXIAUGLCXGX-GJZGRUSLSA-N 1 3 268.404 3.599 20 0 CHADHO CC(C)[C@@H](NC[C@@H](C)C[NH3+])c1ccc(C(F)(F)F)cc1 ZINC000423310615 330189532 /nfs/dbraw/zinc/18/95/32/330189532.db2.gz SCGLXJBMRFOUEP-SMDDNHRTSA-N 1 3 288.357 3.587 20 0 CHADHO N[C@@H](C[NH2+][C@H](c1ccc(Cl)c(Cl)c1)C1CC1)C1CC1 ZINC000423313175 330189717 /nfs/dbraw/zinc/18/97/17/330189717.db2.gz FGWSNIGBKHQCOE-GJZGRUSLSA-N 1 3 299.245 3.771 20 0 CHADHO C[C@@H](C[NH3+])CN[C@H](c1cc2ccccc2o1)C(C)(C)C ZINC000423313711 330189722 /nfs/dbraw/zinc/18/97/22/330189722.db2.gz XGMFMRJLHACYRD-BLLLJJGKSA-N 1 3 274.408 3.704 20 0 CHADHO C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)NC[C@H]([NH3+])C1CC1 ZINC000423322196 330190424 /nfs/dbraw/zinc/19/04/24/330190424.db2.gz NVDVOAQMLGCRRF-GUYCJALGSA-N 1 3 299.462 3.551 20 0 CHADHO C[C@H]([NH2+]CC1(N)CCC1)c1ccccc1C(C)(C)C ZINC000423323405 330190795 /nfs/dbraw/zinc/19/07/95/330190795.db2.gz JJHIRQAMMVICSC-ZDUSSCGKSA-N 1 3 260.425 3.516 20 0 CHADHO CC(C)[C@@H](CCc1ccccc1)[NH2+]C[C@@]1(C)CCCNC1 ZINC000423338851 330191839 /nfs/dbraw/zinc/19/18/39/330191839.db2.gz UZSFKSFDVGBHHD-MOPGFXCFSA-N 1 3 288.479 3.623 20 0 CHADHO C[C@@H](NC[C@]1(C)CCC[NH2+]C1)c1cc2c(s1)CCCC2 ZINC000423345329 330192288 /nfs/dbraw/zinc/19/22/88/330192288.db2.gz YTNMXPUZANEJAW-CXAGYDPISA-N 1 3 292.492 3.667 20 0 CHADHO C[C@@H]([NH2+]C[C@]1(C)CCCNC1)c1cc2c(s1)CCCC2 ZINC000423345329 330192290 /nfs/dbraw/zinc/19/22/90/330192290.db2.gz YTNMXPUZANEJAW-CXAGYDPISA-N 1 3 292.492 3.667 20 0 CHADHO Cc1ccsc1[C@@H](C)NCc1ccc2c(c1)C[NH2+]C2 ZINC000423352790 330193209 /nfs/dbraw/zinc/19/32/09/330193209.db2.gz BTWIUHWPOSYHBM-GFCCVEGCSA-N 1 3 272.417 3.511 20 0 CHADHO CCc1ccc([C@@H](C)NCc2ccc3c(c2)C[NH2+]C3)cc1 ZINC000423360754 330193699 /nfs/dbraw/zinc/19/36/99/330193699.db2.gz QTGMGZMDJGZHCK-CQSZACIVSA-N 1 3 280.415 3.703 20 0 CHADHO Cc1ccc(C)c([C@H](C)NCc2ccc3c(c2)C[NH2+]C3)c1 ZINC000423362845 330194030 /nfs/dbraw/zinc/19/40/30/330194030.db2.gz TXXYZJWNSHXRRY-HNNXBMFYSA-N 1 3 280.415 3.757 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1ccc(F)c2ccccc21 ZINC000423361486 330194086 /nfs/dbraw/zinc/19/40/86/330194086.db2.gz GYPORSUZQQLHTE-MELADBBJSA-N 1 3 286.394 3.899 20 0 CHADHO CC1(C)C[C@@H](NCc2ccc3c(c2)C[NH2+]C3)c2ccccc21 ZINC000423364483 330194163 /nfs/dbraw/zinc/19/41/63/330194163.db2.gz ATYSYULSOKKQDW-LJQANCHMSA-N 1 3 292.426 3.802 20 0 CHADHO CC1(C)C[C@H](NCc2ccc3c(c2)C[NH2+]C3)c2ccccc21 ZINC000423364472 330194197 /nfs/dbraw/zinc/19/41/97/330194197.db2.gz ATYSYULSOKKQDW-IBGZPJMESA-N 1 3 292.426 3.802 20 0 CHADHO C[C@@H]1C[C@@H](N[C@@H](c2cccs2)C2CCCC2)CC[NH2+]1 ZINC000423369232 330194899 /nfs/dbraw/zinc/19/48/99/330194899.db2.gz FTSQQYYJZOQNRZ-IVMMDQJWSA-N 1 3 278.465 3.710 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@@H](c2cccs2)C2CCCC2)CCN1 ZINC000423369232 330194901 /nfs/dbraw/zinc/19/49/01/330194901.db2.gz FTSQQYYJZOQNRZ-IVMMDQJWSA-N 1 3 278.465 3.710 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@@H]([NH3+])C1)c1cccc(-c2ccncc2)c1 ZINC000423372946 330195290 /nfs/dbraw/zinc/19/52/90/330195290.db2.gz HKRNZOBCYMSKNZ-GDIGMMSISA-N 1 3 295.430 3.669 20 0 CHADHO CC(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423371499 330195323 /nfs/dbraw/zinc/19/53/23/330195323.db2.gz GJEMTMFKBZZEMG-ZWKOTPCHSA-N 1 3 272.436 3.594 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@@H]([NH3+])C1)c1cc(Cl)cc(Cl)c1 ZINC000423371512 330195332 /nfs/dbraw/zinc/19/53/32/330195332.db2.gz GJQGXTKTTTWXCI-CUOATXAZSA-N 1 3 287.234 3.914 20 0 CHADHO CCC[C@@H]([NH2+]C[C@@H](N)C1CC1)c1ccc(Cl)cc1 ZINC000423325551 330195713 /nfs/dbraw/zinc/19/57/13/330195713.db2.gz QECHFYQMCDITRD-HUUCEWRRSA-N 1 3 266.816 3.508 20 0 CHADHO CC(C)Cc1ccc([C@H](C)[NH2+][C@H]2CCN[C@H](C)C2)cc1 ZINC000423399351 330195968 /nfs/dbraw/zinc/19/59/68/330195968.db2.gz VTNVWUOSJKTIML-VKJFTORMSA-N 1 3 274.452 3.676 20 0 CHADHO C[C@H]([NH2+]Cc1ccc2c(c1)CNC2)C(C)(C)c1ccccc1 ZINC000423403836 330196440 /nfs/dbraw/zinc/19/64/40/330196440.db2.gz XIFSIYGKTZAWBD-HNNXBMFYSA-N 1 3 294.442 3.746 20 0 CHADHO Fc1ccc([C@H](NCc2ccc3c(c2)C[NH2+]C3)C2CC2)cc1 ZINC000423406611 330197083 /nfs/dbraw/zinc/19/70/83/330197083.db2.gz ZCKKCYNNJMLSJA-LJQANCHMSA-N 1 3 296.389 3.670 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1cccc(-c2ccncc2)c1 ZINC000423382425 330199271 /nfs/dbraw/zinc/19/92/71/330199271.db2.gz OXGXUSJURPUWRD-ZRGWGRIASA-N 1 3 295.430 3.540 20 0 CHADHO FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)CNC3)C1 ZINC000423389100 330199826 /nfs/dbraw/zinc/19/98/26/330199826.db2.gz NYMWIGFCMJTEEG-HUUCEWRRSA-N 1 3 298.352 3.501 20 0 CHADHO CCC[C@@H](C)[C@@H](CC)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423392291 330200434 /nfs/dbraw/zinc/20/04/34/330200434.db2.gz PXZRGWKUFSEXIT-CXAGYDPISA-N 1 3 260.425 3.594 20 0 CHADHO COc1ccc([C@H](C)N[C@@H]2CCC[C@@H]([NH3+])C2)c2ccccc12 ZINC000423394397 330200589 /nfs/dbraw/zinc/20/05/89/330200589.db2.gz RKGLEHXYAPKXIE-RRFJBIMHSA-N 1 3 298.430 3.769 20 0 CHADHO C[C@H](CCC1CCCC1)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423393001 330200701 /nfs/dbraw/zinc/20/07/01/330200701.db2.gz QHMZPLKSOZHNEI-CQSZACIVSA-N 1 3 272.436 3.738 20 0 CHADHO C[C@H](N)[C@H](C)[NH2+][C@@H](C)c1ccc(-c2ccccc2)s1 ZINC000423446998 330202314 /nfs/dbraw/zinc/20/23/14/330202314.db2.gz OLWHTZMXFFACDP-AVGNSLFASA-N 1 3 274.433 3.801 20 0 CHADHO C[C@@H](N)[C@@H](C)[NH2+][C@@H](C)c1ccc(-c2ccccc2F)s1 ZINC000423448134 330202574 /nfs/dbraw/zinc/20/25/74/330202574.db2.gz PTIWDGUHZYBTLM-UTUOFQBUSA-N 1 3 292.423 3.941 20 0 CHADHO CC(C)[C@H]([NH2+][C@H](C)[C@H](C)N)c1cccc(C(F)(F)F)c1 ZINC000423449451 330202612 /nfs/dbraw/zinc/20/26/12/330202612.db2.gz RMPAAZCJBSOMJZ-WDMOLILDSA-N 1 3 288.357 3.728 20 0 CHADHO C[C@@H](N[C@@H](C)CCC[NH3+])c1cc(Cl)sc1Cl ZINC000423465512 330204377 /nfs/dbraw/zinc/20/43/77/330204377.db2.gz WOBWCXNXMWQYAU-JGVFFNPUSA-N 1 3 281.252 3.833 20 0 CHADHO CC[C@@H](N)C[NH2+][C@@H](C)c1ccc(SC(C)C)cc1 ZINC000423465024 330204395 /nfs/dbraw/zinc/20/43/95/330204395.db2.gz MJHYRGOGLFEYLO-GXTWGEPZSA-N 1 3 266.454 3.575 20 0 CHADHO C[C@H](N)[C@H](C)[NH2+][C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423471637 330205260 /nfs/dbraw/zinc/20/52/60/330205260.db2.gz PSXHCDIXZMDBLC-ZIBATOQPSA-N 1 3 266.816 3.507 20 0 CHADHO C[C@H](NCCC[C@H]1CCC[NH2+]1)c1ccc(F)cc1Cl ZINC000423475455 330205603 /nfs/dbraw/zinc/20/56/03/330205603.db2.gz HZHPXPCSJHBGAH-AAEUAGOBSA-N 1 3 284.806 3.662 20 0 CHADHO C[C@H](N[C@H]1CC[C@H](C[NH3+])C1)c1cccc(Cl)c1Cl ZINC000423494673 330207499 /nfs/dbraw/zinc/20/74/99/330207499.db2.gz SOLVOAWQULDEMN-DCAQKATOSA-N 1 3 287.234 3.771 20 0 CHADHO Cc1ccnc([C@@H](C)N[C@H](CCC[NH3+])c2ccccc2)c1 ZINC000423501347 330208405 /nfs/dbraw/zinc/20/84/05/330208405.db2.gz CRKHJYQYLJMZFB-NVXWUHKLSA-N 1 3 283.419 3.521 20 0 CHADHO C[C@@H](N[C@@H](CCC[NH3+])c1ccccc1)c1cccs1 ZINC000423510045 330209064 /nfs/dbraw/zinc/20/90/64/330209064.db2.gz RWHUHCBEVYBSEO-HIFRSBDPSA-N 1 3 274.433 3.879 20 0 CHADHO [NH3+]CCC[C@@H](N[C@H]1CCc2cc(F)ccc21)c1ccccc1 ZINC000423513672 330209384 /nfs/dbraw/zinc/20/93/84/330209384.db2.gz VOYMUUADKMWFFA-MOPGFXCFSA-N 1 3 298.405 3.883 20 0 CHADHO CCc1cccnc1[C@H](C)N[C@H](CCC[NH3+])c1ccccc1 ZINC000423525454 330210095 /nfs/dbraw/zinc/21/00/95/330210095.db2.gz YIQPEBQSRGIXKD-MAUKXSAKSA-N 1 3 297.446 3.775 20 0 CHADHO Clc1cccc([C@H]2CC[C@H]([NH2+]CCCNC3CC3)C2)c1 ZINC000423543039 330211144 /nfs/dbraw/zinc/21/11/44/330211144.db2.gz BNZFRAFJUHPBNK-YOEHRIQHSA-N 1 3 292.854 3.708 20 0 CHADHO C[C@H]([NH2+][C@H]1CCCCNC1)c1cccc2ccccc21 ZINC000423563206 330212064 /nfs/dbraw/zinc/21/20/64/330212064.db2.gz RDHUUGZXRIMJHU-HOCLYGCPSA-N 1 3 268.404 3.633 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CCCCNC1)c1cccc2ccccc21 ZINC000423563204 330212100 /nfs/dbraw/zinc/21/21/00/330212100.db2.gz RDHUUGZXRIMJHU-GDBMZVCRSA-N 1 3 268.404 3.633 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCCCNC1)c1cccc2ccccc21 ZINC000423563205 330212242 /nfs/dbraw/zinc/21/22/42/330212242.db2.gz RDHUUGZXRIMJHU-GOEBONIOSA-N 1 3 268.404 3.633 20 0 CHADHO C[C@@H](C[NH2+]C[C@@H](C)c1ccc(F)cc1)CN1CCCCC1 ZINC000527116444 330223244 /nfs/dbraw/zinc/22/32/44/330223244.db2.gz JWLSFHUYUIGEIC-JKSUJKDBSA-N 1 3 292.442 3.641 20 0 CHADHO C[C@@H](C[NH2+]C[C@H](C)CN1CCCCC1)c1ccc(F)cc1 ZINC000527116442 330223342 /nfs/dbraw/zinc/22/33/42/330223342.db2.gz JWLSFHUYUIGEIC-HOTGVXAUSA-N 1 3 292.442 3.641 20 0 CHADHO Cc1c(C)c(C)c(CN[C@H]2CC[N@H+](C)[C@H](C)C2)c(C)c1C ZINC000536841628 330235968 /nfs/dbraw/zinc/23/59/68/330235968.db2.gz VZPLHOWOZBJPNB-XIKOKIGWSA-N 1 3 288.479 3.801 20 0 CHADHO Cc1c(C)c(C)c(CN[C@H]2CC[N@@H+](C)[C@H](C)C2)c(C)c1C ZINC000536841628 330235970 /nfs/dbraw/zinc/23/59/70/330235970.db2.gz VZPLHOWOZBJPNB-XIKOKIGWSA-N 1 3 288.479 3.801 20 0 CHADHO COc1cccc([C@H](C)[NH2+]CCCN2CCCC[C@H]2C)c1 ZINC000036122754 330249664 /nfs/dbraw/zinc/24/96/64/330249664.db2.gz FDXRLHVYSHFSOA-CVEARBPZSA-N 1 3 290.451 3.610 20 0 CHADHO c1cc2ccc(C[NH2+]C3CCN(C4CCCC4)CC3)cc2[nH]1 ZINC000527669348 330269545 /nfs/dbraw/zinc/26/95/45/330269545.db2.gz HMEFZUJXAONDMW-UHFFFAOYSA-N 1 3 297.446 3.665 20 0 CHADHO CC[C@H](CCc1ccccc1)[NH2+][C@@H]1CCN2CCC[C@@H]2C1 ZINC000527763937 330281609 /nfs/dbraw/zinc/28/16/09/330281609.db2.gz NEKCUBAMPQZCCM-GUDVDZBRSA-N 1 3 286.463 3.614 20 0 CHADHO CC[C@H](CCc1ccccc1)N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000527763937 330281610 /nfs/dbraw/zinc/28/16/10/330281610.db2.gz NEKCUBAMPQZCCM-GUDVDZBRSA-N 1 3 286.463 3.614 20 0 CHADHO CC[C@H](CCc1ccccc1)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000527763937 330281611 /nfs/dbraw/zinc/28/16/11/330281611.db2.gz NEKCUBAMPQZCCM-GUDVDZBRSA-N 1 3 286.463 3.614 20 0 CHADHO CC1CCN(CCC[NH2+]C2CC(c3ccccc3)C2)CC1 ZINC000036840536 330292015 /nfs/dbraw/zinc/29/20/15/330292015.db2.gz CSUOXJLCZLVYTO-UHFFFAOYSA-N 1 3 286.463 3.644 20 0 CHADHO CC1CC[NH+](CCCNC2CC(c3ccccc3)C2)CC1 ZINC000036840536 330292016 /nfs/dbraw/zinc/29/20/16/330292016.db2.gz CSUOXJLCZLVYTO-UHFFFAOYSA-N 1 3 286.463 3.644 20 0 CHADHO CC[NH+](CC)CCCNC1CC(c2cccc(Cl)c2)C1 ZINC000036842396 330292460 /nfs/dbraw/zinc/29/24/60/330292460.db2.gz BZEOFOJUXAXILS-UHFFFAOYSA-N 1 3 294.870 3.908 20 0 CHADHO CCN(CC)CCC[NH2+]C1CC(c2cccc(Cl)c2)C1 ZINC000036842396 330292461 /nfs/dbraw/zinc/29/24/61/330292461.db2.gz BZEOFOJUXAXILS-UHFFFAOYSA-N 1 3 294.870 3.908 20 0 CHADHO Fc1ccc(C2CC(NCCC[NH+]3CCCCC3)C2)cc1 ZINC000036843468 330293080 /nfs/dbraw/zinc/29/30/80/330293080.db2.gz YSEMTNHBYHTEDV-UHFFFAOYSA-N 1 3 290.426 3.537 20 0 CHADHO C[C@H]1CCC[C@@H](N2CCC([NH2+]CC3CC=CC3)CC2)C1 ZINC000527943375 330294078 /nfs/dbraw/zinc/29/40/78/330294078.db2.gz KCBIMJGDEKXJRE-MAUKXSAKSA-N 1 3 276.468 3.585 20 0 CHADHO CC(C)[NH+]1CCC(N[C@H](c2cccs2)C2CC2)CC1 ZINC000044298159 330327277 /nfs/dbraw/zinc/32/72/77/330327277.db2.gz NOMVOLLYQJNCEU-INIZCTEOSA-N 1 3 278.465 3.662 20 0 CHADHO C1CC1[C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@@H]2[C@H]2CCCCN2)C1 ZINC000424370044 330348323 /nfs/dbraw/zinc/34/83/23/330348323.db2.gz DFRRQRIMFJSBGM-ZRSRNVLSSA-N 1 3 290.495 3.856 20 0 CHADHO CC(C)[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1ccccc1 ZINC000537016715 330379395 /nfs/dbraw/zinc/37/93/95/330379395.db2.gz SQZGFGJAFXVMSM-KSZLIROESA-N 1 3 274.452 3.846 20 0 CHADHO CC(C)[C@H](N[C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccccc1 ZINC000537016715 330379396 /nfs/dbraw/zinc/37/93/96/330379396.db2.gz SQZGFGJAFXVMSM-KSZLIROESA-N 1 3 274.452 3.846 20 0 CHADHO C[C@H](N[C@@H]1CCCC[C@@H]1C[NH3+])c1ccc(Cl)s1 ZINC000089142297 330380765 /nfs/dbraw/zinc/38/07/65/330380765.db2.gz FTHRTAIJYPNNSH-HBNTYKKESA-N 1 3 272.845 3.570 20 0 CHADHO CC[C@H](N[C@@H]1CCC[C@@H]1C[NH3+])c1ccc(Cl)cc1 ZINC000089148650 330380887 /nfs/dbraw/zinc/38/08/87/330380887.db2.gz UNFMLHQVANSRCL-VHDGCEQUSA-N 1 3 266.816 3.508 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCC[C@@H]1c1ccccc1Cl)CN(C)C ZINC000425939319 330498803 /nfs/dbraw/zinc/49/88/03/330498803.db2.gz ZRNMTEMMPBUUHL-UNEWFSDZSA-N 1 3 294.870 3.763 20 0 CHADHO CC[NH+]1CCC(CCN[C@H](C)c2cc(C)oc2C)CC1 ZINC000447563491 330870240 /nfs/dbraw/zinc/87/02/40/330870240.db2.gz QCLLFMZBSHNFOK-CQSZACIVSA-N 1 3 278.440 3.669 20 0 CHADHO C(C1CCCC1)N1CCC([NH2+][C@H]2CCCC23CCC3)CC1 ZINC000449103453 330899211 /nfs/dbraw/zinc/89/92/11/330899211.db2.gz AWSHSFKUAAJULL-SFHVURJKSA-N 1 3 290.495 3.953 20 0 CHADHO C[C@@H]([NH2+]CC[C@H]1CCCN1C)c1cccc(C2CC2)c1 ZINC000451108993 331015735 /nfs/dbraw/zinc/01/57/35/331015735.db2.gz AYXOLXYLGUJHFN-RDTXWAMCSA-N 1 3 272.436 3.699 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H]2CC[C@H](C)c3ccsc32)C1 ZINC000453069670 331086309 /nfs/dbraw/zinc/08/63/09/331086309.db2.gz UHMJGMCEUASMER-GZBFAFLISA-N 1 3 278.465 3.618 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H]2CC[C@H](C)c3ccsc32)C1 ZINC000453069670 331086310 /nfs/dbraw/zinc/08/63/10/331086310.db2.gz UHMJGMCEUASMER-GZBFAFLISA-N 1 3 278.465 3.618 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H]2CC[C@H](C)c3ccsc32)C1 ZINC000453069670 331086311 /nfs/dbraw/zinc/08/63/11/331086311.db2.gz UHMJGMCEUASMER-GZBFAFLISA-N 1 3 278.465 3.618 20 0 CHADHO Cc1cc([C@@H](C)NCc2ccc(C[NH+](C)C)cc2)cs1 ZINC000453102482 331089285 /nfs/dbraw/zinc/08/92/85/331089285.db2.gz ZNZUFMLUYMKLJP-CQSZACIVSA-N 1 3 288.460 3.969 20 0 CHADHO C1CC1[C@H]([NH2+]C1CCN(C2CCCC2)CC1)C1CCC1 ZINC000453140641 331093351 /nfs/dbraw/zinc/09/33/51/331093351.db2.gz SAGMBFVZHVVOQU-GOSISDBHSA-N 1 3 276.468 3.562 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)CCc2cccc(Cl)c2)C[C@@H]1C ZINC000459385504 331279387 /nfs/dbraw/zinc/27/93/87/331279387.db2.gz YPNDSKUYMQCEET-YOEHRIQHSA-N 1 3 294.870 3.687 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)CCc2cccc(Cl)c2)C[C@@H]1C ZINC000459385504 331279388 /nfs/dbraw/zinc/27/93/88/331279388.db2.gz YPNDSKUYMQCEET-YOEHRIQHSA-N 1 3 294.870 3.687 20 0 CHADHO CC(C)(C)CCCC[NH2+]C1CCN(c2ccncc2)CC1 ZINC000459411023 331280418 /nfs/dbraw/zinc/28/04/18/331280418.db2.gz PZZGHGKDEDNNQL-UHFFFAOYSA-N 1 3 289.467 3.856 20 0 CHADHO c1cc(N2CCC([NH2+][C@@H]3CC[C@H]4CCC[C@@H]4C3)CC2)ccn1 ZINC000459419798 331280519 /nfs/dbraw/zinc/28/05/19/331280519.db2.gz XJQOFCNJEVNXJD-JFIYKMOQSA-N 1 3 299.462 3.609 20 0 CHADHO CCC[C@@H]([NH2+]C1CCN(c2ccncc2)CC1)C(C)(C)C ZINC000459567749 331288329 /nfs/dbraw/zinc/28/83/29/331288329.db2.gz AKADNKJDCIZQLC-QGZVFWFLSA-N 1 3 289.467 3.855 20 0 CHADHO CC1(C)[C@@H](CN[C@H]2CC[N@@H+]3CCC[C@@H]3C2)[C@@H]1c1ccccc1 ZINC000459724435 331295851 /nfs/dbraw/zinc/29/58/51/331295851.db2.gz YSLFIJXYYHYBQG-RDGPPVDQSA-N 1 3 298.474 3.643 20 0 CHADHO CC1(C)[C@@H](CN[C@H]2CC[N@H+]3CCC[C@@H]3C2)[C@@H]1c1ccccc1 ZINC000459724435 331295852 /nfs/dbraw/zinc/29/58/52/331295852.db2.gz YSLFIJXYYHYBQG-RDGPPVDQSA-N 1 3 298.474 3.643 20 0 CHADHO CC[NH+](CC)C[C@@H]1CCN(CCC2CCCCC2)C1 ZINC000464782685 331368163 /nfs/dbraw/zinc/36/81/63/331368163.db2.gz ZJYJLQVIPPHSCT-KRWDZBQOSA-N 1 3 266.473 3.621 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](CCC2CCCCC2)C1 ZINC000464782685 331368164 /nfs/dbraw/zinc/36/81/64/331368164.db2.gz ZJYJLQVIPPHSCT-KRWDZBQOSA-N 1 3 266.473 3.621 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](CCC2CCCCC2)C1 ZINC000464782685 331368165 /nfs/dbraw/zinc/36/81/65/331368165.db2.gz ZJYJLQVIPPHSCT-KRWDZBQOSA-N 1 3 266.473 3.621 20 0 CHADHO CCc1cccc(CN2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000468891210 331441838 /nfs/dbraw/zinc/44/18/38/331441838.db2.gz IJKOMUXNXRPKIR-UHFFFAOYSA-N 1 3 286.463 3.557 20 0 CHADHO CC(C)(C[NH2+][C@H]1CCC[C@H](C2CC2)C1)CN1CCCC1 ZINC000477939248 331695135 /nfs/dbraw/zinc/69/51/35/331695135.db2.gz FENCSMBWDPVUHC-IRXDYDNUSA-N 1 3 278.484 3.667 20 0 CHADHO CC(C)=CCC[NH2+][C@H](C)c1ccc(OCCN(C)C)cc1 ZINC000479302964 331724235 /nfs/dbraw/zinc/72/42/35/331724235.db2.gz VUOOZXBUPXEIKA-MRXNPFEDSA-N 1 3 290.451 3.634 20 0 CHADHO C[C@H]1CCC[C@H](C)C1[NH2+]Cc1cccc(CN(C)C)c1 ZINC000480260746 331764942 /nfs/dbraw/zinc/76/49/42/331764942.db2.gz UIBZNZHOIHYYFU-GJZGRUSLSA-N 1 3 274.452 3.663 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)C(C)(C)c1ccccc1 ZINC000484485113 331899780 /nfs/dbraw/zinc/89/97/80/331899780.db2.gz IWMPBTGSFNZQNY-CGTJXYLNSA-N 1 3 288.479 3.815 20 0 CHADHO CC[C@@]1(C)CCN(CCC[N@@H+]2CC[C@](C)(CC)C2)C1 ZINC000489297758 332045827 /nfs/dbraw/zinc/04/58/27/332045827.db2.gz VOXANJWXDKMFNV-IRXDYDNUSA-N 1 3 266.473 3.621 20 0 CHADHO CC[C@@]1(C)CCN(CCC[N@H+]2CC[C@](C)(CC)C2)C1 ZINC000489297758 332045829 /nfs/dbraw/zinc/04/58/29/332045829.db2.gz VOXANJWXDKMFNV-IRXDYDNUSA-N 1 3 266.473 3.621 20 0 CHADHO c1cc2c(cc1C[NH2+]C1CC(N3CCCCC3)C1)CCCC2 ZINC000491347439 332194076 /nfs/dbraw/zinc/19/40/76/332194076.db2.gz PTILWLOHIZRZGH-UHFFFAOYSA-N 1 3 298.474 3.672 20 0 CHADHO CC(C)C[C@@H](C)C[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000305997052 333003175 /nfs/dbraw/zinc/00/31/75/333003175.db2.gz UMQGSUKRTLKLGR-CQSZACIVSA-N 1 3 254.462 3.521 20 0 CHADHO CN(C)[C@@H]1CCC[N@H+](Cc2ccc(C3CCC3)cc2)CC1 ZINC000513246851 333010914 /nfs/dbraw/zinc/01/09/14/333010914.db2.gz DQGQEAMJHLFYTC-LJQANCHMSA-N 1 3 286.463 3.870 20 0 CHADHO CN(C)[C@@H]1CCC[N@@H+](Cc2ccc(C3CCC3)cc2)CC1 ZINC000513246851 333010915 /nfs/dbraw/zinc/01/09/15/333010915.db2.gz DQGQEAMJHLFYTC-LJQANCHMSA-N 1 3 286.463 3.870 20 0 CHADHO CCN(CC)CCC[N@@H+]1CC[C@H](c2ccccc2C)C1 ZINC000513893362 333047700 /nfs/dbraw/zinc/04/77/00/333047700.db2.gz RUOSILSGLHQGSJ-KRWDZBQOSA-N 1 3 274.452 3.516 20 0 CHADHO CCN(CC)CCC[N@H+]1CC[C@H](c2ccccc2C)C1 ZINC000513893362 333047702 /nfs/dbraw/zinc/04/77/02/333047702.db2.gz RUOSILSGLHQGSJ-KRWDZBQOSA-N 1 3 274.452 3.516 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1)C1CC1 ZINC000310019495 333052896 /nfs/dbraw/zinc/05/28/96/333052896.db2.gz QLXWCOULYWROTP-AEFFLSMTSA-N 1 3 286.463 3.677 20 0 CHADHO C[C@H](C[NH2+][C@H](C)CCC(C)(C)C)CN1CCCC1 ZINC000310892981 333062546 /nfs/dbraw/zinc/06/25/46/333062546.db2.gz YVDQPWCDNQXAPC-HUUCEWRRSA-N 1 3 254.462 3.523 20 0 CHADHO CSc1ccc([C@@H](C)NCc2ccc(C[NH3+])cc2)cc1 ZINC000517031738 333090378 /nfs/dbraw/zinc/09/03/78/333090378.db2.gz YLTUEPYEQFCEKL-CYBMUJFWSA-N 1 3 286.444 3.718 20 0 CHADHO Cc1ccccc1C1CC(NCCC[N@@H+](C)C(C)C)C1 ZINC000228812999 333297209 /nfs/dbraw/zinc/29/72/09/333297209.db2.gz QPDTXLWKJOHMOX-UHFFFAOYSA-N 1 3 274.452 3.561 20 0 CHADHO Cc1ccccc1C1CC(NCCC[N@H+](C)C(C)C)C1 ZINC000228812999 333297211 /nfs/dbraw/zinc/29/72/11/333297211.db2.gz QPDTXLWKJOHMOX-UHFFFAOYSA-N 1 3 274.452 3.561 20 0 CHADHO Cc1ccccc1C1CC([NH2+]CCCN(C)C(C)C)C1 ZINC000228812999 333297212 /nfs/dbraw/zinc/29/72/12/333297212.db2.gz QPDTXLWKJOHMOX-UHFFFAOYSA-N 1 3 274.452 3.561 20 0 CHADHO c1cc2c(s1)CCC[C@@H]2N[C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000250172407 333303064 /nfs/dbraw/zinc/30/30/64/333303064.db2.gz MJXZEOSNXMFYOX-MIGQKNRLSA-N 1 3 290.476 3.636 20 0 CHADHO C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000235297015 333367495 /nfs/dbraw/zinc/36/74/95/333367495.db2.gz IAFRWLKTRUUBAS-TZMCWYRMSA-N 1 3 266.473 3.710 20 0 CHADHO CC[C@H](C)C[C@H](CC)[NH2+]CCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000539074063 333655368 /nfs/dbraw/zinc/65/53/68/333655368.db2.gz TXIDWQVVZQGFBX-MLHJIOFPSA-N 1 3 298.515 3.680 20 0 CHADHO CC(C)CCC[C@H](C)[NH2+]CCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000540169129 333717286 /nfs/dbraw/zinc/71/72/86/333717286.db2.gz DAUKKPZHXBLKSI-BZSNNMDCSA-N 1 3 298.515 3.680 20 0 CHADHO C[C@H]([NH2+]CC1(CN(C)C)CCCC1)c1cc(F)cc(F)c1 ZINC000546932079 334055872 /nfs/dbraw/zinc/05/58/72/334055872.db2.gz LLEIFPOCFZQWFF-ZDUSSCGKSA-N 1 3 296.405 3.737 20 0 CHADHO CC(C)CC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000564318906 334083801 /nfs/dbraw/zinc/08/38/01/334083801.db2.gz LRSUCJQEEYJEIQ-BZSNNMDCSA-N 1 3 280.500 3.911 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](C)c2ccc(SC)cc2)C1 ZINC000245467806 334195510 /nfs/dbraw/zinc/19/55/10/334195510.db2.gz SNJMXKWEOCMGMS-HUUCEWRRSA-N 1 3 292.492 3.791 20 0 CHADHO CC1(C)CC([NH2+][C@H]2CCC[C@H](C3CC3)C2)CC(C)(C)N1 ZINC000081625774 334200959 /nfs/dbraw/zinc/20/09/59/334200959.db2.gz KDLQVGYITWPBDT-GJZGRUSLSA-N 1 3 278.484 3.854 20 0 CHADHO C[C@@H]1C[C@@H](N[C@H](c2ccc(F)cc2)C(C)(C)C)CC[N@@H+]1C ZINC000247065316 334274840 /nfs/dbraw/zinc/27/48/40/334274840.db2.gz PUUMSKAMCQQZLR-XOKHGSTOSA-N 1 3 292.442 3.985 20 0 CHADHO C[C@@H]1C[C@@H](N[C@H](c2ccc(F)cc2)C(C)(C)C)CC[N@H+]1C ZINC000247065316 334274842 /nfs/dbraw/zinc/27/48/42/334274842.db2.gz PUUMSKAMCQQZLR-XOKHGSTOSA-N 1 3 292.442 3.985 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1cccs1 ZINC000247070343 334275001 /nfs/dbraw/zinc/27/50/01/334275001.db2.gz MYSIJURSYBYKMM-MJBXVCDLSA-N 1 3 266.454 3.662 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+](C[C@H](C)Cc2ccccc2)C1 ZINC000248573012 334306584 /nfs/dbraw/zinc/30/65/84/334306584.db2.gz MOOVHOFWSOLDME-MJGOQNOKSA-N 1 3 288.479 3.529 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+](C[C@H](C)Cc2ccccc2)C1 ZINC000248573012 334306585 /nfs/dbraw/zinc/30/65/85/334306585.db2.gz MOOVHOFWSOLDME-MJGOQNOKSA-N 1 3 288.479 3.529 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN(C[C@H](C)Cc2ccccc2)C1 ZINC000248573012 334306586 /nfs/dbraw/zinc/30/65/86/334306586.db2.gz MOOVHOFWSOLDME-MJGOQNOKSA-N 1 3 288.479 3.529 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN(C[C@H](C)Cc2ccccc2)C1 ZINC000248573012 334306587 /nfs/dbraw/zinc/30/65/87/334306587.db2.gz MOOVHOFWSOLDME-MJGOQNOKSA-N 1 3 288.479 3.529 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H]2CC(C)(C)C[C@H]2C)C1 ZINC000248858818 334319940 /nfs/dbraw/zinc/31/99/40/334319940.db2.gz LSBLBWSLDWCSGE-OAGGEKHMSA-N 1 3 266.473 3.521 20 0 CHADHO c1ccc2c(c1)CCCC[C@@H]2N[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000250529941 334345797 /nfs/dbraw/zinc/34/57/97/334345797.db2.gz KGYBEUXMEKWTNH-AOIWGVFYSA-N 1 3 284.447 3.671 20 0 CHADHO c1ccc2c(c1)CCCC[C@@H]2N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000250529941 334345799 /nfs/dbraw/zinc/34/57/99/334345799.db2.gz KGYBEUXMEKWTNH-AOIWGVFYSA-N 1 3 284.447 3.671 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)N1CC[C@H]([NH3+])[C@H](C)C1 ZINC000251608402 334365254 /nfs/dbraw/zinc/36/52/54/334365254.db2.gz DJNCNITVVJWAKN-LBTNJELSSA-N 1 3 268.404 3.570 20 0 CHADHO C[C@H]1CN(Cc2ccc(-c3ccccc3)cc2)CC[C@H]1[NH3+] ZINC000251676226 334366646 /nfs/dbraw/zinc/36/66/46/334366646.db2.gz HOZPSIKIMBSFJW-HNAYVOBHSA-N 1 3 280.415 3.523 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@@H](c2ccccc2)C(C)C)C1 ZINC000091305981 334376033 /nfs/dbraw/zinc/37/60/33/334376033.db2.gz KOWXAGZKQLBOGK-FUHWJXTLSA-N 1 3 274.452 3.705 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@@H](c2ccccc2)C(C)C)C1 ZINC000091305981 334376034 /nfs/dbraw/zinc/37/60/34/334376034.db2.gz KOWXAGZKQLBOGK-FUHWJXTLSA-N 1 3 274.452 3.705 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H](c2ccccc2)C(C)C)C1 ZINC000091305981 334376035 /nfs/dbraw/zinc/37/60/35/334376035.db2.gz KOWXAGZKQLBOGK-FUHWJXTLSA-N 1 3 274.452 3.705 20 0 CHADHO C1=C(CC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCCN2)CCCC1 ZINC000252658324 334384266 /nfs/dbraw/zinc/38/42/66/334384266.db2.gz YPZCODHOTFPPOF-RCCFBDPRSA-N 1 3 276.468 3.777 20 0 CHADHO Cc1cc(N[C@H]2CC[N@@H+]3CCC[C@H]3C2)c2ccccc2n1 ZINC000252672769 334384843 /nfs/dbraw/zinc/38/48/43/334384843.db2.gz CLCRTMQQNNFDOG-GJZGRUSLSA-N 1 3 281.403 3.582 20 0 CHADHO Cc1cc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc2n1 ZINC000252672769 334384844 /nfs/dbraw/zinc/38/48/44/334384844.db2.gz CLCRTMQQNNFDOG-GJZGRUSLSA-N 1 3 281.403 3.582 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000252711954 334386028 /nfs/dbraw/zinc/38/60/28/334386028.db2.gz LAMSXIJRCYUMQY-KDOFPFPSSA-N 1 3 290.426 3.667 20 0 CHADHO C([NH2+]C1CCN(C2CCCC2)CC1)C1CCCCCC1 ZINC000553518170 334389575 /nfs/dbraw/zinc/38/95/75/334389575.db2.gz RACREGHAJMCRLU-UHFFFAOYSA-N 1 3 278.484 3.953 20 0 CHADHO [NH3+]Cc1ccc(CN[C@@H]2CCc3ccc(Cl)cc32)cc1 ZINC000567049321 334676457 /nfs/dbraw/zinc/67/64/57/334676457.db2.gz NFYGQHRNMCJWQC-QGZVFWFLSA-N 1 3 286.806 3.576 20 0 CHADHO Cc1cccc([C@@H](C)NCc2ccc(C[NH3+])cc2)c1C ZINC000576399541 335198898 /nfs/dbraw/zinc/19/88/98/335198898.db2.gz RPLMJCZABGFBGO-OAHLLOKOSA-N 1 3 268.404 3.613 20 0 CHADHO C[C@H](N[C@@H]1CCCC[C@H]1C[NH3+])c1ccc(Cl)c(F)c1 ZINC000577481853 335356977 /nfs/dbraw/zinc/35/69/77/335356977.db2.gz HMXYCRQJFSRBRK-ITDIGPHOSA-N 1 3 284.806 3.647 20 0 CHADHO CCC(C)(C)[C@H](C)[NH2+]CC1(N)C2CC3CC(C2)CC1C3 ZINC000578878134 335683749 /nfs/dbraw/zinc/68/37/49/335683749.db2.gz KXSOPOPUYGVGQN-UCRBLCQZSA-N 1 3 278.484 3.554 20 0 CHADHO C[C@H](CC[NH2+]Cc1cccc2cc[nH]c21)N1CCCCC1 ZINC000344371144 533940646 /nfs/dbraw/zinc/94/06/46/533940646.db2.gz DOLKYVBFBDQTPL-OAHLLOKOSA-N 1 3 285.435 3.522 20 0 CHADHO CC[NH+]1CCC(CCN[C@H](C)c2ccc(Cl)cn2)CC1 ZINC000274970415 521550213 /nfs/dbraw/zinc/55/02/13/521550213.db2.gz YCVAOJBCMGRXSP-CYBMUJFWSA-N 1 3 295.858 3.508 20 0 CHADHO CCN1CC[C@H](C[NH2+]C2CC(c3ccc(Cl)cc3)C2)C1 ZINC000037644377 521717330 /nfs/dbraw/zinc/71/73/30/521717330.db2.gz BSPJABYFHHNXSH-BZOOQXSSSA-N 1 3 292.854 3.517 20 0 CHADHO C[C@H](CN[C@@H]1C[C@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000157274535 524501753 /nfs/dbraw/zinc/50/17/53/524501753.db2.gz QWNBHUWNJIZEIK-JEBQAFNWSA-N 1 3 266.388 3.525 20 0 CHADHO C[C@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1ccc(F)cc1 ZINC000037786295 525293816 /nfs/dbraw/zinc/29/38/16/525293816.db2.gz UARJHAJKQZOMIP-ZDUSSCGKSA-N 1 3 278.415 3.739 20 0 CHADHO C[C@H](N[C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc2ccccc2c1 ZINC000093978077 525567602 /nfs/dbraw/zinc/56/76/02/525567602.db2.gz ZCEYHYFIYXPBTR-YZVOILCLSA-N 1 3 282.431 3.973 20 0 CHADHO C[C@H](N[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc2ccccc2c1 ZINC000093978077 525567610 /nfs/dbraw/zinc/56/76/10/525567610.db2.gz ZCEYHYFIYXPBTR-YZVOILCLSA-N 1 3 282.431 3.973 20 0 CHADHO CSc1ccc([C@@H](C)NC[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000037649186 526060188 /nfs/dbraw/zinc/06/01/88/526060188.db2.gz NCEYQEHAFMBTIF-ZIAGYGMSSA-N 1 3 290.476 3.543 20 0 CHADHO CSc1ccc([C@@H](C)NC[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000037649186 526060193 /nfs/dbraw/zinc/06/01/93/526060193.db2.gz NCEYQEHAFMBTIF-ZIAGYGMSSA-N 1 3 290.476 3.543 20 0 CHADHO CC(C)C[N@@H+]1CCC2(C1)CCN(Cc1ccccc1)CC2 ZINC000353640914 527962848 /nfs/dbraw/zinc/96/28/48/527962848.db2.gz CYPFMDYSHXHXJA-UHFFFAOYSA-N 1 3 286.463 3.631 20 0 CHADHO CC(C)C[N@H+]1CCC2(C1)CCN(Cc1ccccc1)CC2 ZINC000353640914 527962853 /nfs/dbraw/zinc/96/28/53/527962853.db2.gz CYPFMDYSHXHXJA-UHFFFAOYSA-N 1 3 286.463 3.631 20 0 CHADHO CCc1ccc([C@@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)N3C)o1 ZINC000126803317 1125457554 /nfs/dbraw/zinc/45/75/54/1125457554.db2.gz GECMXYUESLGACI-FFHGMXDLSA-N 1 3 276.424 3.508 20 0 CHADHO CCCCCC[C@@H](C)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246252867 1131433761 /nfs/dbraw/zinc/43/37/61/1131433761.db2.gz XSUINFGFLVFAEI-WCVJEAGWSA-N 1 3 252.446 3.608 20 0 CHADHO CC[C@H](N[C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1 ZINC000623384663 1117847108 /nfs/dbraw/zinc/84/71/08/1117847108.db2.gz CLARFDOECNKVLE-CVEARBPZSA-N 1 3 260.425 3.600 20 0 CHADHO CC[C@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1 ZINC000623384663 1117847113 /nfs/dbraw/zinc/84/71/13/1117847113.db2.gz CLARFDOECNKVLE-CVEARBPZSA-N 1 3 260.425 3.600 20 0 CHADHO CC[C@H]([NH2+]C1CCN(CC(C)C)CC1)c1ccc(F)cc1 ZINC000131223282 1125489176 /nfs/dbraw/zinc/48/91/76/1125489176.db2.gz WJEHVPHHDSVXKJ-SFHVURJKSA-N 1 3 292.442 3.987 20 0 CHADHO C[C@H]1C[C@@H]([NH2+]C[C@@H]2CCCCN(C)C2)CC(C)(C)C1 ZINC000708787059 1119844937 /nfs/dbraw/zinc/84/49/37/1119844937.db2.gz FMYWRDVMSYNCKW-HRCADAONSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+]C1CCC2(CC2)CC1 ZINC000362918492 1120191386 /nfs/dbraw/zinc/19/13/86/1120191386.db2.gz NRJOEIQLWGKUBT-OAHLLOKOSA-N 1 3 264.457 3.563 20 0 CHADHO CC[C@@H]([NH2+]CC[C@H]1CCCN1C)c1ccc(Cl)s1 ZINC000543484583 1120533856 /nfs/dbraw/zinc/53/38/56/1120533856.db2.gz CMUJEKUHXLBRFB-VXGBXAGGSA-N 1 3 286.872 3.927 20 0 CHADHO CC(C)=CCC[C@@H](C)[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663467860 1120981870 /nfs/dbraw/zinc/98/18/70/1120981870.db2.gz IIMJNEXYMLJVTI-SJLPKXTDSA-N 1 3 278.484 3.833 20 0 CHADHO CCC[N@H+](C[C@@H](C)N)[C@H](C)c1cc2ccccc2o1 ZINC000420295784 1121995670 /nfs/dbraw/zinc/99/56/70/1121995670.db2.gz ASNVLDYBTLLFRE-CHWSQXEVSA-N 1 3 260.381 3.553 20 0 CHADHO CCC[N@@H+](C[C@@H](C)N)[C@H](C)c1cc2ccccc2o1 ZINC000420295784 1121995676 /nfs/dbraw/zinc/99/56/76/1121995676.db2.gz ASNVLDYBTLLFRE-CHWSQXEVSA-N 1 3 260.381 3.553 20 0 CHADHO CCCCCC[C@H](CCC)[NH2+][C@@H](C(C)C)C1CNC1 ZINC001246512630 1131538997 /nfs/dbraw/zinc/53/89/97/1131538997.db2.gz BBVBKBWAAYGWTA-IRXDYDNUSA-N 1 3 268.489 3.959 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1ccc(OC)cc1 ZINC000247181433 1125654314 /nfs/dbraw/zinc/65/43/14/1125654314.db2.gz TYGSQPNSNKVXHS-JZXOWHBKSA-N 1 3 290.451 3.609 20 0 CHADHO C[C@@H]1CCC[C@H](C[NH2+]C2CCN(C(C)(C)C)CC2)[C@H]1C ZINC000481988400 1126736256 /nfs/dbraw/zinc/73/62/56/1126736256.db2.gz FPCILKNWZGMYKM-OWCLPIDISA-N 1 3 280.500 3.911 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H]2CCc3c2cccc3F)C1 ZINC000482358663 1126752561 /nfs/dbraw/zinc/75/25/61/1126752561.db2.gz OTNVLTJEAUEFAU-KDOFPFPSSA-N 1 3 290.426 3.523 20 0 CHADHO CN1CCCC[C@@H]1CC[N@H+](C)[C@H]1CCc2ccc(F)cc21 ZINC000483062961 1126766345 /nfs/dbraw/zinc/76/63/45/1126766345.db2.gz LFMSEUISFLKLOZ-AEFFLSMTSA-N 1 3 290.426 3.619 20 0 CHADHO CN1CCCC[C@@H]1CC[N@@H+](C)[C@H]1CCc2ccc(F)cc21 ZINC000483062961 1126766347 /nfs/dbraw/zinc/76/63/47/1126766347.db2.gz LFMSEUISFLKLOZ-AEFFLSMTSA-N 1 3 290.426 3.619 20 0 CHADHO C[NH+](C)CC[C@@H](N[C@@H]1CCc2cc(F)ccc21)C(C)(C)C ZINC000483175386 1126771170 /nfs/dbraw/zinc/77/11/70/1126771170.db2.gz ICWCYXJIJZJTIS-IAGOWNOFSA-N 1 3 292.442 3.769 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN(CCCC2CCCC2)C1 ZINC000483238379 1126774396 /nfs/dbraw/zinc/77/43/96/1126774396.db2.gz CPGPZXWZYYZTCL-QGZVFWFLSA-N 1 3 266.473 3.621 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN(CCCC2CCCC2)C1 ZINC000483238379 1126774398 /nfs/dbraw/zinc/77/43/98/1126774398.db2.gz CPGPZXWZYYZTCL-QGZVFWFLSA-N 1 3 266.473 3.621 20 0 CHADHO Cc1cc([C@H](C)N[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc(C)c1F ZINC000483735166 1126799498 /nfs/dbraw/zinc/79/94/98/1126799498.db2.gz VNILHATXDHFHCC-OFQRWUPVSA-N 1 3 278.415 3.576 20 0 CHADHO Cc1cc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc(C)c1F ZINC000483735166 1126799501 /nfs/dbraw/zinc/79/95/01/1126799501.db2.gz VNILHATXDHFHCC-OFQRWUPVSA-N 1 3 278.415 3.576 20 0 CHADHO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)cc1C ZINC000484483616 1126821471 /nfs/dbraw/zinc/82/14/71/1126821471.db2.gz ADLAYILWHOBZSU-CGTJXYLNSA-N 1 3 274.452 3.827 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+][C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000484625113 1126837002 /nfs/dbraw/zinc/83/70/02/1126837002.db2.gz SXDGXSPXRPJMFB-GUDVDZBRSA-N 1 3 286.463 3.787 20 0 CHADHO C[C@H](c1ccc(Cl)cc1Cl)N(C)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904308595 1126844041 /nfs/dbraw/zinc/84/40/41/1126844041.db2.gz SLIZTRCJVFHMPA-FOGDFJRCSA-N 1 3 287.234 3.724 20 0 CHADHO CC(C)CC[C@H](C)N1CCC([NH+]2CCC(F)CC2)CC1 ZINC001256371927 1130639172 /nfs/dbraw/zinc/63/91/72/1130639172.db2.gz WXDVCWQBTHNAIU-HNNXBMFYSA-N 1 3 284.463 3.709 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@H](C)c1cccc(-c2ccncc2)c1 ZINC000268807060 1127024867 /nfs/dbraw/zinc/02/48/67/1127024867.db2.gz ABNFGWWOIOFAMD-HZPDHXFCSA-N 1 3 297.446 3.739 20 0 CHADHO Cc1ccc([C@H](C)NC2CC[NH+](C3CCC3)CC2)s1 ZINC000269059446 1127034645 /nfs/dbraw/zinc/03/46/45/1127034645.db2.gz XLNVNQANWJVDRD-ZDUSSCGKSA-N 1 3 278.465 3.724 20 0 CHADHO CCN(Cc1cccs1)Cc1ccc(C[NH+](C)C)cc1 ZINC000349545258 1127154594 /nfs/dbraw/zinc/15/45/94/1127154594.db2.gz QLUGQDJTYDHIMP-UHFFFAOYSA-N 1 3 288.460 3.832 20 0 CHADHO C[N@@H+]1CC[C@H]2[C@H](CCCN2Cc2ccc(C(F)F)cc2)C1 ZINC000572648016 1127223428 /nfs/dbraw/zinc/22/34/28/1127223428.db2.gz LCROCQZMZDBQLA-CVEARBPZSA-N 1 3 294.389 3.540 20 0 CHADHO C[N@H+]1CC[C@H]2[C@H](CCCN2Cc2ccc(C(F)F)cc2)C1 ZINC000572648016 1127223431 /nfs/dbraw/zinc/22/34/31/1127223431.db2.gz LCROCQZMZDBQLA-CVEARBPZSA-N 1 3 294.389 3.540 20 0 CHADHO CCN1CC[C@H]([N@H+](C)Cc2ccccc2SC)C[C@H]1C ZINC000358030283 1127397787 /nfs/dbraw/zinc/39/77/87/1127397787.db2.gz GLSZARZKBRBTER-ZBFHGGJFSA-N 1 3 292.492 3.713 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)Cc2ccccc2SC)C[C@H]1C ZINC000358030283 1127397791 /nfs/dbraw/zinc/39/77/91/1127397791.db2.gz GLSZARZKBRBTER-ZBFHGGJFSA-N 1 3 292.492 3.713 20 0 CHADHO CC[NH+]1CCC(N[C@@H](C)c2cccc(C3CC3)c2)CC1 ZINC000293583778 1127507023 /nfs/dbraw/zinc/50/70/23/1127507023.db2.gz FAOHFSBSAAKRLH-AWEZNQCLSA-N 1 3 272.436 3.699 20 0 CHADHO CC[C@H]([NH2+][C@@H](C)CCN(C)C)c1cc(Cl)ccc1OC ZINC000360858992 1127515790 /nfs/dbraw/zinc/51/57/90/1127515790.db2.gz MNQJOUWNOCSTFO-WFASDCNBSA-N 1 3 298.858 3.730 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1C ZINC000361080111 1127536556 /nfs/dbraw/zinc/53/65/56/1127536556.db2.gz NVPNLNYOVZYPQL-GUYCJALGSA-N 1 3 299.462 3.665 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@H]2CC[N@H+](C)[C@@H](C)C2)c1C ZINC000361080111 1127536553 /nfs/dbraw/zinc/53/65/53/1127536553.db2.gz NVPNLNYOVZYPQL-GUYCJALGSA-N 1 3 299.462 3.665 20 0 CHADHO CCC[C@H](N[C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccccc1 ZINC000361966640 1127602945 /nfs/dbraw/zinc/60/29/45/1127602945.db2.gz NPZOGVTYJZEGJH-SQNIBIBYSA-N 1 3 274.452 3.990 20 0 CHADHO CCC[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)c1ccccc1 ZINC000361966640 1127602947 /nfs/dbraw/zinc/60/29/47/1127602947.db2.gz NPZOGVTYJZEGJH-SQNIBIBYSA-N 1 3 274.452 3.990 20 0 CHADHO CC[N@@H+]1CC[C@@H](NCc2csc3ccccc23)[C@H](C)C1 ZINC000540195233 1127969202 /nfs/dbraw/zinc/96/92/02/1127969202.db2.gz OXNLTJCMIXMZAY-CZUORRHYSA-N 1 3 288.460 3.721 20 0 CHADHO CC[N@H+]1CC[C@@H](NCc2csc3ccccc23)[C@H](C)C1 ZINC000540195233 1127969205 /nfs/dbraw/zinc/96/92/05/1127969205.db2.gz OXNLTJCMIXMZAY-CZUORRHYSA-N 1 3 288.460 3.721 20 0 CHADHO C[C@@H](CC[NH2+][C@@H](c1ccccc1)C1CC1)N1CCCCC1 ZINC000544370466 1127970492 /nfs/dbraw/zinc/97/04/92/1127970492.db2.gz BIMLDWXKJQRRDR-LPHOPBHVSA-N 1 3 286.463 3.992 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]CC[C@@H](C)N2CCCCC2)s1 ZINC000544373897 1127970790 /nfs/dbraw/zinc/97/07/90/1127970790.db2.gz XIGVRJXOVPAHCV-UKRRQHHQSA-N 1 3 280.481 3.972 20 0 CHADHO CCc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)cc1 ZINC000468072228 1127990796 /nfs/dbraw/zinc/99/07/96/1127990796.db2.gz XFQBABASRPGLAR-BMGDILEWSA-N 1 3 274.452 3.772 20 0 CHADHO CCc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H](N(C)C)C2)cc1 ZINC000468072231 1127990822 /nfs/dbraw/zinc/99/08/22/1127990822.db2.gz XFQBABASRPGLAR-WBAXXEDZSA-N 1 3 274.452 3.772 20 0 CHADHO C[C@H](NCCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccns1 ZINC000924684158 1128110035 /nfs/dbraw/zinc/11/00/35/1128110035.db2.gz JFDHRDSOAKVNKG-KFWWJZLASA-N 1 3 295.496 3.552 20 0 CHADHO CC[C@H]([NH2+]C1CCN(CCC(C)C)CC1)c1ccncc1 ZINC000925130019 1128122858 /nfs/dbraw/zinc/12/28/58/1128122858.db2.gz LQARZHYYUVSYOV-SFHVURJKSA-N 1 3 289.467 3.633 20 0 CHADHO [NH3+]CCC[C@@H](N[C@@H]1CCOc2ccccc21)c1ccccc1 ZINC000925510185 1128130436 /nfs/dbraw/zinc/13/04/36/1128130436.db2.gz UDDZTVAXESSBMF-QZTJIDSGSA-N 1 3 296.414 3.580 20 0 CHADHO C[C@@H](NCCC(C)(C)[NH3+])c1cccc(-c2ccncc2)c1 ZINC000925739694 1128139539 /nfs/dbraw/zinc/13/95/39/1128139539.db2.gz DBVFRPVIKVACFL-CQSZACIVSA-N 1 3 283.419 3.527 20 0 CHADHO C[C@@H]([NH3+])[C@@H](NC1CCC2(CC2(F)F)CC1)c1ccccc1 ZINC000925710523 1128137753 /nfs/dbraw/zinc/13/77/53/1128137753.db2.gz XIGZQTGCOMGNCO-GOTCIRLWSA-N 1 3 294.389 3.633 20 0 CHADHO CSC1CCC(CN[C@H](c2ccccc2)[C@@H](C)[NH3+])CC1 ZINC000925802286 1128142245 /nfs/dbraw/zinc/14/22/45/1128142245.db2.gz KYKJLPHWOKLZGS-LYSZQXJVSA-N 1 3 292.492 3.586 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](C)C2CCCCCC2)C1 ZINC000542476774 1128162403 /nfs/dbraw/zinc/16/24/03/1128162403.db2.gz CCKWKVMHEGCAJF-HZPDHXFCSA-N 1 3 266.473 3.667 20 0 CHADHO Cc1cscc1CN[C@H](C)c1cccc(C[NH+](C)C)c1 ZINC000926302246 1128165537 /nfs/dbraw/zinc/16/55/37/1128165537.db2.gz JAFGEDUBTMBCAD-CQSZACIVSA-N 1 3 288.460 3.969 20 0 CHADHO CC[C@H](N)C[NH2+][C@@H](C)c1ccc(OCc2ccccc2)cc1 ZINC000231439011 1128258374 /nfs/dbraw/zinc/25/83/74/1128258374.db2.gz PXFIUZYKQAQFJV-YJBOKZPZSA-N 1 3 298.430 3.654 20 0 CHADHO CC/C=C\CCCCCCN1CC[C@]2(CC[NH2+]C2)C1 ZINC001235033244 1128291776 /nfs/dbraw/zinc/29/17/76/1128291776.db2.gz WLTSYVDPUVYROZ-LIMHQNJXSA-N 1 3 264.457 3.589 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)[NH+]1CCC(N(C)C)CC1 ZINC000193413425 1128292555 /nfs/dbraw/zinc/29/25/55/1128292555.db2.gz VFXPCXIKFAHRFJ-OAHLLOKOSA-N 1 3 282.431 3.927 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H]2C[C@H](C(C)C)c3ccccc32)C1 ZINC000562592601 1128412687 /nfs/dbraw/zinc/41/26/87/1128412687.db2.gz MPCOGOKXUXGMCB-ATZDWAIDSA-N 1 3 286.463 3.802 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H]2C[C@H](C(C)C)c3ccccc32)C1 ZINC000562592601 1128412689 /nfs/dbraw/zinc/41/26/89/1128412689.db2.gz MPCOGOKXUXGMCB-ATZDWAIDSA-N 1 3 286.463 3.802 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H]2C[C@H](C(C)C)c3ccccc32)C1 ZINC000562592601 1128412692 /nfs/dbraw/zinc/41/26/92/1128412692.db2.gz MPCOGOKXUXGMCB-ATZDWAIDSA-N 1 3 286.463 3.802 20 0 CHADHO CC(C)SCCNC1CC[NH+]([C@H]2CCC[C@H](C)C2)CC1 ZINC000562063183 1128375534 /nfs/dbraw/zinc/37/55/34/1128375534.db2.gz AUTOCPCLFJMVJM-RDJZCZTQSA-N 1 3 298.540 3.761 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)c2cccc3ccccc32)C1 ZINC000037644129 1128433729 /nfs/dbraw/zinc/43/37/29/1128433729.db2.gz SFIMVMBBGGQFLF-JKSUJKDBSA-N 1 3 282.431 3.832 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2)C1 ZINC000037644044 1128433777 /nfs/dbraw/zinc/43/37/77/1128433777.db2.gz UIGCVVUXCZETGX-HOTGVXAUSA-N 1 3 282.431 3.832 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@@H](C)c2ccc3ccccc3c2)C1 ZINC000037644044 1128433778 /nfs/dbraw/zinc/43/37/78/1128433778.db2.gz UIGCVVUXCZETGX-HOTGVXAUSA-N 1 3 282.431 3.832 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@@H](C)c2ccc3ccccc3c2)C1 ZINC000037644044 1128433781 /nfs/dbraw/zinc/43/37/81/1128433781.db2.gz UIGCVVUXCZETGX-HOTGVXAUSA-N 1 3 282.431 3.832 20 0 CHADHO CCCc1ccc([C@H](C)NC[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000037649256 1128434805 /nfs/dbraw/zinc/43/48/05/1128434805.db2.gz LTGCRVDHINGBPX-RDJZCZTQSA-N 1 3 286.463 3.774 20 0 CHADHO CCCc1ccc([C@H](C)NC[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000037649256 1128434808 /nfs/dbraw/zinc/43/48/08/1128434808.db2.gz LTGCRVDHINGBPX-RDJZCZTQSA-N 1 3 286.463 3.774 20 0 CHADHO Cc1ccc([C@@H](C)NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c(C)c1 ZINC000037772120 1128435586 /nfs/dbraw/zinc/43/55/86/1128435586.db2.gz TUZDKYQBBYEBKW-MGNMYUMUSA-N 1 3 272.436 3.579 20 0 CHADHO Cc1ccc([C@@H](C)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(C)c1 ZINC000037772120 1128435589 /nfs/dbraw/zinc/43/55/89/1128435589.db2.gz TUZDKYQBBYEBKW-MGNMYUMUSA-N 1 3 272.436 3.579 20 0 CHADHO Cc1cccc(CC[C@@H](C)[NH2+]C[C@H](C)CN2CCCC2)c1 ZINC000062079231 1128437072 /nfs/dbraw/zinc/43/70/72/1128437072.db2.gz RPRQWPCJSFATSY-ZWKOTPCHSA-N 1 3 288.479 3.638 20 0 CHADHO Cc1ccc([C@@H](NC[C@H](C)C[NH+]2CCCC2)C2CC2)cc1 ZINC000062078637 1128437269 /nfs/dbraw/zinc/43/72/69/1128437269.db2.gz FSRMWCNVUNUCHS-QFBILLFUSA-N 1 3 286.463 3.768 20 0 CHADHO C[C@@H](N[C@@H](CC[NH+](C)C)C(C)(C)C)c1cccs1 ZINC000125890331 1128455221 /nfs/dbraw/zinc/45/52/21/1128455221.db2.gz OHJYFKSDQWJIDW-OCCSQVGLSA-N 1 3 268.470 3.765 20 0 CHADHO CC(C)C[C@H](CN1CC[C@H]([NH3+])C[C@H]1C)c1ccccc1 ZINC000566411165 1128544394 /nfs/dbraw/zinc/54/43/94/1128544394.db2.gz AEYPVCAAVFOLMI-NXHRZFHOSA-N 1 3 274.452 3.628 20 0 CHADHO CC(C)C[C@H](C[N@@H+]1CC[C@H](N)C[C@H]1C)c1ccccc1 ZINC000566411165 1128544395 /nfs/dbraw/zinc/54/43/95/1128544395.db2.gz AEYPVCAAVFOLMI-NXHRZFHOSA-N 1 3 274.452 3.628 20 0 CHADHO CC(C)C[C@H](C[N@H+]1CC[C@H](N)C[C@H]1C)c1ccccc1 ZINC000566411165 1128544396 /nfs/dbraw/zinc/54/43/96/1128544396.db2.gz AEYPVCAAVFOLMI-NXHRZFHOSA-N 1 3 274.452 3.628 20 0 CHADHO C[C@H](N[C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000129775846 1128556131 /nfs/dbraw/zinc/55/61/31/1128556131.db2.gz HMAVMKMHARSIKG-DOXZYTNZSA-N 1 3 286.463 3.699 20 0 CHADHO C[C@H](N[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000129775846 1128556134 /nfs/dbraw/zinc/55/61/34/1128556134.db2.gz HMAVMKMHARSIKG-DOXZYTNZSA-N 1 3 286.463 3.699 20 0 CHADHO [NH3+]C[C@H](N[C@@H]1CCCc2c3ccccc3[nH]c21)C1CCCC1 ZINC000567724430 1128570591 /nfs/dbraw/zinc/57/05/91/1128570591.db2.gz PMUZOHNEDLGBTK-MSOLQXFVSA-N 1 3 297.446 3.652 20 0 CHADHO Cc1cc(C)cc([C@H](C)NC[C@H](C)C[NH+]2CCCC2)c1 ZINC000130353093 1128580741 /nfs/dbraw/zinc/58/07/41/1128580741.db2.gz UECFWOAQKVBHDI-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO CCC(C)(C)c1ccc(CN(C)C2(C)CC[NH2+]CC2)cc1 ZINC001236227068 1128626314 /nfs/dbraw/zinc/62/63/14/1128626314.db2.gz ZDOWXOVEPVYOLO-UHFFFAOYSA-N 1 3 288.479 3.948 20 0 CHADHO CCC(C)(C)c1ccc(C[N@H+](C)C2(C)CCNCC2)cc1 ZINC001236227068 1128626317 /nfs/dbraw/zinc/62/63/17/1128626317.db2.gz ZDOWXOVEPVYOLO-UHFFFAOYSA-N 1 3 288.479 3.948 20 0 CHADHO CCC(C)(C)c1ccc(C[N@@H+](C)C2(C)CCNCC2)cc1 ZINC001236227068 1128626319 /nfs/dbraw/zinc/62/63/19/1128626319.db2.gz ZDOWXOVEPVYOLO-UHFFFAOYSA-N 1 3 288.479 3.948 20 0 CHADHO CC[C@@H](N)C[N@@H+]1CCCC[C@H]1c1ccc(C)c(C)c1 ZINC001236246063 1128633993 /nfs/dbraw/zinc/63/39/93/1128633993.db2.gz XLPNQVKHLKSLJU-SJORKVTESA-N 1 3 260.425 3.568 20 0 CHADHO CC[C@@H](N)C[N@H+]1CCCC[C@H]1c1ccc(C)c(C)c1 ZINC001236246063 1128633994 /nfs/dbraw/zinc/63/39/94/1128633994.db2.gz XLPNQVKHLKSLJU-SJORKVTESA-N 1 3 260.425 3.568 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H]2C[C@H](C)c3ccccc32)C1 ZINC000574114189 1128661380 /nfs/dbraw/zinc/66/13/80/1128661380.db2.gz CGNWEACSLFOWJP-DAYGRLMNSA-N 1 3 272.436 3.556 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H]2C[C@H](C)c3ccccc32)C1 ZINC000574114189 1128661381 /nfs/dbraw/zinc/66/13/81/1128661381.db2.gz CGNWEACSLFOWJP-DAYGRLMNSA-N 1 3 272.436 3.556 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2CCCCC23CCCC3)C1 ZINC000578650184 1128725272 /nfs/dbraw/zinc/72/52/72/1128725272.db2.gz GSZOFDCRRDRDQM-IAGOWNOFSA-N 1 3 278.484 3.811 20 0 CHADHO [NH3+]CCC[C@@H](N[C@@H]1CCCc2cccnc21)c1ccccc1 ZINC000643543722 1117783674 /nfs/dbraw/zinc/78/36/74/1117783674.db2.gz YEVUBDAZXVNYKP-QZTJIDSGSA-N 1 3 295.430 3.529 20 0 CHADHO [NH3+]CCC[C@@H](N[C@H]1CCCc2cccnc21)c1ccccc1 ZINC000643543721 1117783792 /nfs/dbraw/zinc/78/37/92/1117783792.db2.gz YEVUBDAZXVNYKP-MSOLQXFVSA-N 1 3 295.430 3.529 20 0 CHADHO CCN(CC)CCC[N@H+](C1CC1)C1CCCCC1 ZINC000683141421 1117795127 /nfs/dbraw/zinc/79/51/27/1117795127.db2.gz NVCTUQBTHQITHB-UHFFFAOYSA-N 1 3 252.446 3.515 20 0 CHADHO CCN(CC)CCC[N@@H+](C1CC1)C1CCCCC1 ZINC000683141421 1117795132 /nfs/dbraw/zinc/79/51/32/1117795132.db2.gz NVCTUQBTHQITHB-UHFFFAOYSA-N 1 3 252.446 3.515 20 0 CHADHO C1CC2(C1)C[C@H]([NH2+][C@@H]1CCCCC13CCCC3)CCN2 ZINC000643548153 1117798706 /nfs/dbraw/zinc/79/87/06/1117798706.db2.gz NCKVPRSXRYERRZ-HZPDHXFCSA-N 1 3 276.468 3.754 20 0 CHADHO C[N@@H+]1CC[C@@H](N[C@@H]2CCCc3ccccc32)CC1(C)C ZINC000623336395 1117833524 /nfs/dbraw/zinc/83/35/24/1117833524.db2.gz MIFLLFKFLWGURT-NVXWUHKLSA-N 1 3 272.436 3.526 20 0 CHADHO C[N@H+]1CC[C@@H](N[C@@H]2CCCc3ccccc32)CC1(C)C ZINC000623336395 1117833527 /nfs/dbraw/zinc/83/35/27/1117833527.db2.gz MIFLLFKFLWGURT-NVXWUHKLSA-N 1 3 272.436 3.526 20 0 CHADHO CC[C@H](N[C@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(OC)cc1 ZINC000623339769 1117838268 /nfs/dbraw/zinc/83/82/68/1117838268.db2.gz JNDPLNFGKHLEAB-RDJZCZTQSA-N 1 3 290.451 3.609 20 0 CHADHO CC[C@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(OC)cc1 ZINC000623339769 1117838273 /nfs/dbraw/zinc/83/82/73/1117838273.db2.gz JNDPLNFGKHLEAB-RDJZCZTQSA-N 1 3 290.451 3.609 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[NH+]1CCC(N(C)C)CC1 ZINC001208201733 1117870040 /nfs/dbraw/zinc/87/00/40/1117870040.db2.gz IHEKNKQNWWNTAD-INIZCTEOSA-N 1 3 298.515 3.634 20 0 CHADHO COC(C)(C)CCC[C@H](C)CCN1CCC([NH+](C)C)CC1 ZINC001208201733 1117870046 /nfs/dbraw/zinc/87/00/46/1117870046.db2.gz IHEKNKQNWWNTAD-INIZCTEOSA-N 1 3 298.515 3.634 20 0 CHADHO CN1CCCC[C@@H](C[NH2+]Cc2csc3ccccc23)C1 ZINC000623656455 1117883264 /nfs/dbraw/zinc/88/32/64/1117883264.db2.gz UMMQCSREGMTGDQ-AWEZNQCLSA-N 1 3 288.460 3.723 20 0 CHADHO CC/C=C\CC[N@@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001208729313 1117920738 /nfs/dbraw/zinc/92/07/38/1117920738.db2.gz SMNOEDAGSKDWDJ-LIMHQNJXSA-N 1 3 264.457 3.683 20 0 CHADHO CC/C=C\CC[N@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001208729313 1117920743 /nfs/dbraw/zinc/92/07/43/1117920743.db2.gz SMNOEDAGSKDWDJ-LIMHQNJXSA-N 1 3 264.457 3.683 20 0 CHADHO CC[NH+](CC)CCCC1CCN(Cc2ccco2)CC1 ZINC000180791473 1117939136 /nfs/dbraw/zinc/93/91/36/1117939136.db2.gz XKBBVNBIVDPDDB-UHFFFAOYSA-N 1 3 278.440 3.614 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N[C@H]1CCCc2scnc21 ZINC000623848854 1117943387 /nfs/dbraw/zinc/94/33/87/1117943387.db2.gz NFJRSPRTAOYESN-KBPBESRZSA-N 1 3 295.496 3.621 20 0 CHADHO Cc1cc([C@@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)c(C)s1 ZINC000624119889 1117983574 /nfs/dbraw/zinc/98/35/74/1117983574.db2.gz LTVISMFLZXQBLL-HIFRSBDPSA-N 1 3 280.481 3.747 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccc2c(c1)CCC2 ZINC000624120022 1117984119 /nfs/dbraw/zinc/98/41/19/1117984119.db2.gz PRCUPTUWRHBRQT-HZPDHXFCSA-N 1 3 286.463 3.558 20 0 CHADHO CC(C)CC[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)C1CC1 ZINC000624123106 1117984688 /nfs/dbraw/zinc/98/46/88/1117984688.db2.gz FYUIYBBVKRODKJ-RDJZCZTQSA-N 1 3 266.473 3.523 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@@H]2CCc3ccc(Cl)cc32)C1 ZINC000624121800 1117985390 /nfs/dbraw/zinc/98/53/90/1117985390.db2.gz DFAXQORYFKILPH-CXAGYDPISA-N 1 3 292.854 3.649 20 0 CHADHO Cc1cccc([C@@H](C)NC[C@@H]2CCCC[N@H+](C)C2)c1C ZINC000624120925 1117986335 /nfs/dbraw/zinc/98/63/35/1117986335.db2.gz KIGGADGZBYGEKK-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO Cc1cccc([C@@H](C)NC[C@@H]2CCCC[N@@H+](C)C2)c1C ZINC000624120925 1117986339 /nfs/dbraw/zinc/98/63/39/1117986339.db2.gz KIGGADGZBYGEKK-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO Cc1cccc([C@@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)c1C ZINC000624120925 1117986341 /nfs/dbraw/zinc/98/63/41/1117986341.db2.gz KIGGADGZBYGEKK-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO CC[NH+](CC)C[C@@H]1CCN(CCCc2ccc(C)cc2)C1 ZINC000181929308 1118009081 /nfs/dbraw/zinc/00/90/81/1118009081.db2.gz YQIAJARCRHTISJ-IBGZPJMESA-N 1 3 288.479 3.591 20 0 CHADHO CCSc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCCN2C)cc1 ZINC000182137868 1118015039 /nfs/dbraw/zinc/01/50/39/1118015039.db2.gz XTBNXEHWLCNQKA-ZBFHGGJFSA-N 1 3 292.492 3.934 20 0 CHADHO CNCCC[NH+](C1CCCCC1)C1CCCCC1 ZINC000042409339 1118028094 /nfs/dbraw/zinc/02/80/94/1118028094.db2.gz VQKWMYXNHAJWHZ-UHFFFAOYSA-N 1 3 252.446 3.563 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](CC(C)C)c2ccccc2)C1 ZINC000037643950 1118033618 /nfs/dbraw/zinc/03/36/18/1118033618.db2.gz FZZYYOODDSSKCO-WMZOPIPTSA-N 1 3 274.452 3.705 20 0 CHADHO c1ccc(CN(CCC[NH+]2CCCCC2)C2CCC2)cc1 ZINC001209453409 1118064485 /nfs/dbraw/zinc/06/44/85/1118064485.db2.gz HZGVZAIRDVLKCG-UHFFFAOYSA-N 1 3 286.463 3.917 20 0 CHADHO C[C@@H](c1cccc(Cl)c1)N(C)C[C@H]1CCC[N@H+](C)C1 ZINC000247178033 1118130257 /nfs/dbraw/zinc/13/02/57/1118130257.db2.gz YWIWBGHRGGAXPR-KBPBESRZSA-N 1 3 280.843 3.675 20 0 CHADHO C[C@@H](c1cccc(Cl)c1)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000247178033 1118130258 /nfs/dbraw/zinc/13/02/58/1118130258.db2.gz YWIWBGHRGGAXPR-KBPBESRZSA-N 1 3 280.843 3.675 20 0 CHADHO C[C@H](CC(C)(C)c1ccccc1)[NH2+]C[C@H](C)CN(C)C ZINC000312520558 1118150664 /nfs/dbraw/zinc/15/06/64/1118150664.db2.gz OKXAEAWSVBNTRK-JKSUJKDBSA-N 1 3 276.468 3.530 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@@H]2CCC(C)(C)C[C@H]2C)C1 ZINC000155912837 1118159222 /nfs/dbraw/zinc/15/92/22/1118159222.db2.gz KJYLCIXIBPTWOC-OWCLPIDISA-N 1 3 266.473 3.521 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1)CN(C)C ZINC000312656396 1118347416 /nfs/dbraw/zinc/34/74/16/1118347416.db2.gz GHAKUCGFFILWKB-NEPJUHHUSA-N 1 3 288.357 3.554 20 0 CHADHO CC(C)[NH2+]CCCN[C@@H]1C[C@@H](c2ccccc2)C1(C)C ZINC000580062374 1118371243 /nfs/dbraw/zinc/37/12/43/1118371243.db2.gz QCDASIZLFUVKQI-DLBZAZTESA-N 1 3 274.452 3.546 20 0 CHADHO Cc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000765783198 1118405419 /nfs/dbraw/zinc/40/54/19/1118405419.db2.gz KOTJZJFGDBDXTD-LPHOPBHVSA-N 1 3 286.463 3.692 20 0 CHADHO [NH3+][C@H]1CCC[C@H](NC2(c3cccc(Cl)c3)CCC2)C1 ZINC000656200201 1118440338 /nfs/dbraw/zinc/44/03/38/1118440338.db2.gz HBJMPKZWEZHCFW-GJZGRUSLSA-N 1 3 278.827 3.579 20 0 CHADHO CC(C)C[C@@H]([NH2+]CC[C@H]1CCCN1C)c1ccccc1 ZINC000341036121 1118591763 /nfs/dbraw/zinc/59/17/63/1118591763.db2.gz ITISMTWGLKPGES-QZTJIDSGSA-N 1 3 274.452 3.848 20 0 CHADHO CC(C)C[C@@H](NCC[C@H]1CCC[N@@H+]1C)c1ccccc1 ZINC000341036121 1118591771 /nfs/dbraw/zinc/59/17/71/1118591771.db2.gz ITISMTWGLKPGES-QZTJIDSGSA-N 1 3 274.452 3.848 20 0 CHADHO CC(C)C[C@@H](NCC[C@H]1CCC[N@H+]1C)c1ccccc1 ZINC000341036121 1118591773 /nfs/dbraw/zinc/59/17/73/1118591773.db2.gz ITISMTWGLKPGES-QZTJIDSGSA-N 1 3 274.452 3.848 20 0 CHADHO CC[C@@H]1CC[C@H](C)C[C@@H]1[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000430722601 1118764827 /nfs/dbraw/zinc/76/48/27/1118764827.db2.gz QRTDRHYQPMWSCY-MLHJIOFPSA-N 1 3 280.500 3.911 20 0 CHADHO c1csc([C@H](NC[C@@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC000132151689 1118826846 /nfs/dbraw/zinc/82/68/46/1118826846.db2.gz UTRKZQYJDQJNBS-CZUORRHYSA-N 1 3 278.465 3.569 20 0 CHADHO CCC(CC)[C@@H](N[C@@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000133705143 1118865769 /nfs/dbraw/zinc/86/57/69/1118865769.db2.gz NSPJCVZSNNSSDM-QZTJIDSGSA-N 1 3 274.452 3.896 20 0 CHADHO CCC(CC)[C@H](N[C@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000133705353 1118866176 /nfs/dbraw/zinc/86/61/76/1118866176.db2.gz NSPJCVZSNNSSDM-ROUUACIJSA-N 1 3 274.452 3.896 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+]C2CC(C)(C)CC(C)(C)C2)C1 ZINC000129705038 1118882457 /nfs/dbraw/zinc/88/24/57/1118882457.db2.gz OIWNDRPFSXCLDB-HNNXBMFYSA-N 1 3 280.500 3.911 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN(CCCc2cccc(C)c2)C1 ZINC000181132799 1118904330 /nfs/dbraw/zinc/90/43/30/1118904330.db2.gz UTRRBYDZSCPTFV-LJQANCHMSA-N 1 3 288.479 3.591 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN(CCCc2cccc(C)c2)C1 ZINC000181132799 1118904333 /nfs/dbraw/zinc/90/43/33/1118904333.db2.gz UTRRBYDZSCPTFV-LJQANCHMSA-N 1 3 288.479 3.591 20 0 CHADHO Cc1ccc2[nH]c(C[NH2+][C@@H]3CCC[C@@H](N(C)C)C3)cc2c1C ZINC000472080383 1118960927 /nfs/dbraw/zinc/96/09/27/1118960927.db2.gz OENPAYCVJOSKFE-NVXWUHKLSA-N 1 3 299.462 3.747 20 0 CHADHO CCc1cccc2cc(C[NH2+]C[C@@H]3CCN(C4CC4)C3)oc21 ZINC000657307893 1118979576 /nfs/dbraw/zinc/97/95/76/1118979576.db2.gz UEKWCLCIUQXFMA-AWEZNQCLSA-N 1 3 298.430 3.569 20 0 CHADHO CC[C@@H](c1ccccc1)N(C)CC(C)(C)C[NH+](C)C ZINC001207282309 1119036310 /nfs/dbraw/zinc/03/63/10/1119036310.db2.gz HIMOXRHIZLOLEY-INIZCTEOSA-N 1 3 262.441 3.657 20 0 CHADHO C[C@]1(C[NH2+]C2CCN(CC3CCCC3)CC2)CCCS1 ZINC000628209978 1128827696 /nfs/dbraw/zinc/82/76/96/1128827696.db2.gz BSPYCMPBNKEPIH-QGZVFWFLSA-N 1 3 296.524 3.516 20 0 CHADHO CC1CCN(CCC[NH2+]C[C@@H]2C[C@H]2c2ccccc2)CC1 ZINC000343085050 1119304646 /nfs/dbraw/zinc/30/46/46/1119304646.db2.gz AIIJYEKFZHHCBG-OALUTQOASA-N 1 3 286.463 3.502 20 0 CHADHO CC[C@@H](Cc1ccccc1)[NH2+]CCCN1CCCC[C@H]1C ZINC000252895712 1119424285 /nfs/dbraw/zinc/42/42/85/1119424285.db2.gz ZJRXEIQSZDNZAH-MJGOQNOKSA-N 1 3 288.479 3.862 20 0 CHADHO C[C@H]1CC[N@@H+](C2CCC(c3ccccc3)CC2)C[C@H]1CN ZINC000253185774 1119451617 /nfs/dbraw/zinc/45/16/17/1119451617.db2.gz IFNJVPTVVDOOSW-WEOZKBJRSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@H]1CC[N@H+](C2CCC(c3ccccc3)CC2)C[C@H]1CN ZINC000253185774 1119451619 /nfs/dbraw/zinc/45/16/19/1119451619.db2.gz IFNJVPTVVDOOSW-WEOZKBJRSA-N 1 3 286.463 3.630 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]C[C@H](C)Cc2ccccc2)C1 ZINC000248546367 1128851818 /nfs/dbraw/zinc/85/18/18/1128851818.db2.gz DVDMLAHUYYUNHQ-MJGOQNOKSA-N 1 3 288.479 3.575 20 0 CHADHO CC(C)C1(C[NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000090230781 1119544788 /nfs/dbraw/zinc/54/47/88/1119544788.db2.gz ABSYQXLDDAZASD-UHFFFAOYSA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H]2[C@@H]3CCC[C@@H]3C2(C)C)C1 ZINC000657872310 1119583477 /nfs/dbraw/zinc/58/34/77/1119583477.db2.gz MUEXPLDWPBIPHE-WCXIOVBPSA-N 1 3 278.484 3.521 20 0 CHADHO CCCN1CC[C@H](C[NH2+]C[C@@H](C)CCc2ccccc2)C1 ZINC001648920571 1119595250 /nfs/dbraw/zinc/59/52/50/1119595250.db2.gz CEUHVKKAUUULNS-PKOBYXMFSA-N 1 3 288.479 3.577 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CN(C)C[C@H]2c2ccccc2)o1 ZINC000647344370 1119597360 /nfs/dbraw/zinc/59/73/60/1119597360.db2.gz PFDRLWMLYWVWCZ-JQHSSLGASA-N 1 3 298.430 3.584 20 0 CHADHO C[C@H]([NH2+][C@H]1CCCSCC1)[C@H]1CCCN(C2CCC2)C1 ZINC000657969784 1119655490 /nfs/dbraw/zinc/65/54/90/1119655490.db2.gz UQICCUYOYRVNKG-JYJNAYRXSA-N 1 3 296.524 3.515 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1cc([O-])cc(F)c1 ZINC000924526484 1119693751 /nfs/dbraw/zinc/69/37/51/1119693751.db2.gz GAEWHAUVKZQWHB-UONOGXRCSA-N 1 3 296.430 3.692 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H]2C[C@H](C)CC(C)(C)C2)C1 ZINC000708768913 1119809019 /nfs/dbraw/zinc/80/90/19/1119809019.db2.gz YNFSTVGYGWQPQL-JYJNAYRXSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@H](CN1CC[C@H](C[NH+]2CCCCC2)C1)c1ccccc1 ZINC000173867874 1119916854 /nfs/dbraw/zinc/91/68/54/1119916854.db2.gz DVKPGHKEZDFGLP-QZTJIDSGSA-N 1 3 286.463 3.598 20 0 CHADHO C[C@H](C[N@@H+]1CC[C@H](CN2CCCCC2)C1)c1ccccc1 ZINC000173867874 1119916856 /nfs/dbraw/zinc/91/68/56/1119916856.db2.gz DVKPGHKEZDFGLP-QZTJIDSGSA-N 1 3 286.463 3.598 20 0 CHADHO C[C@H](C[N@H+]1CC[C@H](CN2CCCCC2)C1)c1ccccc1 ZINC000173867874 1119916858 /nfs/dbraw/zinc/91/68/58/1119916858.db2.gz DVKPGHKEZDFGLP-QZTJIDSGSA-N 1 3 286.463 3.598 20 0 CHADHO CCCC[N@H+](C)CC1CCN(Cc2cccc(F)c2)CC1 ZINC000613491897 1119940987 /nfs/dbraw/zinc/94/09/87/1119940987.db2.gz CYWZYPACBUXOHD-UHFFFAOYSA-N 1 3 292.442 3.770 20 0 CHADHO CCCC[N@@H+](C)CC1CCN(Cc2cccc(F)c2)CC1 ZINC000613491897 1119940991 /nfs/dbraw/zinc/94/09/91/1119940991.db2.gz CYWZYPACBUXOHD-UHFFFAOYSA-N 1 3 292.442 3.770 20 0 CHADHO CC(C)CC[C@H](C)[NH2+]CCCN1CCCC[C@H]1C ZINC000036854564 1119944144 /nfs/dbraw/zinc/94/41/44/1119944144.db2.gz OJFUJKXEAOUBNN-JKSUJKDBSA-N 1 3 254.462 3.665 20 0 CHADHO C[C@@H]1C[C@@H](NC2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)CS1 ZINC000414223173 1119946550 /nfs/dbraw/zinc/94/65/50/1119946550.db2.gz GDNDQSNKEYYJCU-SRABZTEZSA-N 1 3 296.524 3.513 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+]C2CCN([C@H]3CCC[C@@H](C)C3)CC2)CS1 ZINC000414223173 1119946555 /nfs/dbraw/zinc/94/65/55/1119946555.db2.gz GDNDQSNKEYYJCU-SRABZTEZSA-N 1 3 296.524 3.513 20 0 CHADHO CCC[C@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccsc1 ZINC000187711227 1120032559 /nfs/dbraw/zinc/03/25/59/1120032559.db2.gz SNJYAUDQMBSQGL-ZFWWWQNUSA-N 1 3 266.454 3.521 20 0 CHADHO CCC[C@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccsc1 ZINC000187711227 1120032565 /nfs/dbraw/zinc/03/25/65/1120032565.db2.gz SNJYAUDQMBSQGL-ZFWWWQNUSA-N 1 3 266.454 3.521 20 0 CHADHO Cc1ccc(C)c([C@H](C)NC[C@@H]2CCCC[N@H+](C)C2)c1 ZINC000624119460 1120052176 /nfs/dbraw/zinc/05/21/76/1120052176.db2.gz BMESHBQENRNSDY-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc(C)c([C@H](C)NC[C@@H]2CCCC[N@@H+](C)C2)c1 ZINC000624119460 1120052180 /nfs/dbraw/zinc/05/21/80/1120052180.db2.gz BMESHBQENRNSDY-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc(C)c([C@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)c1 ZINC000624119460 1120052183 /nfs/dbraw/zinc/05/21/83/1120052183.db2.gz BMESHBQENRNSDY-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO Cc1oc2ccccc2c1C[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000623657236 1120065219 /nfs/dbraw/zinc/06/52/19/1120065219.db2.gz LWOLUEXMMMXCQY-HNNXBMFYSA-N 1 3 286.419 3.563 20 0 CHADHO CN1CCCC[C@@H](C[NH2+][C@H]2CCc3c2cccc3Cl)C1 ZINC000624121150 1120074529 /nfs/dbraw/zinc/07/45/29/1120074529.db2.gz PFJWVGCUEKBJEA-GUYCJALGSA-N 1 3 292.854 3.649 20 0 CHADHO Cc1ccc([C@@H]([NH2+]C[C@H]2CCCCN(C)C2)C2CC2)cc1 ZINC000624122151 1120102932 /nfs/dbraw/zinc/10/29/32/1120102932.db2.gz KWKJJEQSBZTPDF-VQIMIIECSA-N 1 3 286.463 3.768 20 0 CHADHO Cc1ccc([C@@H](NC[C@H]2CCCC[N@@H+](C)C2)C2CC2)cc1 ZINC000624122151 1120102934 /nfs/dbraw/zinc/10/29/34/1120102934.db2.gz KWKJJEQSBZTPDF-VQIMIIECSA-N 1 3 286.463 3.768 20 0 CHADHO Cc1ccc([C@@H](NC[C@H]2CCCC[N@H+](C)C2)C2CC2)cc1 ZINC000624122151 1120102937 /nfs/dbraw/zinc/10/29/37/1120102937.db2.gz KWKJJEQSBZTPDF-VQIMIIECSA-N 1 3 286.463 3.768 20 0 CHADHO CC(C)C[C@H](C)CN1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000499545769 1120311294 /nfs/dbraw/zinc/31/12/94/1120311294.db2.gz CYIYZYMMHNFTBY-XYJFISCASA-N 1 3 278.484 3.617 20 0 CHADHO CC(C)C[C@H](C)CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000499545769 1120311298 /nfs/dbraw/zinc/31/12/98/1120311298.db2.gz CYIYZYMMHNFTBY-XYJFISCASA-N 1 3 278.484 3.617 20 0 CHADHO CN1CCC[C@@H]2C[N@H+](CC[C@@H]3CCc4ccccc43)CC[C@@H]21 ZINC000660009768 1120339025 /nfs/dbraw/zinc/33/90/25/1120339025.db2.gz ACHBPBQAQHRWLQ-NSHGMRRFSA-N 1 3 298.474 3.523 20 0 CHADHO CN1CCC[C@@H]2C[N@@H+](CC[C@@H]3CCc4ccccc43)CC[C@@H]21 ZINC000660009768 1120339028 /nfs/dbraw/zinc/33/90/28/1120339028.db2.gz ACHBPBQAQHRWLQ-NSHGMRRFSA-N 1 3 298.474 3.523 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@H]2CCCC23CCCCC3)C1 ZINC000313042174 1120382052 /nfs/dbraw/zinc/38/20/52/1120382052.db2.gz QNCIMRXVMPZCBT-SJORKVTESA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CC[C@@H](C)NC1)c1cc2ccccc2s1 ZINC000629542689 1128914858 /nfs/dbraw/zinc/91/48/58/1128914858.db2.gz JIERFVVBLBKVHZ-YRGRVCCFSA-N 1 3 274.433 3.692 20 0 CHADHO CC(C)(CN[C@H]1CCC[C@@H]1[NH3+])c1ccc2ccccc2c1 ZINC000629550495 1128915128 /nfs/dbraw/zinc/91/51/28/1128915128.db2.gz NENFSMARQJLPFK-ROUUACIJSA-N 1 3 282.431 3.587 20 0 CHADHO CC1(C)[C@H](N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)C[C@@H]1c1ccccc1 ZINC000364071033 1120423397 /nfs/dbraw/zinc/42/33/97/1120423397.db2.gz DMTJBAVXCCKSOG-FCGDIQPGSA-N 1 3 298.474 3.785 20 0 CHADHO CC1(C)[C@H](N[C@@H]2CC[N@H+]3CCC[C@H]3C2)C[C@@H]1c1ccccc1 ZINC000364071033 1120423401 /nfs/dbraw/zinc/42/34/01/1120423401.db2.gz DMTJBAVXCCKSOG-FCGDIQPGSA-N 1 3 298.474 3.785 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417310960 1120425363 /nfs/dbraw/zinc/42/53/63/1120425363.db2.gz LDGMHMFNHODAGX-CQJMVSDSSA-N 1 3 292.492 3.703 20 0 CHADHO Cc1cc(C)c(C[N@H+]2CCC[C@@H]3CN(C)CC[C@H]32)cc1C ZINC000584866058 1120472496 /nfs/dbraw/zinc/47/24/96/1120472496.db2.gz NEMCKMKHGORESP-IEBWSBKVSA-N 1 3 286.463 3.528 20 0 CHADHO Cc1cc(C)c(C[N@@H+]2CCC[C@@H]3CN(C)CC[C@H]32)cc1C ZINC000584866058 1120472500 /nfs/dbraw/zinc/47/25/00/1120472500.db2.gz NEMCKMKHGORESP-IEBWSBKVSA-N 1 3 286.463 3.528 20 0 CHADHO CC[C@@H]1CCC[C@@H](CN2CCC([NH2+]C(C)C)CC2)C1 ZINC000543393964 1120505967 /nfs/dbraw/zinc/50/59/67/1120505967.db2.gz DHRSIUZNLIPAAH-HZPDHXFCSA-N 1 3 266.473 3.665 20 0 CHADHO C[N@H+](CCCN1CCCC1)[C@H]1CCc2c1cccc2Cl ZINC000499936997 1120553136 /nfs/dbraw/zinc/55/31/36/1120553136.db2.gz RJNSPDCOZLVJSB-KRWDZBQOSA-N 1 3 292.854 3.745 20 0 CHADHO C[N@@H+](CCCN1CCCC1)[C@H]1CCc2c1cccc2Cl ZINC000499936997 1120553140 /nfs/dbraw/zinc/55/31/40/1120553140.db2.gz RJNSPDCOZLVJSB-KRWDZBQOSA-N 1 3 292.854 3.745 20 0 CHADHO C[N@H+](CCCN1CCCC1)[C@H]1CCc2ccc(Cl)cc21 ZINC000499951167 1120560817 /nfs/dbraw/zinc/56/08/17/1120560817.db2.gz ROUZTUKXEFVGAH-KRWDZBQOSA-N 1 3 292.854 3.745 20 0 CHADHO C[N@@H+](CCCN1CCCC1)[C@H]1CCc2ccc(Cl)cc21 ZINC000499951167 1120560821 /nfs/dbraw/zinc/56/08/21/1120560821.db2.gz ROUZTUKXEFVGAH-KRWDZBQOSA-N 1 3 292.854 3.745 20 0 CHADHO C[C@H](C[NH2+][C@H](Cc1ccccc1)c1ccccc1)CN(C)C ZINC000390708390 1120609091 /nfs/dbraw/zinc/60/90/91/1120609091.db2.gz GZZYEJWITHBSFQ-YLJYHZDGSA-N 1 3 296.458 3.758 20 0 CHADHO C[C@H](CN[C@H](Cc1ccccc1)c1ccccc1)C[NH+](C)C ZINC000390708390 1120609093 /nfs/dbraw/zinc/60/90/93/1120609093.db2.gz GZZYEJWITHBSFQ-YLJYHZDGSA-N 1 3 296.458 3.758 20 0 CHADHO CC[C@@]1(C)CCC[C@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000651731546 1120729274 /nfs/dbraw/zinc/72/92/74/1120729274.db2.gz RROIHQUERDSFFU-MSOLQXFVSA-N 1 3 278.484 3.952 20 0 CHADHO CCCSC[C@H](C)[NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000893487724 1120795160 /nfs/dbraw/zinc/79/51/60/1120795160.db2.gz LWGZRHBCSWEDQD-HRCADAONSA-N 1 3 298.540 3.761 20 0 CHADHO CC[C@@H]1C[N@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)CC[C@H]1N ZINC000662273711 1120916386 /nfs/dbraw/zinc/91/63/86/1120916386.db2.gz YUSKYOVZMAFJFS-PSBWJHGTSA-N 1 3 286.463 3.630 20 0 CHADHO CC[C@@H]1C[N@@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)CC[C@H]1N ZINC000662273711 1120916390 /nfs/dbraw/zinc/91/63/90/1120916390.db2.gz YUSKYOVZMAFJFS-PSBWJHGTSA-N 1 3 286.463 3.630 20 0 CHADHO CC1(C)C[C@]1(CN[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000663368030 1120947882 /nfs/dbraw/zinc/94/78/82/1120947882.db2.gz MSYGIGYMSCAWCH-GGPKGHCWSA-N 1 3 298.474 3.571 20 0 CHADHO CC1(C)C[C@]1(CN[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000663368030 1120947883 /nfs/dbraw/zinc/94/78/83/1120947883.db2.gz MSYGIGYMSCAWCH-GGPKGHCWSA-N 1 3 298.474 3.571 20 0 CHADHO CC[C@@H]([NH2+]C[C@H]1CCCN(CC2CC2)C1)C1CCCC1 ZINC000663466626 1120982564 /nfs/dbraw/zinc/98/25/64/1120982564.db2.gz WCTQJMLGVSYBPD-SJLPKXTDSA-N 1 3 278.484 3.667 20 0 CHADHO CCC[C@@H](N[C@H]1CCC[NH2+]CC1)c1ccc(Cl)cc1 ZINC000643467040 1120996045 /nfs/dbraw/zinc/99/60/45/1120996045.db2.gz QCUWROCOGDXYPY-JKSUJKDBSA-N 1 3 280.843 3.913 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@@H]2N[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643547950 1121010898 /nfs/dbraw/zinc/01/08/98/1121010898.db2.gz LDGPQVAVFLKKDH-AEFFLSMTSA-N 1 3 298.474 3.945 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N1CCc2ccc(F)cc2C1 ZINC001167837493 1121041453 /nfs/dbraw/zinc/04/14/53/1121041453.db2.gz LMTWKGSEVZMNDK-HNNXBMFYSA-N 1 3 292.442 3.694 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N(C)Cc1ccc(F)cc1F ZINC001167840023 1121045663 /nfs/dbraw/zinc/04/56/63/1121045663.db2.gz DIHQGSSQOWQMDP-AWEZNQCLSA-N 1 3 298.421 3.907 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCCc3ccc(F)cc32)C1 ZINC000344077339 1121074161 /nfs/dbraw/zinc/07/41/61/1121074161.db2.gz QHLNETKUEWSJDH-NUJGCVRESA-N 1 3 290.426 3.666 20 0 CHADHO CC[NH+]1CCC(N[C@@H](c2ccc(Cl)cc2)C2CC2)CC1 ZINC000037977309 1121095486 /nfs/dbraw/zinc/09/54/86/1121095486.db2.gz YNYPXWOLCOJKLK-QGZVFWFLSA-N 1 3 292.854 3.865 20 0 CHADHO CC[NH+]1CCC(N[C@@H](C)c2ccc3ccccc3c2)CC1 ZINC000037977242 1121096002 /nfs/dbraw/zinc/09/60/02/1121096002.db2.gz PUBLCAVSFXVVHD-HNNXBMFYSA-N 1 3 282.431 3.975 20 0 CHADHO CCCN1CCC([NH2+]Cc2cc3cc(C)ccc3o2)CC1 ZINC000152037256 1121357848 /nfs/dbraw/zinc/35/78/48/1121357848.db2.gz SOOWYFFDRVJNLP-UHFFFAOYSA-N 1 3 286.419 3.705 20 0 CHADHO CCC[NH+]1CCC(N[C@H](c2ccccc2C)C2CC2)CC1 ZINC000675873257 1121376261 /nfs/dbraw/zinc/37/62/61/1121376261.db2.gz IIHCUIHHPJFSGG-IBGZPJMESA-N 1 3 286.463 3.910 20 0 CHADHO CC[C@@H](C[N@@H+]1CCC[C@@H](N(C)C)CC1)c1ccccc1 ZINC000432816117 1121378651 /nfs/dbraw/zinc/37/86/51/1121378651.db2.gz NDSJZXAKLCRLQQ-FUHWJXTLSA-N 1 3 274.452 3.596 20 0 CHADHO CC[C@@H](C[N@H+]1CCC[C@@H](N(C)C)CC1)c1ccccc1 ZINC000432816117 1121378659 /nfs/dbraw/zinc/37/86/59/1121378659.db2.gz NDSJZXAKLCRLQQ-FUHWJXTLSA-N 1 3 274.452 3.596 20 0 CHADHO C[C@@H]1CCCC[C@@H]1[NH+]1CCC(N[C@H]2CC23CCCC3)CC1 ZINC000429426374 1121575779 /nfs/dbraw/zinc/57/57/79/1121575779.db2.gz FVIABMUVKVHIHF-NJAFHUGGSA-N 1 3 290.495 3.952 20 0 CHADHO C[C@@H]1CCC[C@H]([NH+]2CCC(N[C@@H]3CC34CCCC4)CC2)C1 ZINC000429425722 1121576837 /nfs/dbraw/zinc/57/68/37/1121576837.db2.gz LRRIZCCKVPJBNZ-BPQIPLTHSA-N 1 3 290.495 3.952 20 0 CHADHO Cc1cc(C)c(/C=C/C[NH2+]C[C@H]2CCN(C3CC3)C2)c(C)c1 ZINC001177226678 1121719571 /nfs/dbraw/zinc/71/95/71/1121719571.db2.gz VKEUIPLXUFVTPL-SHCNBLLESA-N 1 3 298.474 3.699 20 0 CHADHO c1ccc(CCNC2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000153019790 1129016113 /nfs/dbraw/zinc/01/61/13/1129016113.db2.gz OBPUIODKTBZTDN-UHFFFAOYSA-N 1 3 286.463 3.616 20 0 CHADHO c1ccc(CC[NH2+]C2CCN(C3CCCCC3)CC2)cc1 ZINC000153019790 1129016117 /nfs/dbraw/zinc/01/61/17/1129016117.db2.gz OBPUIODKTBZTDN-UHFFFAOYSA-N 1 3 286.463 3.616 20 0 CHADHO C[C@@H]1C[C@@H]1[C@H]1C[C@H]1C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC001179592848 1121892737 /nfs/dbraw/zinc/89/27/37/1121892737.db2.gz IXEVKNMEGPYSTJ-PDWMJMLSSA-N 1 3 290.495 3.665 20 0 CHADHO CCCc1ccc([C@@H](NC[C@@H]2CC[NH2+]C2)C(C)C)cc1 ZINC000420376574 1122003088 /nfs/dbraw/zinc/00/30/88/1122003088.db2.gz QUJUBBUEFBZLIC-AEFFLSMTSA-N 1 3 274.452 3.535 20 0 CHADHO Clc1ccc([C@@H](NC[C@H]2CCC[NH2+]C2)C2CCC2)cc1 ZINC000420399051 1122004660 /nfs/dbraw/zinc/00/46/60/1122004660.db2.gz HMPSPKYYSRYSBV-GUYCJALGSA-N 1 3 292.854 3.770 20 0 CHADHO CC(C)[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H](C)N1CCCCC1 ZINC001180811139 1122017856 /nfs/dbraw/zinc/01/78/56/1122017856.db2.gz QSBGYEYTBSIGLC-IKGGRYGDSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@H](CC[NH2+][C@@H](C)Cc1ccc(F)cc1)N1CCCCC1 ZINC001180809129 1122018503 /nfs/dbraw/zinc/01/85/03/1122018503.db2.gz ARZAVLJDNFDUOO-JKSUJKDBSA-N 1 3 292.442 3.611 20 0 CHADHO CC(C)(C)N1CCC([NH2+]C[C@H]2C[C@@H]2c2ccccc2)CC1 ZINC000503035312 1122163774 /nfs/dbraw/zinc/16/37/74/1122163774.db2.gz NHIRFPVLXYHWEX-SJLPKXTDSA-N 1 3 286.463 3.643 20 0 CHADHO C[C@@]1([NH3+])CCCN(Cc2ccc(F)c3ccccc23)CC1 ZINC001205273252 1122226634 /nfs/dbraw/zinc/22/66/34/1122226634.db2.gz IVLGMHOVPYYBDG-GOSISDBHSA-N 1 3 286.394 3.682 20 0 CHADHO CC1([NH2+]C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CCCCC1 ZINC001167958468 1122446159 /nfs/dbraw/zinc/44/61/59/1122446159.db2.gz FJKIDJOHDWHHOT-ALOPSCKCSA-N 1 3 276.468 3.704 20 0 CHADHO CCN1CCC[C@@H](C[NH2+]CCCC2CCCCC2)C1 ZINC000514758042 1122446490 /nfs/dbraw/zinc/44/64/90/1122446490.db2.gz GCNGJHSIHPOBFC-KRWDZBQOSA-N 1 3 266.473 3.668 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@H]1CC[C@@H](c2ccccc2)C1 ZINC000436283359 1122530857 /nfs/dbraw/zinc/53/08/57/1122530857.db2.gz UUHBLQLMKRDMPY-MSOLQXFVSA-N 1 3 274.452 3.643 20 0 CHADHO C[C@H](C[NH2+][C@@H](CC1CCC1)c1ccccc1)CN(C)C ZINC000425916477 1122658452 /nfs/dbraw/zinc/65/84/52/1122658452.db2.gz FQXCFOVJEBYCRL-QAPCUYQASA-N 1 3 274.452 3.705 20 0 CHADHO C[C@H](CN[C@@H](CC1CCC1)c1ccccc1)C[NH+](C)C ZINC000425916477 1122658453 /nfs/dbraw/zinc/65/84/53/1122658453.db2.gz FQXCFOVJEBYCRL-QAPCUYQASA-N 1 3 274.452 3.705 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)[C@H](C)c1ccc(Cl)cc1)CN(C)C ZINC000425938113 1122668858 /nfs/dbraw/zinc/66/88/58/1122668858.db2.gz VTLGQPCNAVCFJA-RDBSUJKOSA-N 1 3 282.859 3.619 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)c1ccc(OC(C)(C)C)cc1)CN(C)C ZINC000425947101 1122675814 /nfs/dbraw/zinc/67/58/14/1122675814.db2.gz ZHISNVOOKZCYCW-CABCVRRESA-N 1 3 292.467 3.712 20 0 CHADHO CC[N@H+](C)Cc1cccc(CNCc2ccsc2C)c1 ZINC000293663346 1122717051 /nfs/dbraw/zinc/71/70/51/1122717051.db2.gz UEIFUJCJFQNJGS-UHFFFAOYSA-N 1 3 288.460 3.798 20 0 CHADHO CC[N@@H+](C)Cc1cccc(CNCc2ccsc2C)c1 ZINC000293663346 1122717056 /nfs/dbraw/zinc/71/70/56/1122717056.db2.gz UEIFUJCJFQNJGS-UHFFFAOYSA-N 1 3 288.460 3.798 20 0 CHADHO CC1(C)CCC(CN2CCC([NH+]3CCCC3)CC2)CC1 ZINC000506466963 1122747230 /nfs/dbraw/zinc/74/72/30/1122747230.db2.gz PJNXDVCJVBBBEH-UHFFFAOYSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1)C1CCCC1 ZINC001167967082 1122845491 /nfs/dbraw/zinc/84/54/91/1122845491.db2.gz AVKAIDZKWONDKI-DXJOGWAWSA-N 1 3 276.468 3.560 20 0 CHADHO CC1([NH+]2CCC2)CCN(CC[C@H]2CCc3ccccc32)CC1 ZINC001197263819 1122950560 /nfs/dbraw/zinc/95/05/60/1122950560.db2.gz CQVNLAVVTHQLMC-GOSISDBHSA-N 1 3 298.474 3.667 20 0 CHADHO CCN1CC[C@@H](C[NH2+]CC2CCC(C(C)(C)C)CC2)C1 ZINC000129846130 1123003382 /nfs/dbraw/zinc/00/33/82/1123003382.db2.gz YCCDZBPQGOESMA-CGZBRXJRSA-N 1 3 280.500 3.770 20 0 CHADHO C(CN1CCCC1)[C@H]1CCCC[N@@H+]1CC1CCCCC1 ZINC001201397532 1123091905 /nfs/dbraw/zinc/09/19/05/1123091905.db2.gz JGYLINNXFYWNTI-GOSISDBHSA-N 1 3 278.484 3.907 20 0 CHADHO C(CN1CCCC1)[C@H]1CCCC[N@H+]1CC1CCCCC1 ZINC001201397532 1123091909 /nfs/dbraw/zinc/09/19/09/1123091909.db2.gz JGYLINNXFYWNTI-GOSISDBHSA-N 1 3 278.484 3.907 20 0 CHADHO C[C@@H]1CCCCC[N@@H+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167991555 1123093328 /nfs/dbraw/zinc/09/33/28/1123093328.db2.gz CPDOHYQZWRVESK-NAZJXLNTSA-N 1 3 276.468 3.656 20 0 CHADHO C[C@@H]1CCCCC[N@H+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167991555 1123093330 /nfs/dbraw/zinc/09/33/30/1123093330.db2.gz CPDOHYQZWRVESK-NAZJXLNTSA-N 1 3 276.468 3.656 20 0 CHADHO CC(C)=CCNC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000188455661 1123106800 /nfs/dbraw/zinc/10/68/00/1123106800.db2.gz GAMTZDKQQDQSDI-YQQQUEKLSA-N 1 3 284.447 3.738 20 0 CHADHO CC(C)=CCNC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000188455661 1123106804 /nfs/dbraw/zinc/10/68/04/1123106804.db2.gz GAMTZDKQQDQSDI-YQQQUEKLSA-N 1 3 284.447 3.738 20 0 CHADHO CCCN1C[C@@H]2C[NH+](C[C@H](C)CCC=C(C)C)C[C@H]2C1 ZINC001201496810 1123110081 /nfs/dbraw/zinc/11/00/81/1123110081.db2.gz RTZCVKFNVUUWGM-KZNAEPCWSA-N 1 3 278.484 3.643 20 0 CHADHO CCCCCC[N@@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001201754875 1123145897 /nfs/dbraw/zinc/14/58/97/1123145897.db2.gz LINVWPHZSADQRA-KRWDZBQOSA-N 1 3 266.473 3.907 20 0 CHADHO CCCCCC[N@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001201754875 1123145899 /nfs/dbraw/zinc/14/58/99/1123145899.db2.gz LINVWPHZSADQRA-KRWDZBQOSA-N 1 3 266.473 3.907 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@@H](C)c1ccc(F)c2ccccc21 ZINC000520620706 1123189775 /nfs/dbraw/zinc/18/97/75/1123189775.db2.gz KMUKALILPMOZOZ-KGLIPLIRSA-N 1 3 288.410 3.970 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@H](C)c1ccc(F)c2ccccc21 ZINC000520620708 1123189935 /nfs/dbraw/zinc/18/99/35/1123189935.db2.gz KMUKALILPMOZOZ-ZIAGYGMSSA-N 1 3 288.410 3.970 20 0 CHADHO CC(C)(C[NH2+]C[C@@H]1CCCC(C)(C)C1)CN1CCCC1 ZINC001202241601 1123193009 /nfs/dbraw/zinc/19/30/09/1123193009.db2.gz DZNXLNWJJZBGAF-MRXNPFEDSA-N 1 3 280.500 3.914 20 0 CHADHO NC1(C[NH2+][C@@H](c2cccs2)C2CCCC2)CCCC1 ZINC000665248450 1123260661 /nfs/dbraw/zinc/26/06/61/1123260661.db2.gz XHJNAAPMPVGNLU-OAHLLOKOSA-N 1 3 278.465 3.841 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)C1CCC(F)(F)CC1)CN1CCCC1 ZINC000474033088 1123312995 /nfs/dbraw/zinc/31/29/95/1123312995.db2.gz KTHVNFHJHBLANH-KGLIPLIRSA-N 1 3 288.426 3.522 20 0 CHADHO Cc1c2ccccc2oc1[C@H](C)NCC1=CC[N@H+](C)CC1 ZINC000271905998 1129115657 /nfs/dbraw/zinc/11/56/57/1129115657.db2.gz WQISDNZRFXBWIK-AWEZNQCLSA-N 1 3 284.403 3.654 20 0 CHADHO Cc1c2ccccc2oc1[C@H](C)NCC1=CC[N@@H+](C)CC1 ZINC000271905998 1129115660 /nfs/dbraw/zinc/11/56/60/1129115660.db2.gz WQISDNZRFXBWIK-AWEZNQCLSA-N 1 3 284.403 3.654 20 0 CHADHO C[C@H]([NH2+]C1CCN([C@H]2CCC[C@@H](C)C2)CC1)C1(C)CC1 ZINC000776883510 1123557108 /nfs/dbraw/zinc/55/71/08/1123557108.db2.gz ZLOMCXVEISFVEH-VYDXJSESSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@H]([NH3+])[C@@H]1CCN(Cc2ccc(-c3ccccc3)s2)C1 ZINC000346693999 1123707208 /nfs/dbraw/zinc/70/72/08/1123707208.db2.gz RBFYYLJRRZIMIO-DZGCQCFKSA-N 1 3 286.444 3.584 20 0 CHADHO C[C@@H]1CC[C@H](C)[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000777127829 1123708587 /nfs/dbraw/zinc/70/85/87/1123708587.db2.gz VKILSSQLKGPZMF-HWWDLCQESA-N 1 3 278.484 3.808 20 0 CHADHO Cc1ccc([C@@H]2CCCCN2C[C@@H]2CCC[NH2+]C2)cc1 ZINC000346982103 1123738836 /nfs/dbraw/zinc/73/88/36/1123738836.db2.gz MYSKPAHGRGJSRA-AEFFLSMTSA-N 1 3 272.436 3.522 20 0 CHADHO Cc1ccsc1[C@H](C)[NH2+]CC[C@H](C)N1CCCCC1 ZINC000544374996 1123747492 /nfs/dbraw/zinc/74/74/92/1123747492.db2.gz JOYGFELKENUZIE-GJZGRUSLSA-N 1 3 280.481 3.972 20 0 CHADHO CCCCN1CCC([NH2+]Cc2cc(C)cc(C)c2)CC1 ZINC000043393513 1123805589 /nfs/dbraw/zinc/80/55/89/1123805589.db2.gz AXIMGQPVTAIISQ-UHFFFAOYSA-N 1 3 274.452 3.658 20 0 CHADHO Cc1oc2ccccc2c1[C@H](C)N[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000925140171 1123823628 /nfs/dbraw/zinc/82/36/28/1123823628.db2.gz JAUWQMHBHVIGCI-VNHYZAJKSA-N 1 3 286.419 3.875 20 0 CHADHO Cc1oc2ccccc2c1[C@H](C)N[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000925140171 1123823634 /nfs/dbraw/zinc/82/36/34/1123823634.db2.gz JAUWQMHBHVIGCI-VNHYZAJKSA-N 1 3 286.419 3.875 20 0 CHADHO CC(C)[C@H](C[N@@H+]1CCC[C@@H](N(C)C)CC1)c1ccccc1 ZINC000475218629 1123824113 /nfs/dbraw/zinc/82/41/13/1123824113.db2.gz ZERBOVYNGZOLCF-MOPGFXCFSA-N 1 3 288.479 3.842 20 0 CHADHO CC(C)[C@H](C[N@H+]1CCC[C@@H](N(C)C)CC1)c1ccccc1 ZINC000475218629 1123824117 /nfs/dbraw/zinc/82/41/17/1123824117.db2.gz ZERBOVYNGZOLCF-MOPGFXCFSA-N 1 3 288.479 3.842 20 0 CHADHO C(C[C@@H]1CCSC1)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000865651798 1124002944 /nfs/dbraw/zinc/00/29/44/1124002944.db2.gz FSMNCAOGODZVQX-OAHLLOKOSA-N 1 3 296.524 3.516 20 0 CHADHO Cc1ccccc1[C@@H]1CCN(CCC[NH+]2CCCCC2)C1 ZINC000444574320 1124042933 /nfs/dbraw/zinc/04/29/33/1124042933.db2.gz PLOGFZOGJVJQHZ-GOSISDBHSA-N 1 3 286.463 3.660 20 0 CHADHO CC(C)([NH2+]CCCN1CCCCC1)c1ccc(F)c(F)c1 ZINC000444616114 1124045005 /nfs/dbraw/zinc/04/50/05/1124045005.db2.gz HWLJLVVQCALKMK-UHFFFAOYSA-N 1 3 296.405 3.666 20 0 CHADHO CC[C@@H](N[C@H]1CC[NH2+]CC(C)(C)C1)c1cccc(OC)c1 ZINC000635009193 1129170124 /nfs/dbraw/zinc/17/01/24/1129170124.db2.gz GGINPNFLOWOLBZ-DOTOQJQBSA-N 1 3 290.451 3.514 20 0 CHADHO C[C@@H]1C[C@@H](C)N1CC(C)(C)C[N@H+](C)Cc1ccccc1 ZINC000526989446 1124537798 /nfs/dbraw/zinc/53/77/98/1124537798.db2.gz CIKSWLLRZOEPBY-HZPDHXFCSA-N 1 3 274.452 3.627 20 0 CHADHO C[C@@H]1C[C@@H](C)N1CC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC000526989446 1124537803 /nfs/dbraw/zinc/53/78/03/1124537803.db2.gz CIKSWLLRZOEPBY-HZPDHXFCSA-N 1 3 274.452 3.627 20 0 CHADHO C[C@@H]1C[C@H](C)N1CC(C)(C)C[N@H+](C)Cc1ccccc1 ZINC000526989447 1124538585 /nfs/dbraw/zinc/53/85/85/1124538585.db2.gz CIKSWLLRZOEPBY-IYBDPMFKSA-N 1 3 274.452 3.627 20 0 CHADHO C[C@@H]1C[C@H](C)N1CC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC000526989447 1124538595 /nfs/dbraw/zinc/53/85/95/1124538595.db2.gz CIKSWLLRZOEPBY-IYBDPMFKSA-N 1 3 274.452 3.627 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H]1CCCN(CC(C)C)C1)C1CCC1 ZINC000449212460 1124670753 /nfs/dbraw/zinc/67/07/53/1124670753.db2.gz SQJPIBFIPBLMTE-DOTOQJQBSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@@H]1CCCC[C@@H]1C[NH2+][C@H]1CCN[C@@H](C(C)(C)C)C1 ZINC001246095752 1131309213 /nfs/dbraw/zinc/30/92/13/1131309213.db2.gz RVXVTCAWUKLWBB-LVQVYYBASA-N 1 3 266.473 3.569 20 0 CHADHO C[C@H](NCc1ccsc1)c1cccc(C[NH+](C)C)c1 ZINC000820807626 1131302827 /nfs/dbraw/zinc/30/28/27/1131302827.db2.gz MUFZTMFNWNHKSP-ZDUSSCGKSA-N 1 3 274.433 3.661 20 0 CHADHO CCc1ccc2nccc(N3CC[C@@H](C[N@@H+](C)CC)C3)c2c1 ZINC000450359732 1124998821 /nfs/dbraw/zinc/99/88/21/1124998821.db2.gz IBHKQIAPQTWHNQ-INIZCTEOSA-N 1 3 297.446 3.575 20 0 CHADHO CCc1ccc2nccc(N3CC[C@@H](C[N@H+](C)CC)C3)c2c1 ZINC000450359732 1124998826 /nfs/dbraw/zinc/99/88/26/1124998826.db2.gz IBHKQIAPQTWHNQ-INIZCTEOSA-N 1 3 297.446 3.575 20 0 CHADHO C1=C(CC[N@@H+]2CC[C@H](CN3CCCCC3)C2)CCCC1 ZINC000450440037 1125025866 /nfs/dbraw/zinc/02/58/66/1125025866.db2.gz OPEMZWATEGTHSG-GOSISDBHSA-N 1 3 276.468 3.685 20 0 CHADHO C1=C(CC[N@H+]2CC[C@H](CN3CCCCC3)C2)CCCC1 ZINC000450440037 1125025877 /nfs/dbraw/zinc/02/58/77/1125025877.db2.gz OPEMZWATEGTHSG-GOSISDBHSA-N 1 3 276.468 3.685 20 0 CHADHO C1=C(CCN2CC[C@H](C[NH+]3CCCCC3)C2)CCCC1 ZINC000450440037 1125025885 /nfs/dbraw/zinc/02/58/85/1125025885.db2.gz OPEMZWATEGTHSG-GOSISDBHSA-N 1 3 276.468 3.685 20 0 CHADHO CN(Cc1cc(C[N@H+](C)C2CCC2)ccc1F)C1CCC1 ZINC000450444196 1125027954 /nfs/dbraw/zinc/02/79/54/1125027954.db2.gz XVWOJFBXMISVIJ-UHFFFAOYSA-N 1 3 290.426 3.794 20 0 CHADHO CN(Cc1cc(C[N@@H+](C)C2CCC2)ccc1F)C1CCC1 ZINC000450444196 1125027964 /nfs/dbraw/zinc/02/79/64/1125027964.db2.gz XVWOJFBXMISVIJ-UHFFFAOYSA-N 1 3 290.426 3.794 20 0 CHADHO CCc1ccc(CNCCCC[N@H+]2C[C@H](C)C[C@H](C)C2)o1 ZINC000532112811 1125235699 /nfs/dbraw/zinc/23/56/99/1125235699.db2.gz PXVCNTPOEFDRHL-IYBDPMFKSA-N 1 3 292.467 3.690 20 0 CHADHO CCc1ccc(CNCCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)o1 ZINC000532112811 1125235703 /nfs/dbraw/zinc/23/57/03/1125235703.db2.gz PXVCNTPOEFDRHL-IYBDPMFKSA-N 1 3 292.467 3.690 20 0 CHADHO CS[C@@H]1CC[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000128318814 1125260996 /nfs/dbraw/zinc/26/09/96/1125260996.db2.gz DCOOWLLGANNVFI-NVXWUHKLSA-N 1 3 296.524 3.657 20 0 CHADHO CC[C@H](c1ccccc1)N1CCC(C)([NH+]2CCC2)CC1 ZINC000880472140 1125276845 /nfs/dbraw/zinc/27/68/45/1125276845.db2.gz DXNOSNQIMLYMFC-QGZVFWFLSA-N 1 3 272.436 3.698 20 0 CHADHO CCCCN1CCC([NH2+]Cc2ccc(CC)s2)CC1 ZINC000051718375 1125362693 /nfs/dbraw/zinc/36/26/93/1125362693.db2.gz ZSTWPHQUEARKJL-UHFFFAOYSA-N 1 3 280.481 3.665 20 0 CHADHO Cc1cccc([C@@H](C)N[C@H]2CC[N@H+](C)C(C)(C)C2)c1C ZINC000623420814 1125378039 /nfs/dbraw/zinc/37/80/39/1125378039.db2.gz PGELICKWPCGAII-CVEARBPZSA-N 1 3 274.452 3.827 20 0 CHADHO Cc1cccc([C@@H](C)N[C@H]2CC[N@@H+](C)C(C)(C)C2)c1C ZINC000623420814 1125378043 /nfs/dbraw/zinc/37/80/43/1125378043.db2.gz PGELICKWPCGAII-CVEARBPZSA-N 1 3 274.452 3.827 20 0 CHADHO Cc1cccc(CC[C@@H](C)[NH2+]C[C@@H]2CCN(C(C)C)C2)c1 ZINC000040623589 1125388859 /nfs/dbraw/zinc/38/88/59/1125388859.db2.gz UJQWKOAPZJAMAY-MJGOQNOKSA-N 1 3 288.479 3.636 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC[C@@H]2CCCC2(F)F)CC1 ZINC000883273366 1125390555 /nfs/dbraw/zinc/39/05/55/1125390555.db2.gz JWMWCELIZCYLBR-ZDUSSCGKSA-N 1 3 288.426 3.664 20 0 CHADHO CCC[NH+]1CCC(N[C@@H](c2ccc(F)cc2)C(C)C)CC1 ZINC000035016576 1125422536 /nfs/dbraw/zinc/42/25/36/1125422536.db2.gz WPBFRKBUYMDSDX-GOSISDBHSA-N 1 3 292.442 3.987 20 0 CHADHO CN1CCC[C@H]1CC[NH2+][C@@H](c1ccccc1)C1CCC1 ZINC000348267282 1125453065 /nfs/dbraw/zinc/45/30/65/1125453065.db2.gz PUGGNPFLRWNURP-ROUUACIJSA-N 1 3 272.436 3.602 20 0 CHADHO C[N@@H+]1CCC[C@H]1CCN[C@@H](c1ccccc1)C1CCC1 ZINC000348267282 1125453067 /nfs/dbraw/zinc/45/30/67/1125453067.db2.gz PUGGNPFLRWNURP-ROUUACIJSA-N 1 3 272.436 3.602 20 0 CHADHO C[N@H+]1CCC[C@H]1CCN[C@@H](c1ccccc1)C1CCC1 ZINC000348267282 1125453069 /nfs/dbraw/zinc/45/30/69/1125453069.db2.gz PUGGNPFLRWNURP-ROUUACIJSA-N 1 3 272.436 3.602 20 0 CHADHO C[C@H](NCc1cccc(-c2ccccc2)c1)[C@@H]1CCC[NH2+]C1 ZINC000414855687 1129196144 /nfs/dbraw/zinc/19/61/44/1129196144.db2.gz NGVIPEZCUNMNCO-OXJNMPFZSA-N 1 3 294.442 3.831 20 0 CHADHO CC[NH+](CC)Cc1ccccc1CNCc1ccncc1C ZINC000294801068 1129216921 /nfs/dbraw/zinc/21/69/21/1129216921.db2.gz PKKMBQWOPNBIKH-UHFFFAOYSA-N 1 3 297.446 3.522 20 0 CHADHO CN(Cc1cc(Cl)ccc1Cl)C1CCC([NH3+])CC1 ZINC000091848002 1129373480 /nfs/dbraw/zinc/37/34/80/1129373480.db2.gz WWDLWGMRTFMENQ-UHFFFAOYSA-N 1 3 287.234 3.695 20 0 CHADHO NC[C@H]1CCCC[N@H+](CC2(c3ccccc3)CCCC2)C1 ZINC001206606214 1129381170 /nfs/dbraw/zinc/38/11/70/1129381170.db2.gz HEZVUYPIIGVLEW-QGZVFWFLSA-N 1 3 286.463 3.559 20 0 CHADHO NC[C@H]1CCCC[N@@H+](CC2(c3ccccc3)CCCC2)C1 ZINC001206606214 1129381173 /nfs/dbraw/zinc/38/11/73/1129381173.db2.gz HEZVUYPIIGVLEW-QGZVFWFLSA-N 1 3 286.463 3.559 20 0 CHADHO C[C@@H](N)C[NH2+][C@@H](C)c1ccc(-c2c(F)cccc2F)cc1 ZINC000643527634 1129444917 /nfs/dbraw/zinc/44/49/17/1129444917.db2.gz PWDLDQSWPWKBDT-NEPJUHHUSA-N 1 3 290.357 3.630 20 0 CHADHO C[C@@H]([C@H](C)[NH2+][C@H]1CCNC2(CCC2)C1)C1CCCCC1 ZINC000643546868 1129445377 /nfs/dbraw/zinc/44/53/77/1129445377.db2.gz VZCDHCMBYYHSDY-ZOBUZTSGSA-N 1 3 278.484 3.856 20 0 CHADHO C[C@H]1SCC[C@H]1[NH2+]C1CCN([C@H]2CCC[C@@H](C)C2)CC1 ZINC000647357645 1129575089 /nfs/dbraw/zinc/57/50/89/1129575089.db2.gz GELKQOTWADHWBF-TXCZRRACSA-N 1 3 296.524 3.513 20 0 CHADHO CCC[C@@H](NCc1ccc(C[NH3+])cc1)c1ccsc1 ZINC000647803295 1129584472 /nfs/dbraw/zinc/58/44/72/1129584472.db2.gz RRQXTDODSYYNMN-MRXNPFEDSA-N 1 3 274.433 3.838 20 0 CHADHO Fc1ccc(CN(C[C@@H]2CC[NH2+]C2)C2CCCCC2)cc1 ZINC000647872764 1129586239 /nfs/dbraw/zinc/58/62/39/1129586239.db2.gz PBARJDYHCSDCNO-MRXNPFEDSA-N 1 3 290.426 3.570 20 0 CHADHO CCN(CC)[C@@H](CNc1[nH+]ccc2[nH]ccc21)c1ccco1 ZINC000647860880 1129586420 /nfs/dbraw/zinc/58/64/20/1129586420.db2.gz CUQXUSTYILMOBH-HNNXBMFYSA-N 1 3 298.390 3.651 20 0 CHADHO CCCN(C[C@@H]1CC[NH2+]C1)[C@H](C)c1cc2ccccc2o1 ZINC000647882243 1129587368 /nfs/dbraw/zinc/58/73/68/1129587368.db2.gz ZVFNFTKSJZXHIE-HUUCEWRRSA-N 1 3 286.419 3.815 20 0 CHADHO CN(C)CC(C)(C)C[NH2+][C@H]1CCSc2c(F)cccc21 ZINC000037197191 1129596361 /nfs/dbraw/zinc/59/63/61/1129596361.db2.gz QTDZVXARTDGJLP-AWEZNQCLSA-N 1 3 296.455 3.540 20 0 CHADHO CN1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1cc(Cl)cc(Cl)c1)C2 ZINC001169093808 1129696717 /nfs/dbraw/zinc/69/67/17/1129696717.db2.gz JGFMOLFAEZFDJP-QDMKHBRRSA-N 1 3 299.245 3.708 20 0 CHADHO C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)N2C)c1ccc(F)c(Cl)c1 ZINC001169099745 1129696820 /nfs/dbraw/zinc/69/68/20/1129696820.db2.gz UQVKJDSQSKMKND-ZRJCITRHSA-N 1 3 296.817 3.755 20 0 CHADHO CC[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)N2C)c1cc(F)cc(F)c1 ZINC001169119559 1129700899 /nfs/dbraw/zinc/70/08/99/1129700899.db2.gz ULAMKJLVFQTSDV-WCXIOVBPSA-N 1 3 294.389 3.631 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@H](N1CCC[C@H]1c1cccc(F)c1)C2 ZINC001169142440 1129704309 /nfs/dbraw/zinc/70/43/09/1129704309.db2.gz USYUIFQTQFKZET-MHORFTMASA-N 1 3 288.410 3.588 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](N1CCC[C@H]1c1cccc(F)c1)C2 ZINC001169142440 1129704312 /nfs/dbraw/zinc/70/43/12/1129704312.db2.gz USYUIFQTQFKZET-MHORFTMASA-N 1 3 288.410 3.588 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H]2CCCC(C)(C)CC2)C1 ZINC000086906400 1129818817 /nfs/dbraw/zinc/81/88/17/1129818817.db2.gz SJCZIOIATQCFKV-HZPDHXFCSA-N 1 3 266.473 3.665 20 0 CHADHO C(C1CCCCC1)N1CCC([NH2+]C2CCCC2)CC1 ZINC000749308561 1129994506 /nfs/dbraw/zinc/99/45/06/1129994506.db2.gz YZSDQKWFCNREHZ-UHFFFAOYSA-N 1 3 264.457 3.563 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@H]1CCC=CCCC1 ZINC000902456652 1130012431 /nfs/dbraw/zinc/01/24/31/1130012431.db2.gz PYFRHRQMEGUWRY-HOCLYGCPSA-N 1 3 287.451 3.636 20 0 CHADHO Cc1ccc(CN2CCCC[C@H]2C[C@@H]2CCC[N@H+]2C)s1 ZINC001204033533 1130206843 /nfs/dbraw/zinc/20/68/43/1130206843.db2.gz FTUUJSPYOYPDNC-HOTGVXAUSA-N 1 3 292.492 3.895 20 0 CHADHO Cc1ccc(CN2CCCC[C@H]2C[C@@H]2CCC[N@@H+]2C)s1 ZINC001204033533 1130206847 /nfs/dbraw/zinc/20/68/47/1130206847.db2.gz FTUUJSPYOYPDNC-HOTGVXAUSA-N 1 3 292.492 3.895 20 0 CHADHO Cc1ccc(C[N@H+]2CCCC[C@H]2C[C@@H]2CCCN2C)s1 ZINC001204033533 1130206852 /nfs/dbraw/zinc/20/68/52/1130206852.db2.gz FTUUJSPYOYPDNC-HOTGVXAUSA-N 1 3 292.492 3.895 20 0 CHADHO Cc1ccc(C[N@@H+]2CCCC[C@H]2C[C@@H]2CCCN2C)s1 ZINC001204033533 1130206856 /nfs/dbraw/zinc/20/68/56/1130206856.db2.gz FTUUJSPYOYPDNC-HOTGVXAUSA-N 1 3 292.492 3.895 20 0 CHADHO C[C@@H]1CC[C@H](N2CCC([NH3+])(c3ccc(Cl)cc3)CC2)C1 ZINC001170122407 1130282418 /nfs/dbraw/zinc/28/24/18/1130282418.db2.gz QDTAGZXFWCXVIX-CJNGLKHVSA-N 1 3 292.854 3.778 20 0 CHADHO C[C@H](CC[NH2+]C[C@@H]1CCc2ccccc21)N1CCCCC1 ZINC000790056710 1130288875 /nfs/dbraw/zinc/28/88/75/1130288875.db2.gz XKXVRPAHRBZVGC-AEFFLSMTSA-N 1 3 286.463 3.571 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2cccc3cnccc32)C[C@@H]1C ZINC000679990550 1130567435 /nfs/dbraw/zinc/56/74/35/1130567435.db2.gz VEPYPQYFZSTHCC-YJBOKZPZSA-N 1 3 297.446 3.539 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2cccc3cnccc32)C[C@@H]1C ZINC000679990550 1130567441 /nfs/dbraw/zinc/56/74/41/1130567441.db2.gz VEPYPQYFZSTHCC-YJBOKZPZSA-N 1 3 297.446 3.539 20 0 CHADHO Cc1cccc(-c2ccc(C[N@@H+]3CC4CC3(CN)C4)cc2)c1 ZINC001235008106 1130703432 /nfs/dbraw/zinc/70/34/32/1130703432.db2.gz QNPHYEAITDMTRP-UHFFFAOYSA-N 1 3 292.426 3.585 20 0 CHADHO Cc1cccc(-c2ccc(C[N@H+]3CC4CC3(CN)C4)cc2)c1 ZINC001235008106 1130703438 /nfs/dbraw/zinc/70/34/38/1130703438.db2.gz QNPHYEAITDMTRP-UHFFFAOYSA-N 1 3 292.426 3.585 20 0 CHADHO Cc1cc(C)c(CN2CCC[C@@]3(CCC[NH2+]3)CC2)c(C)c1 ZINC001235040302 1130704072 /nfs/dbraw/zinc/70/40/72/1130704072.db2.gz KJCBWQHAZAMDBG-IBGZPJMESA-N 1 3 286.463 3.720 20 0 CHADHO c1cc2cccc(CN3CCC[C@]4(CCC[NH2+]4)CC3)c2o1 ZINC001235040998 1130704710 /nfs/dbraw/zinc/70/47/10/1130704710.db2.gz WBRPXHKMKZMAJW-GOSISDBHSA-N 1 3 284.403 3.541 20 0 CHADHO c1cc(-c2ccccc2)sc1CN1CC2(C1)CC[NH2+]CC2 ZINC001235088453 1130708947 /nfs/dbraw/zinc/70/89/47/1130708947.db2.gz HCZUIXBDBLXOBJ-UHFFFAOYSA-N 1 3 298.455 3.601 20 0 CHADHO CC(C)c1cccc(C[N@@H+]2CCCC23CCNCC3)c1 ZINC001235145827 1130715375 /nfs/dbraw/zinc/71/53/75/1130715375.db2.gz VPLUEZMDZHEKEZ-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO CC(C)c1cccc(C[N@H+]2CCCC23CCNCC3)c1 ZINC001235145827 1130715380 /nfs/dbraw/zinc/71/53/80/1130715380.db2.gz VPLUEZMDZHEKEZ-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO CC(C)c1cccc(CN2CCCC23CC[NH2+]CC3)c1 ZINC001235145827 1130715382 /nfs/dbraw/zinc/71/53/82/1130715382.db2.gz VPLUEZMDZHEKEZ-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO [NH3+]C[C@H]1CCCN(Cc2ccc3oc4ccccc4c3c2)C1 ZINC001235672405 1130764709 /nfs/dbraw/zinc/76/47/09/1130764709.db2.gz CLMVCFGKADIBDV-OAHLLOKOSA-N 1 3 294.398 3.757 20 0 CHADHO CCC[C@H]1CCCC[N@@H+]1Cc1cc2c(s1)CNCC2 ZINC001235694875 1130769477 /nfs/dbraw/zinc/76/94/77/1130769477.db2.gz WWGJPNGISLBJFJ-AWEZNQCLSA-N 1 3 278.465 3.548 20 0 CHADHO CCC[C@H]1CCCC[N@H+]1Cc1cc2c(s1)CNCC2 ZINC001235694875 1130769481 /nfs/dbraw/zinc/76/94/81/1130769481.db2.gz WWGJPNGISLBJFJ-AWEZNQCLSA-N 1 3 278.465 3.548 20 0 CHADHO [NH3+]CCCCCCN1CCC[C@@H]1c1cc(F)ccc1F ZINC001235712514 1130771235 /nfs/dbraw/zinc/77/12/35/1130771235.db2.gz BLAXWPZZXZMHBA-MRXNPFEDSA-N 1 3 282.378 3.621 20 0 CHADHO CC[N@H+](Cc1c(C)c(C)c(C)c(C)c1C)C1CCNCC1 ZINC001235760684 1130776919 /nfs/dbraw/zinc/77/69/19/1130776919.db2.gz HOVQSNIIHHKLFV-UHFFFAOYSA-N 1 3 288.479 3.803 20 0 CHADHO CC[N@@H+](Cc1c(C)c(C)c(C)c(C)c1C)C1CCNCC1 ZINC001235760684 1130776925 /nfs/dbraw/zinc/77/69/25/1130776925.db2.gz HOVQSNIIHHKLFV-UHFFFAOYSA-N 1 3 288.479 3.803 20 0 CHADHO CCN(Cc1c(C)c(C)c(C)c(C)c1C)C1CC[NH2+]CC1 ZINC001235760684 1130776931 /nfs/dbraw/zinc/77/69/31/1130776931.db2.gz HOVQSNIIHHKLFV-UHFFFAOYSA-N 1 3 288.479 3.803 20 0 CHADHO CCCCCCc1csc(CN2CC[C@@H](C[NH3+])C2)c1 ZINC001235751394 1130777282 /nfs/dbraw/zinc/77/72/82/1130777282.db2.gz XWOAETFVYKPIRL-HNNXBMFYSA-N 1 3 280.481 3.652 20 0 CHADHO C[C@@H](C[NH2+]Cc1ccccc1-c1ccccc1)CN(C)C ZINC000813784747 1130783131 /nfs/dbraw/zinc/78/31/31/1130783131.db2.gz QFMXUPZYFOVRIO-INIZCTEOSA-N 1 3 282.431 3.641 20 0 CHADHO C[C@@H](CNCc1ccccc1-c1ccccc1)C[NH+](C)C ZINC000813784747 1130783134 /nfs/dbraw/zinc/78/31/34/1130783134.db2.gz QFMXUPZYFOVRIO-INIZCTEOSA-N 1 3 282.431 3.641 20 0 CHADHO CCCCCCc1csc(CN2CC(CC[NH3+])C2)c1 ZINC001235918902 1130804220 /nfs/dbraw/zinc/80/42/20/1130804220.db2.gz OQWNSWWCLXSCOA-UHFFFAOYSA-N 1 3 280.481 3.652 20 0 CHADHO Clc1ccc([C@@H]2CCN(CC[C@@H]3CCCC[NH2+]3)C2)cc1 ZINC001235946725 1130812238 /nfs/dbraw/zinc/81/22/38/1130812238.db2.gz AGFBJVVVIJPTNZ-WBVHZDCISA-N 1 3 292.854 3.662 20 0 CHADHO C[C@H]1C[C@H](N)C[N@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001236047180 1130837011 /nfs/dbraw/zinc/83/70/11/1130837011.db2.gz LDPSJURSMXUQDK-KBPBESRZSA-N 1 3 299.462 3.635 20 0 CHADHO C[C@H]1C[C@H](N)C[N@@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001236047180 1130837018 /nfs/dbraw/zinc/83/70/18/1130837018.db2.gz LDPSJURSMXUQDK-KBPBESRZSA-N 1 3 299.462 3.635 20 0 CHADHO Cc1ccc(-c2ccc(C[N@@H+]3CCCN[C@@H](C)C3)cc2)cc1 ZINC001236095412 1130859203 /nfs/dbraw/zinc/85/92/03/1130859203.db2.gz TUEYWEXIASAKQJ-KRWDZBQOSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1ccc(-c2ccc(C[N@H+]3CCCN[C@@H](C)C3)cc2)cc1 ZINC001236095412 1130859211 /nfs/dbraw/zinc/85/92/11/1130859211.db2.gz TUEYWEXIASAKQJ-KRWDZBQOSA-N 1 3 294.442 3.846 20 0 CHADHO CC(C)=CCC[C@H](C)CN(C)[C@H]1CCCC[C@H]1[NH3+] ZINC001236210541 1130887934 /nfs/dbraw/zinc/88/79/34/1130887934.db2.gz DFZMOYAUJVVPTF-XHSDSOJGSA-N 1 3 252.446 3.571 20 0 CHADHO CN(Cc1cc(Cl)ccc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236224750 1130896183 /nfs/dbraw/zinc/89/61/83/1130896183.db2.gz WWDLWGMRTFMENQ-JOCQHMNTSA-N 1 3 287.234 3.695 20 0 CHADHO C(C[NH2+]C1CCCCC1)CN1CCCC2(CCC2)C1 ZINC001236322683 1130914378 /nfs/dbraw/zinc/91/43/78/1130914378.db2.gz RRUQLFMGWCIRSP-UHFFFAOYSA-N 1 3 264.457 3.565 20 0 CHADHO CCN(Cc1c(C)c(C)c(C)c(C)c1C)C[C@@H]1CC[NH2+]C1 ZINC001236407412 1130931169 /nfs/dbraw/zinc/93/11/69/1130931169.db2.gz FCTKJFPTCVGHPA-GOSISDBHSA-N 1 3 288.479 3.660 20 0 CHADHO C[C@H]1[C@H](N)CCC[N@@H+]1Cc1cccc2c3ccccc3oc21 ZINC001236419414 1130934716 /nfs/dbraw/zinc/93/47/16/1130934716.db2.gz INSOLOLECCMIBI-SUMWQHHRSA-N 1 3 294.398 3.898 20 0 CHADHO C[C@H]1[C@H](N)CCC[N@H+]1Cc1cccc2c3ccccc3oc21 ZINC001236419414 1130934720 /nfs/dbraw/zinc/93/47/20/1130934720.db2.gz INSOLOLECCMIBI-SUMWQHHRSA-N 1 3 294.398 3.898 20 0 CHADHO Cc1c(F)cccc1CN(CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236458197 1130946225 /nfs/dbraw/zinc/94/62/25/1130946225.db2.gz SKKBXPKXTFCAFS-UHFFFAOYSA-N 1 3 292.442 3.734 20 0 CHADHO Cc1c(F)cccc1C[N@H+](CC(C)(C)C)C1CCNCC1 ZINC001236458197 1130946227 /nfs/dbraw/zinc/94/62/27/1130946227.db2.gz SKKBXPKXTFCAFS-UHFFFAOYSA-N 1 3 292.442 3.734 20 0 CHADHO Cc1c(F)cccc1C[N@@H+](CC(C)(C)C)C1CCNCC1 ZINC001236458197 1130946229 /nfs/dbraw/zinc/94/62/29/1130946229.db2.gz SKKBXPKXTFCAFS-UHFFFAOYSA-N 1 3 292.442 3.734 20 0 CHADHO Cc1ccc([C@H](C)CC[N@H+](CCN)Cc2ccccc2)o1 ZINC001236521449 1130963515 /nfs/dbraw/zinc/96/35/15/1130963515.db2.gz BRALPBRHICQOHH-OAHLLOKOSA-N 1 3 286.419 3.543 20 0 CHADHO Cc1ccc([C@H](C)CC[N@@H+](CCN)Cc2ccccc2)o1 ZINC001236521449 1130963518 /nfs/dbraw/zinc/96/35/18/1130963518.db2.gz BRALPBRHICQOHH-OAHLLOKOSA-N 1 3 286.419 3.543 20 0 CHADHO CCCN(Cc1ccc(Cl)c(CC)c1)C[C@H]1CC[NH2+]C1 ZINC001236842577 1131021097 /nfs/dbraw/zinc/02/10/97/1131021097.db2.gz FPSDOLPCYKVDQU-HNNXBMFYSA-N 1 3 294.870 3.724 20 0 CHADHO CCCN(Cc1ccc(C2CCC2)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236843130 1131021272 /nfs/dbraw/zinc/02/12/72/1131021272.db2.gz LBBWIQDZAPNQLF-QGZVFWFLSA-N 1 3 286.463 3.776 20 0 CHADHO CC[C@H](N)C[N@H+](C)Cc1ccccc1-c1ccccc1 ZINC001236871179 1131027595 /nfs/dbraw/zinc/02/75/95/1131027595.db2.gz YPJKZDPXWXZDKM-KRWDZBQOSA-N 1 3 268.404 3.523 20 0 CHADHO CC[C@H](N)C[N@@H+](C)Cc1ccccc1-c1ccccc1 ZINC001236871179 1131027603 /nfs/dbraw/zinc/02/76/03/1131027603.db2.gz YPJKZDPXWXZDKM-KRWDZBQOSA-N 1 3 268.404 3.523 20 0 CHADHO C[C@]1(C[NH3+])CCCN(Cc2ccc(-c3ccccc3)cc2)C1 ZINC001237056708 1131042059 /nfs/dbraw/zinc/04/20/59/1131042059.db2.gz IXODKLSQEUHSKC-HXUWFJFHSA-N 1 3 294.442 3.914 20 0 CHADHO C[C@@]1(C[NH3+])CCCN(Cc2ccc(-c3ccccc3)cc2)C1 ZINC001237056706 1131043753 /nfs/dbraw/zinc/04/37/53/1131043753.db2.gz IXODKLSQEUHSKC-FQEVSTJZSA-N 1 3 294.442 3.914 20 0 CHADHO Cc1ccc2ccccc2c1CN1CC[C@H]2[NH2+]CCC[C@H]2C1 ZINC001237408183 1131096204 /nfs/dbraw/zinc/09/62/04/1131096204.db2.gz ZAFWLDFHUKQROJ-FXAWDEMLSA-N 1 3 294.442 3.722 20 0 CHADHO Cc1cc(C)c(Cl)c(CN2CCC(C[NH+](C)C)CC2)c1 ZINC001237704937 1131130861 /nfs/dbraw/zinc/13/08/61/1131130861.db2.gz VCLYWBMXMBEJPT-UHFFFAOYSA-N 1 3 294.870 3.730 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+](C)CC3CCC3)cc21 ZINC001237877637 1131147160 /nfs/dbraw/zinc/14/71/60/1131147160.db2.gz BCLGRJCTSARCSF-UHFFFAOYSA-N 1 3 284.447 3.920 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+](C)CC3CCC3)cc21 ZINC001237877637 1131147162 /nfs/dbraw/zinc/14/71/62/1131147162.db2.gz BCLGRJCTSARCSF-UHFFFAOYSA-N 1 3 284.447 3.920 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2ccnc(Cl)c2)cc1 ZINC000817961783 1131192595 /nfs/dbraw/zinc/19/25/95/1131192595.db2.gz CCEYNFRLOJWBGH-NEPJUHHUSA-N 1 3 289.810 3.606 20 0 CHADHO CCCCC[C@H]([NH2+][C@H]1CCN[C@H](C)C1)C(C)(C)C ZINC000817970778 1131193852 /nfs/dbraw/zinc/19/38/52/1131193852.db2.gz FCHAEWJUWACVIT-ILXRZTDVSA-N 1 3 254.462 3.712 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCNC2(CCC2)C1)C1CCCCC1 ZINC000817987171 1131195344 /nfs/dbraw/zinc/19/53/44/1131195344.db2.gz XIFLMYSOMGVFGA-CVEARBPZSA-N 1 3 264.457 3.610 20 0 CHADHO C[NH2+][C@@H](C)CCN[C@@H](c1cccs1)C1CCCC1 ZINC001118121864 1131211473 /nfs/dbraw/zinc/21/14/73/1131211473.db2.gz KCMURVMZGJTQPY-SWLSCSKDSA-N 1 3 266.454 3.567 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CCN[C@@H](C(C)(C)C)C1)C1CCCCC1 ZINC001246243684 1131430076 /nfs/dbraw/zinc/43/00/76/1131430076.db2.gz HIQDODYKGCOLKY-FVQBIDKESA-N 1 3 266.473 3.712 20 0 CHADHO C[C@H]1C[C@H]([NH2+]CCCCCCCCCCCCO)CCN1 ZINC001246271076 1131437699 /nfs/dbraw/zinc/43/76/99/1131437699.db2.gz HOIBFXVMWRYDEC-ZWKOTPCHSA-N 1 3 298.515 3.610 20 0 CHADHO C[NH+]1CCC2(CN(Cc3ccc(F)c4ccccc34)C2)CC1 ZINC001139892428 1131649186 /nfs/dbraw/zinc/64/91/86/1131649186.db2.gz PFMHKVNZHRJDQR-UHFFFAOYSA-N 1 3 298.405 3.507 20 0 CHADHO NC[C@H]1CCCC[N@@H+](C2CCC3(CCCCC3)CC2)C1 ZINC001246583828 1131690532 /nfs/dbraw/zinc/69/05/32/1131690532.db2.gz SDKJOPYMAXMYER-MRXNPFEDSA-N 1 3 278.484 3.940 20 0 CHADHO NC[C@H]1CCCC[N@H+](C2CCC3(CCCCC3)CC2)C1 ZINC001246583828 1131690535 /nfs/dbraw/zinc/69/05/35/1131690535.db2.gz SDKJOPYMAXMYER-MRXNPFEDSA-N 1 3 278.484 3.940 20 0 CHADHO C[C@@H]1C[C@H]([N@@H+]2CCC[C@@]3(CCCCN3)C2)CC(C)(C)C1 ZINC001246614162 1131718477 /nfs/dbraw/zinc/71/84/77/1131718477.db2.gz MNXWGLQKFDMUFJ-RYRKJORJSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H]1C[C@H]([N@H+]2CCC[C@@]3(CCCCN3)C2)CC(C)(C)C1 ZINC001246614162 1131718482 /nfs/dbraw/zinc/71/84/82/1131718482.db2.gz MNXWGLQKFDMUFJ-RYRKJORJSA-N 1 3 278.484 3.809 20 0 CHADHO CCCC[C@H](CC(C)C)[N@H+]1C[C@H](C2(N)CC2)[C@H](CF)C1 ZINC001246689310 1131782042 /nfs/dbraw/zinc/78/20/42/1131782042.db2.gz INTDLKHXRBRWHH-OAGGEKHMSA-N 1 3 284.463 3.600 20 0 CHADHO CCCC[C@H](CC(C)C)[N@@H+]1C[C@H](C2(N)CC2)[C@H](CF)C1 ZINC001246689310 1131782045 /nfs/dbraw/zinc/78/20/45/1131782045.db2.gz INTDLKHXRBRWHH-OAGGEKHMSA-N 1 3 284.463 3.600 20 0 CHADHO CCCN(Cc1ccccc1)[C@@H]1CC[NH2+][C@H](C(C)C)C1 ZINC001246776623 1131782677 /nfs/dbraw/zinc/78/26/77/1131782677.db2.gz LITAGRPVHPVJCC-MSOLQXFVSA-N 1 3 274.452 3.675 20 0 CHADHO CC(C)CC(CC(C)C)[N@H+]1C[C@H](C(F)(F)F)C[C@H](N)C1 ZINC001246827543 1131786025 /nfs/dbraw/zinc/78/60/25/1131786025.db2.gz MLTOQMRACDWLMY-OLZOCXBDSA-N 1 3 294.405 3.659 20 0 CHADHO CC(C)CC(CC(C)C)[N@@H+]1C[C@H](C(F)(F)F)C[C@H](N)C1 ZINC001246827543 1131786029 /nfs/dbraw/zinc/78/60/29/1131786029.db2.gz MLTOQMRACDWLMY-OLZOCXBDSA-N 1 3 294.405 3.659 20 0 CHADHO C[NH2+]CC[C@H](C)N1CCC[C@@H]1c1ccccc1SC ZINC001246884590 1131803773 /nfs/dbraw/zinc/80/37/73/1131803773.db2.gz BZNQXGJMLLWRAJ-DZGCQCFKSA-N 1 3 278.465 3.543 20 0 CHADHO CC1(C)CC[C@H]([N@H+](C[C@@H]2CCCNC2)C2CCCC2)C1 ZINC001246937917 1131822478 /nfs/dbraw/zinc/82/24/78/1131822478.db2.gz NKAOUUKGIWWSBA-WBVHZDCISA-N 1 3 278.484 3.809 20 0 CHADHO CC1(C)CC[C@H]([N@@H+](C[C@@H]2CCCNC2)C2CCCC2)C1 ZINC001246937917 1131822486 /nfs/dbraw/zinc/82/24/86/1131822486.db2.gz NKAOUUKGIWWSBA-WBVHZDCISA-N 1 3 278.484 3.809 20 0 CHADHO Cc1ccc([C@@H]2CCCN2CC[C@H]2CCC[N@H+]2C)s1 ZINC000348155879 1131890935 /nfs/dbraw/zinc/89/09/35/1131890935.db2.gz CKIIULIKIXGELX-CABCVRRESA-N 1 3 278.465 3.678 20 0 CHADHO Cc1ccc([C@@H]2CCCN2CC[C@H]2CCC[N@@H+]2C)s1 ZINC000348155879 1131890945 /nfs/dbraw/zinc/89/09/45/1131890945.db2.gz CKIIULIKIXGELX-CABCVRRESA-N 1 3 278.465 3.678 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@@H]2CCCC23CCC3)CC1(C)C ZINC001171629200 1132061679 /nfs/dbraw/zinc/06/16/79/1132061679.db2.gz PHBCKNIAKUZDKC-OAHLLOKOSA-N 1 3 278.484 3.950 20 0 CHADHO CN1C(C)(C)CC([N@@H+]2CCCC[C@@](C)(F)C2)CC1(C)C ZINC001171631500 1132062019 /nfs/dbraw/zinc/06/20/19/1132062019.db2.gz JURSCPIIJNQMFB-QGZVFWFLSA-N 1 3 284.463 3.852 20 0 CHADHO CN1C(C)(C)CC([N@H+]2CCCC[C@@](C)(F)C2)CC1(C)C ZINC001171631500 1132062027 /nfs/dbraw/zinc/06/20/27/1132062027.db2.gz JURSCPIIJNQMFB-QGZVFWFLSA-N 1 3 284.463 3.852 20 0 CHADHO C[NH+]1C(C)(C)CC(N2CCCC[C@@](C)(F)C2)CC1(C)C ZINC001171631500 1132062034 /nfs/dbraw/zinc/06/20/34/1132062034.db2.gz JURSCPIIJNQMFB-QGZVFWFLSA-N 1 3 284.463 3.852 20 0 CHADHO C[C@H]1CCC[C@H]([NH2+]C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001171613179 1132064911 /nfs/dbraw/zinc/06/49/11/1132064911.db2.gz GYZJEMGOEGMCOT-KBPBESRZSA-N 1 3 266.473 3.806 20 0 CHADHO C[C@@H]1CCC[C@H]([NH2+]C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001171613181 1132065573 /nfs/dbraw/zinc/06/55/73/1132065573.db2.gz GYZJEMGOEGMCOT-KGLIPLIRSA-N 1 3 266.473 3.806 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccc(F)c(Cl)c1)C2 ZINC001172100515 1132124536 /nfs/dbraw/zinc/12/45/36/1132124536.db2.gz DDWVXPCWORFFSQ-BTTYYORXSA-N 1 3 296.817 3.584 20 0 CHADHO CCc1ccc(CN(C)[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172129428 1132127781 /nfs/dbraw/zinc/12/77/81/1132127781.db2.gz ZNMDZPAXNSUBSC-REPLKXPHSA-N 1 3 286.463 3.696 20 0 CHADHO CCc1ccc(CN(C)[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172129428 1132127784 /nfs/dbraw/zinc/12/77/84/1132127784.db2.gz ZNMDZPAXNSUBSC-REPLKXPHSA-N 1 3 286.463 3.696 20 0 CHADHO C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](NC(C)(C)c1cccc(F)c1)C2 ZINC001172111282 1132134107 /nfs/dbraw/zinc/13/41/07/1132134107.db2.gz RGCQMCNJCITBFC-OSYLJGHBSA-N 1 3 290.426 3.666 20 0 CHADHO C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H](NC(C)(C)c1cccc(F)c1)C2 ZINC001172111282 1132134109 /nfs/dbraw/zinc/13/41/09/1132134109.db2.gz RGCQMCNJCITBFC-OSYLJGHBSA-N 1 3 290.426 3.666 20 0 CHADHO CN(Cc1cccc(Cl)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172122905 1132135359 /nfs/dbraw/zinc/13/53/59/1132135359.db2.gz VLHPFGUINVRHCQ-BJWYYQGGSA-N 1 3 292.854 3.787 20 0 CHADHO CN(Cc1cccc(Cl)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172122905 1132135361 /nfs/dbraw/zinc/13/53/61/1132135361.db2.gz VLHPFGUINVRHCQ-BJWYYQGGSA-N 1 3 292.854 3.787 20 0 CHADHO CC[C@H](C)OCC[C@H](C)[N@H+](CCCN)C1CCCCC1 ZINC001172315212 1132156410 /nfs/dbraw/zinc/15/64/10/1132156410.db2.gz GFSZWDPFJGCECY-HOTGVXAUSA-N 1 3 284.488 3.564 20 0 CHADHO CC[C@H](C)OCC[C@H](C)[N@@H+](CCCN)C1CCCCC1 ZINC001172315212 1132156413 /nfs/dbraw/zinc/15/64/13/1132156413.db2.gz GFSZWDPFJGCECY-HOTGVXAUSA-N 1 3 284.488 3.564 20 0 CHADHO CC[C@H](C)OCC[C@@H](C)[NH+]1C(C)(C)CC(N)CC1(C)C ZINC001172320711 1132158563 /nfs/dbraw/zinc/15/85/63/1132158563.db2.gz ZSAQFWQHGLRDSP-KGLIPLIRSA-N 1 3 284.488 3.560 20 0 CHADHO CC[C@@H](C)OCC[C@@H](C)N1CCC([NH3+])(CC2CCC2)CC1 ZINC001172335871 1132175110 /nfs/dbraw/zinc/17/51/10/1132175110.db2.gz LBSVCCUDHVHEAN-HZPDHXFCSA-N 1 3 296.499 3.564 20 0 CHADHO CC[C@H](C)OCC[C@@H](C)N1CCC([NH3+])(CC2CCC2)CC1 ZINC001172335867 1132175220 /nfs/dbraw/zinc/17/52/20/1132175220.db2.gz LBSVCCUDHVHEAN-CVEARBPZSA-N 1 3 296.499 3.564 20 0 CHADHO CN(C1CC1)C1CC[NH+]([C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172567410 1132271657 /nfs/dbraw/zinc/27/16/57/1132271657.db2.gz DCGVFSMUEKYODC-YLJYHZDGSA-N 1 3 298.474 3.881 20 0 CHADHO CCCCCC[C@H](C)[NH2+][C@H]1CCNC2(CCC2)C1 ZINC000841090201 1132326913 /nfs/dbraw/zinc/32/69/13/1132326913.db2.gz MODVEYCUZPZZRM-GJZGRUSLSA-N 1 3 252.446 3.610 20 0 CHADHO C[C@H]1CCC[N@H+](Cc2cc(F)cc(CN(C)C)c2)CC1 ZINC001232145270 1132427175 /nfs/dbraw/zinc/42/71/75/1132427175.db2.gz ZXXVSTAAGWNEBW-AWEZNQCLSA-N 1 3 278.415 3.509 20 0 CHADHO C[C@H]1CCC[N@@H+](Cc2cc(F)cc(CN(C)C)c2)CC1 ZINC001232145270 1132427176 /nfs/dbraw/zinc/42/71/76/1132427176.db2.gz ZXXVSTAAGWNEBW-AWEZNQCLSA-N 1 3 278.415 3.509 20 0 CHADHO C[C@@H]1CCC[N@H+](Cc2cc(F)cc(CN(C)C)c2)[C@@H]1C ZINC001232146778 1132427444 /nfs/dbraw/zinc/42/74/44/1132427444.db2.gz HCSJBNQUHHQBSA-ZIAGYGMSSA-N 1 3 278.415 3.508 20 0 CHADHO C[C@@H]1CCC[N@@H+](Cc2cc(F)cc(CN(C)C)c2)[C@@H]1C ZINC001232146778 1132427449 /nfs/dbraw/zinc/42/74/49/1132427449.db2.gz HCSJBNQUHHQBSA-ZIAGYGMSSA-N 1 3 278.415 3.508 20 0 CHADHO CC[C@@H]1CC[C@H]([NH2+]C2CCN(C[C@@H]3CC=CCC3)CC2)C1 ZINC001173275160 1132438625 /nfs/dbraw/zinc/43/86/25/1132438625.db2.gz LMQAUAPBHWUGLH-LMMKCTJWSA-N 1 3 290.495 3.975 20 0 CHADHO CCSC[C@@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC001173295376 1132444640 /nfs/dbraw/zinc/44/46/40/1132444640.db2.gz GFTVZWXMUNRYBD-CQSZACIVSA-N 1 3 284.513 3.515 20 0 CHADHO CCSC[C@@H](C)NC1CC[NH+](C2CCCCC2)CC1 ZINC001173295376 1132444643 /nfs/dbraw/zinc/44/46/43/1132444643.db2.gz GFTVZWXMUNRYBD-CQSZACIVSA-N 1 3 284.513 3.515 20 0 CHADHO CC[C@@H]1CC[C@H](N2CCC(C)([NH+]3CCCC3)CC2)C1 ZINC001173281659 1132454904 /nfs/dbraw/zinc/45/49/04/1132454904.db2.gz ATQPGSNQCHZYNM-CVEARBPZSA-N 1 3 264.457 3.515 20 0 CHADHO CC(C)C[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)c1ccncc1 ZINC000842847927 1132469474 /nfs/dbraw/zinc/46/94/74/1132469474.db2.gz DUWLYJKPLNVDGW-SQNIBIBYSA-N 1 3 289.467 3.631 20 0 CHADHO CN1CC2(C1)CC[NH+]([C@H]1CCCC3(CCCCC3)C1)CC2 ZINC001173349392 1132474707 /nfs/dbraw/zinc/47/47/07/1132474707.db2.gz OZNVTNBIJOVWDN-KRWDZBQOSA-N 1 3 290.495 3.907 20 0 CHADHO CCCC1CCC(C[NH2+]C[C@H]2CCCCN(C)C2)CC1 ZINC001203136145 1132526937 /nfs/dbraw/zinc/52/69/37/1132526937.db2.gz LQCHSYFOBCIVHC-DAWZGUTISA-N 1 3 280.500 3.914 20 0 CHADHO CCCN1CCC([NH2+]Cc2cccc(C(F)F)c2)CC1 ZINC000131765929 1132571396 /nfs/dbraw/zinc/57/13/96/1132571396.db2.gz WLDZKZGKRMQAKC-UHFFFAOYSA-N 1 3 282.378 3.588 20 0 CHADHO CC(C)([NH3+])c1ccc(Nc2ccnc(C3CC3)c2)cc1 ZINC001159365771 1132834296 /nfs/dbraw/zinc/83/42/96/1132834296.db2.gz NQRBSSWLMJYLPJ-UHFFFAOYSA-N 1 3 267.376 3.896 20 0 CHADHO CN(C)Cc1ccccc1Nc1ccc([C@@H]2CCC[NH2+]2)cc1 ZINC001159712774 1132897868 /nfs/dbraw/zinc/89/78/68/1132897868.db2.gz NBFZQGQOBLASIN-SFHVURJKSA-N 1 3 295.430 3.916 20 0 CHADHO CC(C)(C)c1cc(Nc2ccc3c(c2)C[C@H]([NH3+])C3)ccn1 ZINC001159832145 1132913968 /nfs/dbraw/zinc/91/39/68/1132913968.db2.gz DHEZMQJPJKHXJF-CQSZACIVSA-N 1 3 281.403 3.549 20 0 CHADHO C[NH2+]C[C@H]1CCCN(C[C@H](C)c2cccc3ccccc32)C1 ZINC001205002078 1133515995 /nfs/dbraw/zinc/51/59/95/1133515995.db2.gz YXFPUYVITYWACA-DLBZAZTESA-N 1 3 296.458 3.875 20 0 CHADHO [NH3+][C@@H]1CCCN(Cc2ccc(-c3ccccc3)cc2)CC1 ZINC001205095340 1133529247 /nfs/dbraw/zinc/52/92/47/1133529247.db2.gz WVOSEKBOWCYFKS-LJQANCHMSA-N 1 3 280.415 3.667 20 0 CHADHO [NH3+][C@@H]1CCCN(Cc2cccc(-c3ccsc3)c2)CC1 ZINC001205110469 1133531401 /nfs/dbraw/zinc/53/14/01/1133531401.db2.gz SUHYMYYOBIDEBF-QGZVFWFLSA-N 1 3 286.444 3.728 20 0 CHADHO CCC(C)(C)c1ccc(CN2CCC[C@H]([NH3+])CC2)cc1 ZINC001205117365 1133532654 /nfs/dbraw/zinc/53/26/54/1133532654.db2.gz OYARFVHUJRRNRB-KRWDZBQOSA-N 1 3 274.452 3.687 20 0 CHADHO COc1ccc2ccccc2c1CN1CCC[C@](C)([NH3+])CC1 ZINC001205266349 1133552435 /nfs/dbraw/zinc/55/24/35/1133552435.db2.gz TZOQMHIGRJMFMI-IBGZPJMESA-N 1 3 298.430 3.552 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@@H+]1CC[C@H](C)[C@H](CN)C1 ZINC001205296203 1133556206 /nfs/dbraw/zinc/55/62/06/1133556206.db2.gz ITFUAHIOUPJRRA-YESZJQIVSA-N 1 3 298.515 3.525 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@H+]1CC[C@H](C)[C@H](CN)C1 ZINC001205296203 1133556208 /nfs/dbraw/zinc/55/62/08/1133556208.db2.gz ITFUAHIOUPJRRA-YESZJQIVSA-N 1 3 298.515 3.525 20 0 CHADHO C[C@H]1CCNCC[N@@H+]1Cc1c2ccccc2[nH]c1C(C)(C)C ZINC001205324705 1133561562 /nfs/dbraw/zinc/56/15/62/1133561562.db2.gz FNAOHHYUVDYHID-AWEZNQCLSA-N 1 3 299.462 3.649 20 0 CHADHO C[C@H]1CCNCC[N@H+]1Cc1c2ccccc2[nH]c1C(C)(C)C ZINC001205324705 1133561563 /nfs/dbraw/zinc/56/15/63/1133561563.db2.gz FNAOHHYUVDYHID-AWEZNQCLSA-N 1 3 299.462 3.649 20 0 CHADHO Cc1cc(CN2CC[C@@H](C[NH3+])[C@@H](C)CC2)c(F)cc1Cl ZINC001205655151 1133600115 /nfs/dbraw/zinc/60/01/15/1133600115.db2.gz YWUNKUZPALJATG-AAEUAGOBSA-N 1 3 298.833 3.594 20 0 CHADHO C[C@@]1(F)CCCN(CCC[NH2+]C2CCCCC2)CC1 ZINC001205855896 1133623010 /nfs/dbraw/zinc/62/30/10/1133623010.db2.gz QHVGPGFCGMKLLT-MRXNPFEDSA-N 1 3 270.436 3.513 20 0 CHADHO CC(C)CN(CC[C@@H]1CCCC[NH2+]1)Cc1ccccc1 ZINC001205922843 1133631483 /nfs/dbraw/zinc/63/14/83/1133631483.db2.gz BNXPACZTBPHQJC-SFHVURJKSA-N 1 3 274.452 3.677 20 0 CHADHO Cc1cc(CN2CCC[C@@H](C[NH3+])[C@H](C)C2)c(F)cc1Cl ZINC001206027279 1133644134 /nfs/dbraw/zinc/64/41/34/1133644134.db2.gz VRVMXNSBHWCDBK-OLZOCXBDSA-N 1 3 298.833 3.594 20 0 CHADHO C[C@@H]1CNCC[N@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001206269207 1133680226 /nfs/dbraw/zinc/68/02/26/1133680226.db2.gz GSAKQDJDCQPMRE-CQSZACIVSA-N 1 3 299.462 3.507 20 0 CHADHO C[C@@H]1CNCC[N@@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001206269207 1133680230 /nfs/dbraw/zinc/68/02/30/1133680230.db2.gz GSAKQDJDCQPMRE-CQSZACIVSA-N 1 3 299.462 3.507 20 0 CHADHO CCCc1ccc(CN2CCCC[C@](C)(C[NH3+])C2)s1 ZINC001206547117 1133715299 /nfs/dbraw/zinc/71/52/99/1133715299.db2.gz BUSGTEJNNRNXQL-MRXNPFEDSA-N 1 3 280.481 3.652 20 0 CHADHO CC(C)N(Cc1coc2ccccc12)[C@H]1CCC[NH2+]CC1 ZINC001206588565 1133723054 /nfs/dbraw/zinc/72/30/54/1133723054.db2.gz BPUFOCMJXQELSW-INIZCTEOSA-N 1 3 286.419 3.785 20 0 CHADHO CC(C)N(Cc1ccccc1C(F)F)[C@@H]1CCC[NH2+]CC1 ZINC001206591515 1133724363 /nfs/dbraw/zinc/72/43/63/1133724363.db2.gz SGQSDCVDOBXAMK-OAHLLOKOSA-N 1 3 296.405 3.977 20 0 CHADHO CCCCc1ccc(CN2CCCC[C@H](C[NH3+])C2)s1 ZINC001206615551 1133728118 /nfs/dbraw/zinc/72/81/18/1133728118.db2.gz ILJPZCKVWJLTAY-CQSZACIVSA-N 1 3 280.481 3.652 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@@H+]1C[C@H](CN)CC[C@H]1C ZINC001206761291 1133743567 /nfs/dbraw/zinc/74/35/67/1133743567.db2.gz WDAWPGXZMMHREV-BBWFWOEESA-N 1 3 298.515 3.667 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@H+]1C[C@H](CN)CC[C@H]1C ZINC001206761291 1133743574 /nfs/dbraw/zinc/74/35/74/1133743574.db2.gz WDAWPGXZMMHREV-BBWFWOEESA-N 1 3 298.515 3.667 20 0 CHADHO C[C@H](CC[NH2+][C@@H]1CCC[C@H]1c1ccc(Cl)cc1)N(C)C ZINC001206827736 1133752386 /nfs/dbraw/zinc/75/23/86/1133752386.db2.gz RFEREIJOZDQEIE-XOKHGSTOSA-N 1 3 294.870 3.906 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1CN1CCC([NH2+]C2CCC2)CC1 ZINC001207741752 1133844011 /nfs/dbraw/zinc/84/40/11/1133844011.db2.gz KIAXDVGNRSLJPQ-MAUKXSAKSA-N 1 3 276.468 3.585 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@@H](C)CC1CCCC1 ZINC001207858540 1133856097 /nfs/dbraw/zinc/85/60/97/1133856097.db2.gz UDPAKOOZYURBOH-GJZGRUSLSA-N 1 3 254.462 3.665 20 0 CHADHO CC[N@H+](Cc1ccc(F)cc1)CC1(CN(C)C)CCCC1 ZINC001208186405 1133901858 /nfs/dbraw/zinc/90/18/58/1133901858.db2.gz QFLAIOTXEZKIDV-UHFFFAOYSA-N 1 3 292.442 3.770 20 0 CHADHO CC[N@@H+](Cc1ccc(F)cc1)CC1(CN(C)C)CCCC1 ZINC001208186405 1133901864 /nfs/dbraw/zinc/90/18/64/1133901864.db2.gz QFLAIOTXEZKIDV-UHFFFAOYSA-N 1 3 292.442 3.770 20 0 CHADHO CC/C=C\CCCCC[NH+]1C[C@H]2CN(CCC)C[C@@H]2C1 ZINC001208193892 1133904838 /nfs/dbraw/zinc/90/48/38/1133904838.db2.gz GXESVTSFDICLAR-OSFIAYCASA-N 1 3 278.484 3.787 20 0 CHADHO CC/C=C\CCCCCN1C[C@H]2C[NH+](CCC)C[C@@H]2C1 ZINC001208193892 1133904842 /nfs/dbraw/zinc/90/48/42/1133904842.db2.gz GXESVTSFDICLAR-OSFIAYCASA-N 1 3 278.484 3.787 20 0 CHADHO c1ccc(CN2CC[C@H](C[N@@H+]3CCC[C@H]4CCC[C@@H]43)C2)cc1 ZINC001208954602 1133967311 /nfs/dbraw/zinc/96/73/11/1133967311.db2.gz WOKKQFIIROXDGB-ZCNNSNEGSA-N 1 3 298.474 3.773 20 0 CHADHO c1ccc(CN2CC[C@H](C[N@H+]3CCC[C@H]4CCC[C@@H]43)C2)cc1 ZINC001208954602 1133967315 /nfs/dbraw/zinc/96/73/15/1133967315.db2.gz WOKKQFIIROXDGB-ZCNNSNEGSA-N 1 3 298.474 3.773 20 0 CHADHO c1csc(CC[N@H+]2CCCC[C@@H]2CCN2CCCC2)c1 ZINC001209224436 1133991473 /nfs/dbraw/zinc/99/14/73/1133991473.db2.gz AYJGIOJUTLWTQL-MRXNPFEDSA-N 1 3 292.492 3.631 20 0 CHADHO c1csc(CC[N@@H+]2CCCC[C@@H]2CCN2CCCC2)c1 ZINC001209224436 1133991478 /nfs/dbraw/zinc/99/14/78/1133991478.db2.gz AYJGIOJUTLWTQL-MRXNPFEDSA-N 1 3 292.492 3.631 20 0 CHADHO c1csc(CCN2CCCC[C@@H]2CC[NH+]2CCCC2)c1 ZINC001209224436 1133991480 /nfs/dbraw/zinc/99/14/80/1133991480.db2.gz AYJGIOJUTLWTQL-MRXNPFEDSA-N 1 3 292.492 3.631 20 0 CHADHO CCN(Cc1ccccc1)C1CC[NH+](C[C@@H]2C[C@@H]2C)CC1 ZINC001209420358 1134014534 /nfs/dbraw/zinc/01/45/34/1134014534.db2.gz HZPZAWJPSRFECO-WMZOPIPTSA-N 1 3 286.463 3.629 20 0 CHADHO Cc1ccc(CN2CC[C@@]3(C2)CCC[NH2+]C3)c2ccccc12 ZINC001222142208 1135199319 /nfs/dbraw/zinc/19/93/19/1135199319.db2.gz XBEHZBLVDZAYLU-FQEVSTJZSA-N 1 3 294.442 3.724 20 0 CHADHO C[C@H](CC[N@@H+]1CCC[C@@]12CCCNC2)CC(C)(C)C ZINC001222232320 1135211463 /nfs/dbraw/zinc/21/14/63/1135211463.db2.gz UXMSJFJFCIHRBD-NVXWUHKLSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@H](CC[N@H+]1CCC[C@@]12CCCNC2)CC(C)(C)C ZINC001222232320 1135211469 /nfs/dbraw/zinc/21/14/69/1135211469.db2.gz UXMSJFJFCIHRBD-NVXWUHKLSA-N 1 3 266.473 3.667 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CC[C@H]2CNCC[C@H]21 ZINC001222615529 1135254877 /nfs/dbraw/zinc/25/48/77/1135254877.db2.gz QVFAILAOMVCTTH-OPCNFVSTSA-N 1 3 264.457 3.587 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CC[C@H]2CNCC[C@H]21 ZINC001222615529 1135254882 /nfs/dbraw/zinc/25/48/82/1135254882.db2.gz QVFAILAOMVCTTH-OPCNFVSTSA-N 1 3 264.457 3.587 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]CCCN(C)C(C)C)cc1C ZINC000221915339 262323538 /nfs/dbraw/zinc/32/35/38/262323538.db2.gz UNRVXXKOJCKJTK-MRXNPFEDSA-N 1 3 262.441 3.684 20 0 CHADHO CC(C)CC[C@H](C)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000020143419 171029034 /nfs/dbraw/zinc/02/90/34/171029034.db2.gz CTICZSAMXXNHHZ-ZDUSSCGKSA-N 1 3 254.462 3.710 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCC(C)CC1)c1cccs1 ZINC000020146284 171032826 /nfs/dbraw/zinc/03/28/26/171032826.db2.gz LVMISDGFSGJIAU-CQSZACIVSA-N 1 3 266.454 3.521 20 0 CHADHO CCC[NH+]1CCC(N[C@H](C)c2ccc(C)s2)CC1 ZINC000020189986 171056656 /nfs/dbraw/zinc/05/66/56/171056656.db2.gz HIRDNWOGRVRUBJ-CYBMUJFWSA-N 1 3 266.454 3.582 20 0 CHADHO CCC[NH+]1CCC(N[C@H]2CCCCc3ccccc32)CC1 ZINC000021815306 171332119 /nfs/dbraw/zinc/33/21/19/171332119.db2.gz HAUUXPJRLYQTSR-IBGZPJMESA-N 1 3 286.463 3.918 20 0 CHADHO Cc1cc(NC[C@H](c2ccco2)N2CCCCC2)cc[nH+]1 ZINC000302211732 227822703 /nfs/dbraw/zinc/82/27/03/227822703.db2.gz DOGBAYAJOMCILL-MRXNPFEDSA-N 1 3 285.391 3.622 20 0 CHADHO CC[C@@H](N[C@@H]1CC[N@H+](C)[C@H](C)C1)c1cccc(Cl)c1 ZINC000091959941 260267211 /nfs/dbraw/zinc/26/72/11/260267211.db2.gz GPADXURDIJDRIU-DAXOMENPSA-N 1 3 280.843 3.863 20 0 CHADHO CC[C@@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc(Cl)c1 ZINC000091959941 260267212 /nfs/dbraw/zinc/26/72/12/260267212.db2.gz GPADXURDIJDRIU-DAXOMENPSA-N 1 3 280.843 3.863 20 0 CHADHO CC[C@H](N[C@@H](C)C[C@@H]1CCC[NH2+]1)c1ccc(C)cc1 ZINC000093463939 260286714 /nfs/dbraw/zinc/28/67/14/260286714.db2.gz KTTKQOQWKCOAIZ-XIRDDKMYSA-N 1 3 260.425 3.566 20 0 CHADHO CC(C)C[C@H](N[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000093977916 260340437 /nfs/dbraw/zinc/34/04/37/260340437.db2.gz IEDOGMLVVNUSIJ-OTWHNJEPSA-N 1 3 286.463 3.990 20 0 CHADHO CC(C)C[C@H](N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000093977916 260340439 /nfs/dbraw/zinc/34/04/39/260340439.db2.gz IEDOGMLVVNUSIJ-OTWHNJEPSA-N 1 3 286.463 3.990 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN(CCCc2ccccc2C)C1 ZINC000084678395 260366528 /nfs/dbraw/zinc/36/65/28/260366528.db2.gz KCDLZPWGCSLLJQ-SFHVURJKSA-N 1 3 288.479 3.591 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN(CCCc2ccccc2C)C1 ZINC000084678395 260366529 /nfs/dbraw/zinc/36/65/29/260366529.db2.gz KCDLZPWGCSLLJQ-SFHVURJKSA-N 1 3 288.479 3.591 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+](CCCc2ccccc2C)C1 ZINC000084678395 260366530 /nfs/dbraw/zinc/36/65/30/260366530.db2.gz KCDLZPWGCSLLJQ-SFHVURJKSA-N 1 3 288.479 3.591 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+](CCCc2ccccc2C)C1 ZINC000084678395 260366531 /nfs/dbraw/zinc/36/65/31/260366531.db2.gz KCDLZPWGCSLLJQ-SFHVURJKSA-N 1 3 288.479 3.591 20 0 CHADHO C[C@@H]1C[C@@H](N[C@@H]2CCC(C)(C)c3ccccc32)CC[N@@H+]1C ZINC000128105325 260372571 /nfs/dbraw/zinc/37/25/71/260372571.db2.gz DOHWLYQXHONYAW-RVKKMQEKSA-N 1 3 286.463 3.871 20 0 CHADHO C[C@@H]1C[C@@H](N[C@@H]2CCC(C)(C)c3ccccc32)CC[N@H+]1C ZINC000128105325 260372572 /nfs/dbraw/zinc/37/25/72/260372572.db2.gz DOHWLYQXHONYAW-RVKKMQEKSA-N 1 3 286.463 3.871 20 0 CHADHO C1CCC2(C1)CCC([NH2+][C@@H]1CCN3CCC[C@@H]3C1)CC2 ZINC000129451174 260387235 /nfs/dbraw/zinc/38/72/35/260387235.db2.gz HEUUHRQQBMPGMF-IAGOWNOFSA-N 1 3 276.468 3.706 20 0 CHADHO C[C@H]1CN(Cc2ccc(-c3ccccc3)cc2)CC[C@@H]1[NH3+] ZINC000094338962 262197521 /nfs/dbraw/zinc/19/75/21/262197521.db2.gz HOZPSIKIMBSFJW-KXBFYZLASA-N 1 3 280.415 3.523 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CC[C@H]([NH3+])[C@@H](C)C2)cc1 ZINC000094339106 262197820 /nfs/dbraw/zinc/19/78/20/262197820.db2.gz XTZFYPMPALEZND-ZQIUZPCESA-N 1 3 260.425 3.540 20 0 CHADHO COc1ccc([C@@H](C)[NH2+]CCCN2CCCC[C@@H]2C)cc1 ZINC000019913085 262205766 /nfs/dbraw/zinc/20/57/66/262205766.db2.gz OXESROMZUYCIDW-JKSUJKDBSA-N 1 3 290.451 3.610 20 0 CHADHO CC[NH+](CC)Cc1ccc(CNCc2ccccc2)cc1 ZINC000020146487 262231804 /nfs/dbraw/zinc/23/18/04/262231804.db2.gz BSAWJMMLKSDDBY-UHFFFAOYSA-N 1 3 282.431 3.818 20 0 CHADHO CC(C)[C@@H]1C[C@@H](NCCC[NH+](C(C)C)C(C)C)CS1 ZINC000488454831 262325834 /nfs/dbraw/zinc/32/58/34/262325834.db2.gz ZTEYUEMCTFVBIM-CVEARBPZSA-N 1 3 286.529 3.615 20 0 CHADHO Cc1cc(C)c([C@H](C)[NH2+]CCCN2CCCC2)cc1C ZINC000021049758 262375157 /nfs/dbraw/zinc/37/51/57/262375157.db2.gz KIZIIKCVPYVTIT-KRWDZBQOSA-N 1 3 274.452 3.748 20 0 CHADHO CCOc1ccc([C@@H](C)[NH2+]CCCN2CCCCC2)cc1 ZINC000021056095 262376011 /nfs/dbraw/zinc/37/60/11/262376011.db2.gz MMGDLYZPTPONBS-MRXNPFEDSA-N 1 3 290.451 3.612 20 0 CHADHO C[C@@H](C[NH2+][C@H]1CCCc2sccc21)CN1CCCCC1 ZINC000061328604 262394045 /nfs/dbraw/zinc/39/40/45/262394045.db2.gz SBNWULZJBKEQLP-HOCLYGCPSA-N 1 3 292.492 3.837 20 0 CHADHO CC(C)(C)N1CCC([NH2+][C@@H]2CCCc3sccc32)CC1 ZINC000061328466 262394124 /nfs/dbraw/zinc/39/41/24/262394124.db2.gz OUQQUSGCLMMFIQ-OAHLLOKOSA-N 1 3 292.492 3.978 20 0 CHADHO C[C@@H]1C[C@@H](CN)C[N@@H+]1CC1CCC(c2ccccc2)CC1 ZINC000414661613 263023805 /nfs/dbraw/zinc/02/38/05/263023805.db2.gz OXVFWZMKFASTBX-XNGIKWSVSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@@H]1C[C@@H](CN)C[N@H+]1CC1CCC(c2ccccc2)CC1 ZINC000414661613 263023806 /nfs/dbraw/zinc/02/38/06/263023806.db2.gz OXVFWZMKFASTBX-XNGIKWSVSA-N 1 3 286.463 3.630 20 0 CHADHO CCN(Cc1ccccc1Cl)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000414668660 263026296 /nfs/dbraw/zinc/02/62/96/263026296.db2.gz AMMVPPIAIXSFRL-KGLIPLIRSA-N 1 3 280.843 3.550 20 0 CHADHO Cc1ccc(CNCc2ccc([C@H](C)[NH3+])cc2)c(C)c1 ZINC000414808476 263052701 /nfs/dbraw/zinc/05/27/01/263052701.db2.gz KPSNQQHOMYQCRS-HNNXBMFYSA-N 1 3 268.404 3.613 20 0 CHADHO Cc1cc(C)cc(CNCc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000414808883 263052723 /nfs/dbraw/zinc/05/27/23/263052723.db2.gz LDWCBGOVRKLAET-OAHLLOKOSA-N 1 3 268.404 3.613 20 0 CHADHO C[C@@H]1C[C@H](NC2C[C@H]3CC[C@@H](C2)[NH2+]3)C[C@@H](c2ccccc2)C1 ZINC000414822924 263055479 /nfs/dbraw/zinc/05/54/79/263055479.db2.gz CZTJCCGBIZRVLN-DCJDXFLUSA-N 1 3 298.474 3.831 20 0 CHADHO NC1(C[NH2+]CCSCc2ccccc2)CCCCCC1 ZINC000414859341 263075080 /nfs/dbraw/zinc/07/50/80/263075080.db2.gz MMCYDRQYSOFFKN-UHFFFAOYSA-N 1 3 292.492 3.561 20 0 CHADHO [NH3+]C1(CNCCSCc2ccccc2)CCCCCC1 ZINC000414859341 263075081 /nfs/dbraw/zinc/07/50/81/263075081.db2.gz MMCYDRQYSOFFKN-UHFFFAOYSA-N 1 3 292.492 3.561 20 0 CHADHO C[N@@H+]1CCC[C@H]1CCN(C1CC1)[C@@H]1CCc2ccccc21 ZINC000340370032 263120032 /nfs/dbraw/zinc/12/00/32/263120032.db2.gz KIDCMCUBBWSWDS-QFBILLFUSA-N 1 3 284.447 3.623 20 0 CHADHO C[N@H+]1CCC[C@H]1CCN(C1CC1)[C@@H]1CCc2ccccc21 ZINC000340370032 263120033 /nfs/dbraw/zinc/12/00/33/263120033.db2.gz KIDCMCUBBWSWDS-QFBILLFUSA-N 1 3 284.447 3.623 20 0 CHADHO c1ccc(C2CCC(C[NH2+][C@H]3CCCNCC3)CC2)cc1 ZINC000414916844 263120955 /nfs/dbraw/zinc/12/09/55/263120955.db2.gz PFDNHKKFFALEFE-KVZIAJEVSA-N 1 3 286.463 3.692 20 0 CHADHO CC1(c2ccccc2)CCC([NH2+][C@@H]2CCCNCC2)CC1 ZINC000414919935 263124479 /nfs/dbraw/zinc/12/44/79/263124479.db2.gz WDOGYMNZHQABNI-LMDPOFIKSA-N 1 3 286.463 3.619 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H]1CCCC[C@@H](c2ccccc2)C1 ZINC000414943708 263153081 /nfs/dbraw/zinc/15/30/81/263153081.db2.gz OIFSPUNKPCEEIC-YSHGAJCASA-N 1 3 286.463 3.691 20 0 CHADHO C[C@H](CC1CC1)N[C@H](C[NH3+])c1ccc2ccccc2c1 ZINC000414946354 263155169 /nfs/dbraw/zinc/15/51/69/263155169.db2.gz TVKXEBSMYAENOF-FZKQIMNGSA-N 1 3 268.404 3.618 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](CNCc2c(Cl)cccc2Cl)C1 ZINC000414989122 263185949 /nfs/dbraw/zinc/18/59/49/263185949.db2.gz GSINYJNGBRWADR-WDEREUQCSA-N 1 3 287.234 3.601 20 0 CHADHO [NH3+]CCC[C@H](NCc1cc(F)cc(F)c1)c1ccccc1 ZINC000415056734 263258723 /nfs/dbraw/zinc/25/87/23/263258723.db2.gz QMMXSROSHAYNHN-KRWDZBQOSA-N 1 3 290.357 3.535 20 0 CHADHO Cc1cccc(CN[C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000415063335 263258943 /nfs/dbraw/zinc/25/89/43/263258943.db2.gz HWOVCZKWZINSSC-SFHVURJKSA-N 1 3 268.404 3.565 20 0 CHADHO Cc1ccc(C)c(CN[C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000415068458 263259658 /nfs/dbraw/zinc/25/96/58/263259658.db2.gz RBPNUQNETXAJIT-IBGZPJMESA-N 1 3 282.431 3.873 20 0 CHADHO c1ccc(C[C@@H]2CCCC[C@@H]2[NH2+][C@H]2CCCNCC2)cc1 ZINC000415072782 263262946 /nfs/dbraw/zinc/26/29/46/263262946.db2.gz ABNUNEMCOOWFNE-FHWLQOOXSA-N 1 3 286.463 3.520 20 0 CHADHO CC(C)c1ccc2c(c1)[C@H](N[C@H]1CC[N@H+](C)[C@@H](C)C1)CC2 ZINC000187801708 263268849 /nfs/dbraw/zinc/26/88/49/263268849.db2.gz CEULMMXWUAALBF-UCLAIMLFSA-N 1 3 286.463 3.870 20 0 CHADHO CC(C)c1ccc2c(c1)[C@H](N[C@H]1CC[N@@H+](C)[C@@H](C)C1)CC2 ZINC000187801708 263268851 /nfs/dbraw/zinc/26/88/51/263268851.db2.gz CEULMMXWUAALBF-UCLAIMLFSA-N 1 3 286.463 3.870 20 0 CHADHO Cc1cccc([C@@H](NC[C@@H]2CCC[NH2+]C2)C(C)(C)C)c1 ZINC000415086906 263271743 /nfs/dbraw/zinc/27/17/43/263271743.db2.gz VHRVVASSLIQBKB-NVXWUHKLSA-N 1 3 274.452 3.671 20 0 CHADHO Cc1cccc([C@@H]([NH2+]C[C@@H]2CCCNC2)C(C)(C)C)c1 ZINC000415086906 263271744 /nfs/dbraw/zinc/27/17/44/263271744.db2.gz VHRVVASSLIQBKB-NVXWUHKLSA-N 1 3 274.452 3.671 20 0 CHADHO CC[C@H](N[C@@H]1CCC[NH2+]CC1)c1ccc(Cl)cc1 ZINC000129000598 264313126 /nfs/dbraw/zinc/31/31/26/264313126.db2.gz UCXQZXFJWXRXSA-CABCVRRESA-N 1 3 266.816 3.523 20 0 CHADHO CC(C)[N@H+](C)Cc1cccc(CNCc2ccccc2)c1 ZINC000065976591 265007568 /nfs/dbraw/zinc/00/75/68/265007568.db2.gz GVTJOUYOVNESQO-UHFFFAOYSA-N 1 3 282.431 3.817 20 0 CHADHO CC(C)[N@@H+](C)Cc1cccc(CNCc2ccccc2)c1 ZINC000065976591 265007570 /nfs/dbraw/zinc/00/75/70/265007570.db2.gz GVTJOUYOVNESQO-UHFFFAOYSA-N 1 3 282.431 3.817 20 0 CHADHO CN(C)Cc1cccc(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)c1 ZINC000348242787 265146782 /nfs/dbraw/zinc/14/67/82/265146782.db2.gz LCSMAOMRIDEQEH-PMACEKPBSA-N 1 3 294.442 3.642 20 0 CHADHO Cc1oc2ccccc2c1C[N@H+]1CCC[C@H]2CN(C)CC[C@@H]21 ZINC000519033710 265299867 /nfs/dbraw/zinc/29/98/67/265299867.db2.gz ZRQLAKIURNVAEH-YJBOKZPZSA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1C[N@@H+]1CCC[C@H]2CN(C)CC[C@@H]21 ZINC000519033710 265299870 /nfs/dbraw/zinc/29/98/70/265299870.db2.gz ZRQLAKIURNVAEH-YJBOKZPZSA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1CN1CCC[C@H]2C[N@H+](C)CC[C@@H]21 ZINC000519033710 265299876 /nfs/dbraw/zinc/29/98/76/265299876.db2.gz ZRQLAKIURNVAEH-YJBOKZPZSA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1CN1CCC[C@H]2C[N@@H+](C)CC[C@@H]21 ZINC000519033710 265299878 /nfs/dbraw/zinc/29/98/78/265299878.db2.gz ZRQLAKIURNVAEH-YJBOKZPZSA-N 1 3 298.430 3.657 20 0 CHADHO C[C@H](CC[N@@H+]1CCC[C@H]2CN(C)CC[C@@H]21)c1ccccc1 ZINC000519129546 265328200 /nfs/dbraw/zinc/32/82/00/265328200.db2.gz BEAUVYDUYNOUIN-NEWSRXKRSA-N 1 3 286.463 3.596 20 0 CHADHO C[C@H](CC[N@H+]1CCC[C@H]2CN(C)CC[C@@H]21)c1ccccc1 ZINC000519129546 265328203 /nfs/dbraw/zinc/32/82/03/265328203.db2.gz BEAUVYDUYNOUIN-NEWSRXKRSA-N 1 3 286.463 3.596 20 0 CHADHO CC(C)[C@H]1C[C@H]([NH2+]C2CCN(C3CCCC3)CC2)CS1 ZINC000368460538 267174130 /nfs/dbraw/zinc/17/41/30/267174130.db2.gz DOQJJYWEZVGYMW-DOTOQJQBSA-N 1 3 296.524 3.513 20 0 CHADHO CC(C)[C@H]1C[C@H](NC2CC[NH+](C3CCCC3)CC2)CS1 ZINC000368460538 267174133 /nfs/dbraw/zinc/17/41/33/267174133.db2.gz DOQJJYWEZVGYMW-DOTOQJQBSA-N 1 3 296.524 3.513 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H]([NH2+][C@@H]2CCN3CCC[C@H]3C2)C1 ZINC000370477716 267321221 /nfs/dbraw/zinc/32/12/21/267321221.db2.gz QAULIHDZGHNSEV-FYQPLNBISA-N 1 3 298.474 3.713 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H](N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000370477716 267321224 /nfs/dbraw/zinc/32/12/24/267321224.db2.gz QAULIHDZGHNSEV-FYQPLNBISA-N 1 3 298.474 3.713 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H](N[C@@H]2CC[N@H+]3CCC[C@H]3C2)C1 ZINC000370477716 267321227 /nfs/dbraw/zinc/32/12/27/267321227.db2.gz QAULIHDZGHNSEV-FYQPLNBISA-N 1 3 298.474 3.713 20 0 CHADHO CN1CCC[C@H]1CC[N@H+](C)Cc1cccc2ccccc21 ZINC000534017960 328033206 /nfs/dbraw/zinc/03/32/06/328033206.db2.gz HZIZFPYMCHTJCV-SFHVURJKSA-N 1 3 282.431 3.756 20 0 CHADHO CN1CCC[C@H]1CC[N@@H+](C)Cc1cccc2ccccc21 ZINC000534017960 328033208 /nfs/dbraw/zinc/03/32/08/328033208.db2.gz HZIZFPYMCHTJCV-SFHVURJKSA-N 1 3 282.431 3.756 20 0 CHADHO c1ccc2cc(C[NH2+]CCCN3CCCCC3)ccc2c1 ZINC000022145945 328129481 /nfs/dbraw/zinc/12/94/81/328129481.db2.gz KSVLFYCJNLRTDH-UHFFFAOYSA-N 1 3 282.431 3.805 20 0 CHADHO [NH3+]C[C@@H]1CCCC[C@H]1NCc1csc2ccccc12 ZINC000414791118 328226470 /nfs/dbraw/zinc/22/64/70/328226470.db2.gz AYCRQXHQDXISAU-SWLSCSKDSA-N 1 3 274.433 3.508 20 0 CHADHO C[C@H](N)[C@H](C)[NH2+]Cc1ccc(-c2ccccc2Cl)s1 ZINC000415011898 328298475 /nfs/dbraw/zinc/29/84/75/328298475.db2.gz RJNICVIIJMXFKK-QWRGUYRKSA-N 1 3 294.851 3.894 20 0 CHADHO CC(C)CCC[NH2+]C[C@@H]1CNCC[C@@H]1c1ccc(F)cc1 ZINC000415011574 328298642 /nfs/dbraw/zinc/29/86/42/328298642.db2.gz WFMCXMWVZAKZFA-SJLPKXTDSA-N 1 3 292.442 3.545 20 0 CHADHO Cc1cc(C)c(CN[C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)c(C)c1 ZINC000415081557 328302259 /nfs/dbraw/zinc/30/22/59/328302259.db2.gz KUNFHGZOBHFJLY-YTQUADARSA-N 1 3 286.463 3.622 20 0 CHADHO CC(C)CC[C@@H]([NH2+][C@@H]1CCCNCC1)C(C)(C)C ZINC000415083529 328302714 /nfs/dbraw/zinc/30/27/14/328302714.db2.gz NOSRDBFHPBFIAS-HUUCEWRRSA-N 1 3 254.462 3.569 20 0 CHADHO Cc1cc([C@H](C)[NH2+]CCCN2CCCC2)cc(C)c1F ZINC000531944994 328323875 /nfs/dbraw/zinc/32/38/75/328323875.db2.gz SWMRJTOIAXDQAH-HNNXBMFYSA-N 1 3 278.415 3.579 20 0 CHADHO C[N@@H+]1CCC[C@@H]1CCN1CCC[C@](C)(c2ccccc2)C1 ZINC000534758341 328360425 /nfs/dbraw/zinc/36/04/25/328360425.db2.gz YURUMEHRKCVCIL-MOPGFXCFSA-N 1 3 286.463 3.524 20 0 CHADHO C[N@H+]1CCC[C@@H]1CCN1CCC[C@](C)(c2ccccc2)C1 ZINC000534758341 328360427 /nfs/dbraw/zinc/36/04/27/328360427.db2.gz YURUMEHRKCVCIL-MOPGFXCFSA-N 1 3 286.463 3.524 20 0 CHADHO CCCc1ccc([C@@H](C)N[C@H](C)CC[NH+](C)C)cc1 ZINC000049553347 328371736 /nfs/dbraw/zinc/37/17/36/328371736.db2.gz KSSDKZPWEQCZAG-HUUCEWRRSA-N 1 3 262.441 3.630 20 0 CHADHO CN1CCC[C@@H]2C[N@H+](Cc3cccc4ccccc43)CC[C@H]21 ZINC000531988606 328382919 /nfs/dbraw/zinc/38/29/19/328382919.db2.gz LLLHCOHOUZQLPK-UYAOXDASSA-N 1 3 294.442 3.756 20 0 CHADHO CN1CCC[C@@H]2C[N@@H+](Cc3cccc4ccccc43)CC[C@H]21 ZINC000531988606 328382921 /nfs/dbraw/zinc/38/29/21/328382921.db2.gz LLLHCOHOUZQLPK-UYAOXDASSA-N 1 3 294.442 3.756 20 0 CHADHO C[N@@H+]1CCC[C@@H]2CN(Cc3cccc4ccccc43)CC[C@H]21 ZINC000531988606 328382922 /nfs/dbraw/zinc/38/29/22/328382922.db2.gz LLLHCOHOUZQLPK-UYAOXDASSA-N 1 3 294.442 3.756 20 0 CHADHO C[N@H+]1CCC[C@@H]2CN(Cc3cccc4ccccc43)CC[C@H]21 ZINC000531988606 328382925 /nfs/dbraw/zinc/38/29/25/328382925.db2.gz LLLHCOHOUZQLPK-UYAOXDASSA-N 1 3 294.442 3.756 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1ccc(Cl)cc1 ZINC000531993595 328386048 /nfs/dbraw/zinc/38/60/48/328386048.db2.gz HSFKBZNHZQEALB-APHBMKBZSA-N 1 3 280.843 3.863 20 0 CHADHO CC[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1ccc(Cl)cc1 ZINC000093212020 328510766 /nfs/dbraw/zinc/51/07/66/328510766.db2.gz CQGQQLZBNCWHFM-KKUMJFAQSA-N 1 3 266.816 3.651 20 0 CHADHO C[C@H](NCc1ccc(C[NH3+])cc1)c1ccc(Cl)c(F)c1 ZINC000517742844 326810779 /nfs/dbraw/zinc/81/07/79/326810779.db2.gz MPWSSRZFRKFAHR-NSHDSACASA-N 1 3 292.785 3.789 20 0 CHADHO CC(C)[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCN(C(C)C)C2)C[C@@H]1C ZINC000584186660 327062785 /nfs/dbraw/zinc/06/27/85/327062785.db2.gz OZXWPWLTQFWENM-XSLAGTTESA-N 1 3 280.500 3.767 20 0 CHADHO CC(C)N1CCC([NH2+]Cc2ccc(C(F)F)cc2)CC1 ZINC000131310122 327161250 /nfs/dbraw/zinc/16/12/50/327161250.db2.gz RGXZUESOUPZFDT-UHFFFAOYSA-N 1 3 282.378 3.587 20 0 CHADHO C[C@@H]1CCC[C@H]([NH+]2CCC(NC3CC(C)(F)C3)CC2)C1 ZINC000449377793 327181091 /nfs/dbraw/zinc/18/10/91/327181091.db2.gz UOIZSQBZAHMIPA-AKBUMOGYSA-N 1 3 282.447 3.510 20 0 CHADHO C[C@@H]1CCC[C@H](N2CCC([NH2+]C3CC(C)(F)C3)CC2)C1 ZINC000449377793 327181093 /nfs/dbraw/zinc/18/10/93/327181093.db2.gz UOIZSQBZAHMIPA-AKBUMOGYSA-N 1 3 282.447 3.510 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@H]1N[C@@H](c1cccs1)C1CCCC1 ZINC000261600065 327258531 /nfs/dbraw/zinc/25/85/31/327258531.db2.gz PTJFUDZUCOZZGI-XNRPHZJLSA-N 1 3 278.465 3.567 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@@H](c1cccs1)C1CCCC1 ZINC000261600065 327258532 /nfs/dbraw/zinc/25/85/32/327258532.db2.gz PTJFUDZUCOZZGI-XNRPHZJLSA-N 1 3 278.465 3.567 20 0 CHADHO CC(C)c1ccc([C@@H](C)N2CC[C@@](C)(C[NH3+])C2)cc1 ZINC000261617658 327359638 /nfs/dbraw/zinc/35/96/38/327359638.db2.gz UFYLVRFYPWAYJS-PBHICJAKSA-N 1 3 260.425 3.542 20 0 CHADHO CC(C)c1ccc([C@@H](C)[N@@H+]2CC[C@@](C)(CN)C2)cc1 ZINC000261617658 327359639 /nfs/dbraw/zinc/35/96/39/327359639.db2.gz UFYLVRFYPWAYJS-PBHICJAKSA-N 1 3 260.425 3.542 20 0 CHADHO CC(C)c1ccc([C@@H](C)[N@H+]2CC[C@@](C)(CN)C2)cc1 ZINC000261617658 327359640 /nfs/dbraw/zinc/35/96/40/327359640.db2.gz UFYLVRFYPWAYJS-PBHICJAKSA-N 1 3 260.425 3.542 20 0 CHADHO CCCN(CCC)CCC[NH2+][C@@H]1CCC[C@@H](C)C1 ZINC000462776492 331328409 /nfs/dbraw/zinc/32/84/09/331328409.db2.gz SNTAYEQQXFBNHD-HZPDHXFCSA-N 1 3 254.462 3.667 20 0 CHADHO CC1(C)C[C@H](NCc2ccc(C[NH3+])cc2)c2ccccc21 ZINC000570516000 327596812 /nfs/dbraw/zinc/59/68/12/327596812.db2.gz GGCHMINYDHCIBA-SFHVURJKSA-N 1 3 280.415 3.658 20 0 CHADHO C[C@@H](CN1CCC(C[NH+](C)C)CC1)c1cccc(Cl)c1 ZINC000527356509 328665920 /nfs/dbraw/zinc/66/59/20/328665920.db2.gz SMDMKTBEIDZAQH-AWEZNQCLSA-N 1 3 294.870 3.717 20 0 CHADHO CC[N@H+](CCCN1CCCC1)Cc1ccc(C(F)F)cc1 ZINC000582573656 329109958 /nfs/dbraw/zinc/10/99/58/329109958.db2.gz RCICSWFUTPPVMW-UHFFFAOYSA-N 1 3 296.405 3.932 20 0 CHADHO CC[N@@H+](CCCN1CCCC1)Cc1ccc(C(F)F)cc1 ZINC000582573656 329109959 /nfs/dbraw/zinc/10/99/59/329109959.db2.gz RCICSWFUTPPVMW-UHFFFAOYSA-N 1 3 296.405 3.932 20 0 CHADHO CCC[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000582779593 329185142 /nfs/dbraw/zinc/18/51/42/329185142.db2.gz ZKVXHKGEOWJBLL-IIDMSEBBSA-N 1 3 289.467 3.858 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]C[C@H](C)CN2CCCCC2)s1 ZINC000038041633 329354588 /nfs/dbraw/zinc/35/45/88/329354588.db2.gz YIRRRCYFSRXNMJ-DZGCQCFKSA-N 1 3 280.481 3.829 20 0 CHADHO CN(C)Cc1cccc(C[NH2+][C@@H]2CCC23CCCC3)c1 ZINC000189051978 329375391 /nfs/dbraw/zinc/37/53/91/329375391.db2.gz PXLKTVGKBRVMHH-QGZVFWFLSA-N 1 3 272.436 3.561 20 0 CHADHO C[C@H](NCC[C@@H]1CCC[NH2+]C1)c1ccc(F)cc1Cl ZINC000420397404 329763890 /nfs/dbraw/zinc/76/38/90/329763890.db2.gz GCUMBQPDAAHWRR-RYUDHWBXSA-N 1 3 284.806 3.519 20 0 CHADHO CC(C)(C[NH2+][C@@H]1CC[C@H]1C(C)(C)C)CN1CCCC1 ZINC000571868594 329925175 /nfs/dbraw/zinc/92/51/75/329925175.db2.gz OCLRANONQXBTQB-HUUCEWRRSA-N 1 3 266.473 3.523 20 0 CHADHO CC[NH2+]CC1CCN(C[C@H](C)c2cccc(Cl)c2)CC1 ZINC000261948738 329990660 /nfs/dbraw/zinc/99/06/60/329990660.db2.gz NQQPPSSYWFEALX-AWEZNQCLSA-N 1 3 294.870 3.765 20 0 CHADHO CC(C)(CC[NH3+])NCc1cc(-c2ccccc2)cs1 ZINC000422563903 330149328 /nfs/dbraw/zinc/14/93/28/330149328.db2.gz UWFAZNBDOFCQSY-UHFFFAOYSA-N 1 3 274.433 3.632 20 0 CHADHO C[C@H](NCCCCCOC1CCCCC1)[C@H]1CCCC[NH2+]1 ZINC000422700583 330150818 /nfs/dbraw/zinc/15/08/18/330150818.db2.gz AHBVKHSPIZQRGH-FUHWJXTLSA-N 1 3 296.499 3.626 20 0 CHADHO c1ccc2cc(CN[C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)ccc2c1 ZINC000422706524 330151090 /nfs/dbraw/zinc/15/10/90/330151090.db2.gz UPCICSIYTGYEHE-XUVXKRRUSA-N 1 3 294.442 3.850 20 0 CHADHO CCCC[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000422710385 330151386 /nfs/dbraw/zinc/15/13/86/330151386.db2.gz LCCVDOXRFPJCTK-IIDMSEBBSA-N 1 3 289.467 3.858 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H](C)CCc1ccccc1 ZINC000422725604 330152431 /nfs/dbraw/zinc/15/24/31/330152431.db2.gz BYMSHIPFOLZMEE-GJZGRUSLSA-N 1 3 297.446 3.521 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@@H](C)CCCC(C)C ZINC000422734169 330152712 /nfs/dbraw/zinc/15/27/12/330152712.db2.gz SCWPHHFGXBHQDY-UONOGXRCSA-N 1 3 277.456 3.714 20 0 CHADHO C[C@H](CCCC[NH3+])N[C@H](C)c1ccc(F)cc1Cl ZINC000422752090 330153366 /nfs/dbraw/zinc/15/33/66/330153366.db2.gz GWCBWUBPQZUVLZ-GHMZBOCLSA-N 1 3 272.795 3.647 20 0 CHADHO C[C@@H](N)C[C@@H](C)[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000422752923 330153418 /nfs/dbraw/zinc/15/34/18/330153418.db2.gz HWXNFPQQHZRGLA-HZPDHXFCSA-N 1 3 282.431 3.534 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCC(c1ccccc1)c1ccccc1 ZINC000422752923 330153420 /nfs/dbraw/zinc/15/34/20/330153420.db2.gz HWXNFPQQHZRGLA-HZPDHXFCSA-N 1 3 282.431 3.534 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]CC1(c2ccc(F)cc2)CCCCC1 ZINC000422761002 330153611 /nfs/dbraw/zinc/15/36/11/330153611.db2.gz MDKTYAWMWHPZRK-LSDHHAIUSA-N 1 3 292.442 3.743 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCC1(c2ccc(F)cc2)CCCCC1 ZINC000422761002 330153613 /nfs/dbraw/zinc/15/36/13/330153613.db2.gz MDKTYAWMWHPZRK-LSDHHAIUSA-N 1 3 292.442 3.743 20 0 CHADHO NC[C@@H]1CCC[C@@H]1[NH2+]CC1(c2cccs2)CCCCC1 ZINC000422767938 330154229 /nfs/dbraw/zinc/15/42/29/330154229.db2.gz NHZOBVHGYJHYQR-GJZGRUSLSA-N 1 3 292.492 3.667 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+][C@H](C)C[C@@H](C)N ZINC000422776237 330154617 /nfs/dbraw/zinc/15/46/17/330154617.db2.gz CJABMMVFURGADC-BFYDXBDKSA-N 1 3 262.441 3.503 20 0 CHADHO Cc1cccc([C@H](C)CN[C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)c1 ZINC000422786745 330155384 /nfs/dbraw/zinc/15/53/84/330155384.db2.gz QQFGRVNYTHPARA-OQIJWPOYSA-N 1 3 286.463 3.609 20 0 CHADHO CCS[C@@H]1CCC[C@H](N[C@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000422818400 330156362 /nfs/dbraw/zinc/15/63/62/330156362.db2.gz KHUMKGCWUFGTCM-IXKJSCDLSA-N 1 3 290.476 3.785 20 0 CHADHO CC(C)(C)[C@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1 ZINC000422826533 330156584 /nfs/dbraw/zinc/15/65/84/330156584.db2.gz CIUHQGFKDYCLEN-FCLJQHQZSA-N 1 3 272.436 3.646 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]C[C@H](Cc1ccccc1)c1ccccc1 ZINC000422839987 330157125 /nfs/dbraw/zinc/15/71/25/330157125.db2.gz RTLQRGXJSUUSSQ-ZWOKBUDYSA-N 1 3 296.458 3.728 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]C[C@H](Cc1ccccc1)c1ccccc1 ZINC000422839985 330157190 /nfs/dbraw/zinc/15/71/90/330157190.db2.gz RTLQRGXJSUUSSQ-QKLQHJQFSA-N 1 3 296.458 3.728 20 0 CHADHO C[C@H](CN[C@H]1CCC[C@@H]1[NH3+])c1c(Cl)cccc1Cl ZINC000422879286 330158891 /nfs/dbraw/zinc/15/88/91/330158891.db2.gz MDMVRRXRKXYKPC-ICCXJUOJSA-N 1 3 287.234 3.566 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H]1NCC1(Sc2ccccc2)CCCC1 ZINC000422912486 330160084 /nfs/dbraw/zinc/16/00/84/330160084.db2.gz WGZPJMVBIQPXBT-CVEARBPZSA-N 1 3 290.476 3.561 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+][C@H](C)C(c1ccccc1)c1ccccc1 ZINC000422934096 330161148 /nfs/dbraw/zinc/16/11/48/330161148.db2.gz FHGUYWWUKMLJBN-GVDBMIGSSA-N 1 3 296.458 3.922 20 0 CHADHO C[C@@H](CCC[NH3+])N[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000422935100 330161355 /nfs/dbraw/zinc/16/13/55/330161355.db2.gz KPNPUYVOTGFABM-KSSFIOAISA-N 1 3 286.394 3.632 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@H]1CCC(C)(C)c2ccccc21 ZINC000422939493 330161587 /nfs/dbraw/zinc/16/15/87/330161587.db2.gz FWMYLJKFOFZAFB-XEZPLFJOSA-N 1 3 260.425 3.515 20 0 CHADHO C[C@@H](CCCC[NH3+])NCc1nc2cc(Cl)ccc2s1 ZINC000422899656 330162077 /nfs/dbraw/zinc/16/20/77/330162077.db2.gz HZPMNBVDHOFPQS-JTQLQIEISA-N 1 3 297.855 3.557 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H](Cc1ccccc1)c1cccs1 ZINC000422979821 330162624 /nfs/dbraw/zinc/16/26/24/330162624.db2.gz KKPAOUIQKXRBTB-SQWLQELKSA-N 1 3 288.460 3.747 20 0 CHADHO c1ccc(CC[C@H]([NH2+]C2CCNCC2)c2ccccc2)cc1 ZINC000422948193 330163680 /nfs/dbraw/zinc/16/36/80/330163680.db2.gz QWJFVCZBBSSHMP-FQEVSTJZSA-N 1 3 294.442 3.702 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000422954080 330163977 /nfs/dbraw/zinc/16/39/77/330163977.db2.gz HFUVOSMFPMETBN-RVBZMBCESA-N 1 3 287.234 3.696 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000422954079 330164149 /nfs/dbraw/zinc/16/41/49/330164149.db2.gz HFUVOSMFPMETBN-MWODSPESSA-N 1 3 287.234 3.696 20 0 CHADHO c1ccc(C2CC(N[C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)C2)cc1 ZINC000422968664 330164444 /nfs/dbraw/zinc/16/44/44/330164444.db2.gz RTRBKUSCIKASKP-GNWGEKMJSA-N 1 3 298.474 3.833 20 0 CHADHO C(=C\c1ccccc1)\CN[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000422972813 330164704 /nfs/dbraw/zinc/16/47/04/330164704.db2.gz AKFSUCSFSAISKM-RLZQMHOASA-N 1 3 292.426 3.783 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)NC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000423025276 330166033 /nfs/dbraw/zinc/16/60/33/330166033.db2.gz NVSBXIKBOWRFJG-QXGIVVGOSA-N 1 3 286.463 3.614 20 0 CHADHO Cc1cccc([C@@H](N[C@H](C)CCCC[NH3+])c2ccccn2)c1 ZINC000423030780 330166153 /nfs/dbraw/zinc/16/61/53/330166153.db2.gz WHJKOLLKKVDUDX-VQIMIIECSA-N 1 3 297.446 3.587 20 0 CHADHO c1ccc([C@H](CC2CCC2)N[C@H]2CCC[NH2+]CC2)cc1 ZINC000423038883 330166495 /nfs/dbraw/zinc/16/64/95/330166495.db2.gz DJCPNIMXOQUFHS-ROUUACIJSA-N 1 3 272.436 3.650 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CC[C@H](C)CC(C)(C)C ZINC000423059673 330167601 /nfs/dbraw/zinc/16/76/01/330167601.db2.gz MMVLGVAGHJNTLH-UONOGXRCSA-N 1 3 291.483 3.962 20 0 CHADHO C[C@H]1CCNCC[C@@H]1[NH2+]CCCCCc1ccc(F)cc1 ZINC000423064563 330168070 /nfs/dbraw/zinc/16/80/70/330168070.db2.gz RSIPLRNHGMVKAN-YJBOKZPZSA-N 1 3 292.442 3.516 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC000423077672 330168537 /nfs/dbraw/zinc/16/85/37/330168537.db2.gz MPHRVNFJYXNYLX-HCXYKTFWSA-N 1 3 286.463 3.820 20 0 CHADHO Cc1ccc([C@H](N[C@H](C)CCCC[NH3+])c2ccccn2)cc1 ZINC000423082596 330168698 /nfs/dbraw/zinc/16/86/98/330168698.db2.gz DNMLDOQYLBSFAQ-APWZRJJASA-N 1 3 297.446 3.587 20 0 CHADHO CC(C)[C@@H]1C[C@@H](C[NH2+][C@@H](C)C[C@@H](C)N)c2ccccc21 ZINC000423089425 330169088 /nfs/dbraw/zinc/16/90/88/330169088.db2.gz VHUPPCGYJHJYLZ-LLDVTBCESA-N 1 3 274.452 3.629 20 0 CHADHO [NH3+][C@H]1CCCCC[C@@H]1N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423095425 330169450 /nfs/dbraw/zinc/16/94/50/330169450.db2.gz MBPDTCFRKAJCTQ-HJWJTTGWSA-N 1 3 292.854 3.836 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@@H]1CCC[C@H](C)[C@@H]1C ZINC000423105667 330170543 /nfs/dbraw/zinc/17/05/43/330170543.db2.gz ZEDLKBWCIXUPHU-YXWQFLTLSA-N 1 3 289.467 3.572 20 0 CHADHO [NH3+][C@H]1CCCCC[C@H]1N[C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423146042 330172457 /nfs/dbraw/zinc/17/24/57/330172457.db2.gz NPZDMSXMGZDSBR-MGBSGCIJSA-N 1 3 292.854 3.836 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H](c1ccc(F)c(Cl)c1)C1CC1 ZINC000423153448 330173153 /nfs/dbraw/zinc/17/31/53/330173153.db2.gz GNSOWCPLJIQVTQ-WMFXKJRFSA-N 1 3 284.806 3.646 20 0 CHADHO CCC[C@H]([NH2+][C@H](C)c1ccc(CN)nc1C)C(C)(C)C ZINC000423154454 330173186 /nfs/dbraw/zinc/17/31/86/330173186.db2.gz HSYIFTUKHYHFGT-CJNGLKHVSA-N 1 3 277.456 3.714 20 0 CHADHO CC[C@@H]1CCCC[C@@H]1C[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000423166535 330174138 /nfs/dbraw/zinc/17/41/38/330174138.db2.gz ZKKFDOHFQYFMAO-NUEKZKHPSA-N 1 3 289.467 3.716 20 0 CHADHO C[C@H](C[C@@H]1CCCCC[NH2+]1)N1CCC[C@@]2(CCSC2)C1 ZINC000423167811 330174251 /nfs/dbraw/zinc/17/42/51/330174251.db2.gz XGUJSAUTOQCHAR-IXDOHACOSA-N 1 3 296.524 3.516 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@H]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000423170753 330174580 /nfs/dbraw/zinc/17/45/80/330174580.db2.gz YTHVIOLLRGOHFE-GMZLATJGSA-N 1 3 280.843 3.692 20 0 CHADHO Cc1cc([C@H](C)[NH2+]CC2(N)CCCCC2)c(C)s1 ZINC000423174547 330174867 /nfs/dbraw/zinc/17/48/67/330174867.db2.gz AZEVNUXEXMKTRN-LBPRGKRZSA-N 1 3 266.454 3.677 20 0 CHADHO CC(C)(C)[C@@H](CCC1CCCC1)[NH2+]C1CCNCC1 ZINC000423180140 330175460 /nfs/dbraw/zinc/17/54/60/330175460.db2.gz IEVCXDGJAPMIDL-MRXNPFEDSA-N 1 3 266.473 3.713 20 0 CHADHO CCCCCOc1ccc([C@H](C)[NH2+]C2CCNCC2)cc1 ZINC000423192537 330176110 /nfs/dbraw/zinc/17/61/10/330176110.db2.gz VUOKECNXMKYWPB-HNNXBMFYSA-N 1 3 290.451 3.658 20 0 CHADHO CC(C)CC[C@@H]1CC[C@H]([NH2+][C@H](C)[C@@H]2CCCNC2)C1 ZINC000423205174 330176964 /nfs/dbraw/zinc/17/69/64/330176964.db2.gz AZILXZQZPOHECX-VQHPVUNQSA-N 1 3 266.473 3.569 20 0 CHADHO Fc1ccc([C@H](NC[C@@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC000423212726 330178376 /nfs/dbraw/zinc/17/83/76/330178376.db2.gz MEPRFVCUHALLFP-RDTXWAMCSA-N 1 3 290.426 3.646 20 0 CHADHO Fc1ccc([C@H]([NH2+]C[C@@H]2CCCNC2)C2CCCC2)cc1 ZINC000423212726 330178377 /nfs/dbraw/zinc/17/83/77/330178377.db2.gz MEPRFVCUHALLFP-RDTXWAMCSA-N 1 3 290.426 3.646 20 0 CHADHO C[C@@H](NC[C@@H]1CCC[NH2+]C1)c1ccc(F)c2ccccc21 ZINC000423216914 330178702 /nfs/dbraw/zinc/17/87/02/330178702.db2.gz SNKUJVOWLBVRNX-ZIAGYGMSSA-N 1 3 286.394 3.629 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCCNC1)c1ccc(F)c2ccccc21 ZINC000423216914 330178705 /nfs/dbraw/zinc/17/87/05/330178705.db2.gz SNKUJVOWLBVRNX-ZIAGYGMSSA-N 1 3 286.394 3.629 20 0 CHADHO CCC[C@H](NCC[C@H](C)[NH3+])c1cccc(C(F)(F)F)c1 ZINC000423222682 330179860 /nfs/dbraw/zinc/17/98/60/330179860.db2.gz CCDCNBFPXJUGME-FZMZJTMJSA-N 1 3 288.357 3.874 20 0 CHADHO CC(C)Sc1ccc([C@@H](C)NCC[C@H](C)[NH3+])cc1 ZINC000423224134 330180038 /nfs/dbraw/zinc/18/00/38/330180038.db2.gz IHWWIRYROQLJPU-QWHCGFSZSA-N 1 3 266.454 3.575 20 0 CHADHO C[C@H]([NH3+])CCN[C@@H](C)c1cccc(OCc2ccccc2)c1 ZINC000423225839 330180063 /nfs/dbraw/zinc/18/00/63/330180063.db2.gz OKWWPFBFDFJMQX-HOTGVXAUSA-N 1 3 298.430 3.654 20 0 CHADHO C[C@@H]([NH3+])CCN[C@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423226019 330180451 /nfs/dbraw/zinc/18/04/51/330180451.db2.gz PCYLQPMBRXANJG-IAQYHMDHSA-N 1 3 266.816 3.508 20 0 CHADHO C[C@H]([NH3+])CCN[C@H](CCc1ccccc1)c1ccccc1 ZINC000423225980 330180468 /nfs/dbraw/zinc/18/04/68/330180468.db2.gz OYXNEORYPVDFHO-QFBILLFUSA-N 1 3 282.431 3.687 20 0 CHADHO CC(C)Sc1ccc([C@H](C)[NH2+]C[C@@H](N)C(C)C)cc1 ZINC000423264513 330184152 /nfs/dbraw/zinc/18/41/52/330184152.db2.gz CCUYOZMTEWARBQ-XJKSGUPXSA-N 1 3 280.481 3.821 20 0 CHADHO CC[C@H](N[C@@H](C[NH3+])C1CCCCC1)c1cccs1 ZINC000423267851 330184526 /nfs/dbraw/zinc/18/45/26/330184526.db2.gz UBXHKLQQBWASQG-KBPBESRZSA-N 1 3 266.454 3.696 20 0 CHADHO CCC(N)(CC)C[NH2+][C@@H](C)c1ccc(-c2ccncc2)cc1 ZINC000423283265 330185691 /nfs/dbraw/zinc/18/56/91/330185691.db2.gz FCCBAVMHBVGNJE-HNNXBMFYSA-N 1 3 297.446 3.917 20 0 CHADHO CC(C)[C@H]([NH3+])CN[C@H](C)C(c1ccccc1)c1ccccc1 ZINC000423285890 330185771 /nfs/dbraw/zinc/18/57/71/330185771.db2.gz ZSOHQNWUGMJLNG-VQIMIIECSA-N 1 3 296.458 3.780 20 0 CHADHO CC[C@@H]([NH2+]CC(C)(C)N)c1ccc2cc(OC)ccc2c1 ZINC000423286454 330186030 /nfs/dbraw/zinc/18/60/30/330186030.db2.gz HJZUKMMJQLEACL-QGZVFWFLSA-N 1 3 286.419 3.626 20 0 CHADHO COc1ccccc1-c1ccc([C@H](C)[NH2+]CC(C)(C)N)cc1 ZINC000423289526 330186632 /nfs/dbraw/zinc/18/66/32/330186632.db2.gz XJPJZJNXUIMQJX-AWEZNQCLSA-N 1 3 298.430 3.750 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc(F)c(F)c2)cc1 ZINC000423293178 330187693 /nfs/dbraw/zinc/18/76/93/330187693.db2.gz QCSWTPQKMULJDQ-NEPJUHHUSA-N 1 3 290.357 3.835 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H]2CCCNc3ccccc32)cc1 ZINC000423292674 330187754 /nfs/dbraw/zinc/18/77/54/330187754.db2.gz NVLXWGZRNQEWDO-KUHUBIRLSA-N 1 3 295.430 3.743 20 0 CHADHO C[C@H](C[NH3+])CN[C@@H](C)c1ccc(OCc2ccccc2)cc1 ZINC000423294843 330188141 /nfs/dbraw/zinc/18/81/41/330188141.db2.gz CWOZGIFNVWQENG-CVEARBPZSA-N 1 3 298.430 3.511 20 0 CHADHO CCC[C@@H](NC[C@@H](C)C[NH3+])c1cccc(C(F)(F)F)c1 ZINC000423296099 330188219 /nfs/dbraw/zinc/18/82/19/330188219.db2.gz GCZZXACNSLVYMZ-SMDDNHRTSA-N 1 3 288.357 3.731 20 0 CHADHO C[C@H](C[NH3+])CN[C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000423299392 330188890 /nfs/dbraw/zinc/18/88/90/330188890.db2.gz QAEKNAMKELDUCQ-CABCVRRESA-N 1 3 268.404 3.599 20 0 CHADHO CC(C)C[C@H](NC[C@]1(C)CCC[NH2+]C1)c1cccs1 ZINC000423318674 330189969 /nfs/dbraw/zinc/18/99/69/330189969.db2.gz CVXCLISFZMBJBV-GOEBONIOSA-N 1 3 280.481 3.815 20 0 CHADHO CC(C)C[C@H]([NH2+]C[C@]1(C)CCCNC1)c1cccs1 ZINC000423318674 330189970 /nfs/dbraw/zinc/18/99/70/330189970.db2.gz CVXCLISFZMBJBV-GOEBONIOSA-N 1 3 280.481 3.815 20 0 CHADHO CC(C)Sc1ccc([C@H](C)NCC2=CC[NH2+]CC2)cc1 ZINC000423342984 330192313 /nfs/dbraw/zinc/19/23/13/330192313.db2.gz LHBDAFIQQGJEHC-AWEZNQCLSA-N 1 3 290.476 3.757 20 0 CHADHO Cc1cc(C)c([C@H](C)NC[C@]2(C)CCC[NH2+]C2)cc1C ZINC000423344318 330192423 /nfs/dbraw/zinc/19/24/23/330192423.db2.gz XQACXLYFPYOWSW-FUHWJXTLSA-N 1 3 274.452 3.652 20 0 CHADHO Cc1cc(C)c([C@H](C)[NH2+]C[C@]2(C)CCCNC2)cc1C ZINC000423344318 330192424 /nfs/dbraw/zinc/19/24/24/330192424.db2.gz XQACXLYFPYOWSW-FUHWJXTLSA-N 1 3 274.452 3.652 20 0 CHADHO C[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccc(Cl)s1 ZINC000423354186 330192992 /nfs/dbraw/zinc/19/29/92/330192992.db2.gz FPTNSTVAOCPGHW-SNVBAGLBSA-N 1 3 292.835 3.856 20 0 CHADHO C[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1cccc(Cl)c1 ZINC000423357206 330193265 /nfs/dbraw/zinc/19/32/65/330193265.db2.gz LUGSCYOXWUBIGL-LBPRGKRZSA-N 1 3 286.806 3.794 20 0 CHADHO CC[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccc(OC)cc1 ZINC000423359857 330193722 /nfs/dbraw/zinc/19/37/22/330193722.db2.gz PRMNRVDWAQXXMR-IBGZPJMESA-N 1 3 296.414 3.539 20 0 CHADHO C[C@@H]([NH2+][C@H]1CCN[C@H](C)C1)c1ccccc1C(C)(C)C ZINC000423362998 330193843 /nfs/dbraw/zinc/19/38/43/330193843.db2.gz AEFDIHZLLXPAIZ-KFWWJZLASA-N 1 3 274.452 3.775 20 0 CHADHO CCC[C@H]([NH2+][C@H]1CCNC[C@H]1C)c1ccc(Cl)cc1 ZINC000423363921 330194253 /nfs/dbraw/zinc/19/42/53/330194253.db2.gz CDEDSFXDBGZPNU-KCXAZCMYSA-N 1 3 280.843 3.769 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](N[C@H]2CCCc3c(Cl)cccc32)C1 ZINC000423364390 330194426 /nfs/dbraw/zinc/19/44/26/330194426.db2.gz AMOVIXHGYNHUGV-WQGACYEGSA-N 1 3 278.827 3.577 20 0 CHADHO C[C@@H]1CC[C@H](N[C@@H]2CCC[C@H]([NH3+])C2)c2sccc21 ZINC000423365876 330194598 /nfs/dbraw/zinc/19/45/98/330194598.db2.gz KUYLTOAWDVBEJG-CZXHOFHRSA-N 1 3 264.438 3.546 20 0 CHADHO C[C@@H]([NH2+][C@H]1CCN[C@H](C)C1)c1cc2ccccc2s1 ZINC000423368659 330195020 /nfs/dbraw/zinc/19/50/20/330195020.db2.gz BGUULYUCCKUOET-BZPMIXESSA-N 1 3 274.433 3.692 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1cc2ccccc2s1 ZINC000423368662 330195072 /nfs/dbraw/zinc/19/50/72/330195072.db2.gz BGUULYUCCKUOET-YRGRVCCFSA-N 1 3 274.433 3.692 20 0 CHADHO Cc1ccccc1[C@H](N[C@H]1CC[NH2+][C@H](C)C1)C1CCCC1 ZINC000423372415 330195380 /nfs/dbraw/zinc/19/53/80/330195380.db2.gz GGVXGZXTJYURQE-HHXXYDBFSA-N 1 3 286.463 3.956 20 0 CHADHO Cc1ccccc1[C@H]([NH2+][C@H]1CCN[C@H](C)C1)C1CCCC1 ZINC000423372415 330195381 /nfs/dbraw/zinc/19/53/81/330195381.db2.gz GGVXGZXTJYURQE-HHXXYDBFSA-N 1 3 286.463 3.956 20 0 CHADHO Fc1ccc2c(c1)[C@H](NCc1ccc3c(c1)C[NH2+]C3)CCC2 ZINC000423399190 330195833 /nfs/dbraw/zinc/19/58/33/330195833.db2.gz UUPMJVHOASQCBL-LJQANCHMSA-N 1 3 296.389 3.596 20 0 CHADHO Cc1cccc([C@H](C)NCc2ccc3c(c2)C[NH2+]C3)c1C ZINC000423400440 330195877 /nfs/dbraw/zinc/19/58/77/330195877.db2.gz VJANOBDEWHQQCT-HNNXBMFYSA-N 1 3 280.415 3.757 20 0 CHADHO CC(C)C[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)c1cccs1 ZINC000423403711 330196267 /nfs/dbraw/zinc/19/62/67/330196267.db2.gz XDXBOAFLSMLQQA-RDBSUJKOSA-N 1 3 266.454 3.695 20 0 CHADHO CC(C)C[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1cccs1 ZINC000423403710 330196373 /nfs/dbraw/zinc/19/63/73/330196373.db2.gz XDXBOAFLSMLQQA-MJBXVCDLSA-N 1 3 266.454 3.695 20 0 CHADHO Cc1ccc([C@H](N[C@H]2CCC[C@H]([NH3+])C2)C2CCCC2)o1 ZINC000423404682 330196755 /nfs/dbraw/zinc/19/67/55/330196755.db2.gz XOOYUNITADJUGF-YQQAZPJKSA-N 1 3 276.424 3.679 20 0 CHADHO c1ccc([C@H]2CC[C@H]([NH2+]Cc3ccc4c(c3)CNC4)C2)cc1 ZINC000423376051 330198581 /nfs/dbraw/zinc/19/85/81/330198581.db2.gz JABQOFJHSIIPQV-PXNSSMCTSA-N 1 3 292.426 3.716 20 0 CHADHO C[C@@H](N[C@H]1CC[NH2+][C@H](C)C1)c1cccc2ccccc21 ZINC000423381769 330199402 /nfs/dbraw/zinc/19/94/02/330199402.db2.gz OOOFAQMWLFCVLC-FMKPAKJESA-N 1 3 268.404 3.631 20 0 CHADHO C[C@@H]([NH2+][C@H]1CCN[C@H](C)C1)c1cccc2ccccc21 ZINC000423381769 330199403 /nfs/dbraw/zinc/19/94/03/330199403.db2.gz OOOFAQMWLFCVLC-FMKPAKJESA-N 1 3 268.404 3.631 20 0 CHADHO CCCC[C@H](N[C@@H]1CC[NH2+]C[C@@H]1C)c1ccccc1 ZINC000423384493 330199488 /nfs/dbraw/zinc/19/94/88/330199488.db2.gz GAAXVVPWWHYOFI-UAGQMJEPSA-N 1 3 260.425 3.506 20 0 CHADHO CCCC[C@H]([NH2+][C@@H]1CCNC[C@@H]1C)c1ccccc1 ZINC000423384493 330199490 /nfs/dbraw/zinc/19/94/90/330199490.db2.gz GAAXVVPWWHYOFI-UAGQMJEPSA-N 1 3 260.425 3.506 20 0 CHADHO CC(C)[C@@H]([NH2+][C@H]1CCN[C@H](C)C1)c1ccc(Cl)cc1 ZINC000423384933 330199630 /nfs/dbraw/zinc/19/96/30/330199630.db2.gz QOGLLJVFLYTFAP-UHOFOFEASA-N 1 3 280.843 3.767 20 0 CHADHO Cc1ccc([C@H](C)NCc2ccc3c(c2)C[NH2+]C3)s1 ZINC000423393625 330200705 /nfs/dbraw/zinc/20/07/05/330200705.db2.gz QSRMNGFCSBLADO-LBPRGKRZSA-N 1 3 272.417 3.511 20 0 CHADHO C[C@@H]([NH2+][C@H](CC(C)(C)C)c1ccc(F)cc1)[C@H](C)N ZINC000423432764 330201087 /nfs/dbraw/zinc/20/10/87/330201087.db2.gz BMJZCLRDJCALFT-YWPYICTPSA-N 1 3 266.404 3.628 20 0 CHADHO CC(C)Sc1ccc([C@H](C)[NH2+][C@H](C)[C@@H](C)N)cc1 ZINC000423447413 330202549 /nfs/dbraw/zinc/20/25/49/330202549.db2.gz OXNKEEAASZKYHD-UPJWGTAASA-N 1 3 266.454 3.573 20 0 CHADHO CCCCCOc1ccc([C@H](C)[NH2+][C@H](C)[C@@H](C)N)cc1 ZINC000423450694 330203007 /nfs/dbraw/zinc/20/30/07/330203007.db2.gz UAAWCTJZJIEXNH-KFWWJZLASA-N 1 3 278.440 3.642 20 0 CHADHO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@H](C)[C@H](C)N ZINC000423452442 330203218 /nfs/dbraw/zinc/20/32/18/330203218.db2.gz WIFDXRAGGYLPSH-TUAOUCFPSA-N 1 3 289.448 3.505 20 0 CHADHO CC[C@H]([NH3+])CN[C@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000423459144 330203772 /nfs/dbraw/zinc/20/37/72/330203772.db2.gz HSRKWIXMSZYLPE-KGLIPLIRSA-N 1 3 287.451 3.551 20 0 CHADHO CC[C@@H](N)C[NH2+][C@@H](CC)c1ccc(Cl)c(Cl)c1 ZINC000423461102 330204077 /nfs/dbraw/zinc/20/40/77/330204077.db2.gz JJWKCKHIFZAWFE-MFKMUULPSA-N 1 3 275.223 3.771 20 0 CHADHO CC[C@@H](N)C[NH2+][C@@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423465614 330204358 /nfs/dbraw/zinc/20/43/58/330204358.db2.gz MURSPONCDUXHSO-CABCVRRESA-N 1 3 266.816 3.508 20 0 CHADHO COc1ccc(Cl)cc1[C@@H](C)NCCC[C@H]1CCC[NH2+]1 ZINC000423474814 330205521 /nfs/dbraw/zinc/20/55/21/330205521.db2.gz HNRDPPPTBLLQCC-OCCSQVGLSA-N 1 3 296.842 3.531 20 0 CHADHO COc1ccc([C@H](C)N[C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423494258 330207657 /nfs/dbraw/zinc/20/76/57/330207657.db2.gz AJZURGZOWWWEHA-HNAYVOBHSA-N 1 3 298.430 3.826 20 0 CHADHO [NH3+]CCC[C@H](N[C@H]1CCc2c1cccc2F)c1ccccc1 ZINC000423495784 330207961 /nfs/dbraw/zinc/20/79/61/330207961.db2.gz CQJKQVDTWBMKBH-OALUTQOASA-N 1 3 298.405 3.883 20 0 CHADHO C[C@H](N[C@H](CCC[NH3+])c1ccccc1)c1ccsc1 ZINC000423498303 330208058 /nfs/dbraw/zinc/20/80/58/330208058.db2.gz HXSFSUSZPIRMGW-XJKSGUPXSA-N 1 3 274.433 3.879 20 0 CHADHO [NH3+]CCC[C@@H](N[C@H]1CCc2ccc(F)cc21)c1ccccc1 ZINC000423507719 330209215 /nfs/dbraw/zinc/20/92/15/330209215.db2.gz QHDTXCSJRKUZQB-MOPGFXCFSA-N 1 3 298.405 3.883 20 0 CHADHO CC(C)C[C@H]([NH2+]CCCNC1CC1)c1ccccc1 ZINC000423526067 330209940 /nfs/dbraw/zinc/20/99/40/330209940.db2.gz KZTFZSUBRVWJLG-KRWDZBQOSA-N 1 3 260.425 3.506 20 0 CHADHO C[C@@H](NCCC[NH2+]C1CC1)c1cccc2ccccc21 ZINC000423529938 330210299 /nfs/dbraw/zinc/21/02/99/330210299.db2.gz QQDZWYXRFCKJFM-CQSZACIVSA-N 1 3 268.404 3.633 20 0 CHADHO C[C@@H]([NH2+]CCCNC1CC1)c1cccc2ccccc21 ZINC000423529938 330210300 /nfs/dbraw/zinc/21/03/00/330210300.db2.gz QQDZWYXRFCKJFM-CQSZACIVSA-N 1 3 268.404 3.633 20 0 CHADHO C[C@H]([NH2+]CCCNC1CC1)[C@@H](C)c1ccc(Cl)cc1 ZINC000423550948 330211531 /nfs/dbraw/zinc/21/15/31/330211531.db2.gz IUJYRCSAIRSTPX-OLZOCXBDSA-N 1 3 280.843 3.564 20 0 CHADHO COc1ccc([C@@H](C)[NH2+][C@H]2CCCCNC2)c2ccccc12 ZINC000423570791 330212092 /nfs/dbraw/zinc/21/20/92/330212092.db2.gz XDBHTORJVSRSIG-CABCVRRESA-N 1 3 298.430 3.641 20 0 CHADHO C[C@@H](NCCC1=CC[NH2+]CC1)c1cc(Cl)ccc1Cl ZINC000423571781 330212116 /nfs/dbraw/zinc/21/21/16/330212116.db2.gz XURKIJZXDIROMI-LLVKDONJSA-N 1 3 299.245 3.954 20 0 CHADHO C[C@@H](C[NH2+]CCCN1CCCC[C@H]1C)c1ccc(F)cc1 ZINC000527116834 330223283 /nfs/dbraw/zinc/22/32/83/330223283.db2.gz LAUAPSUSCLHHEP-JKSUJKDBSA-N 1 3 292.442 3.783 20 0 CHADHO C[C@@H](CNCCC[N@@H+]1CCCC[C@H]1C)c1ccc(F)cc1 ZINC000527116834 330223285 /nfs/dbraw/zinc/22/32/85/330223285.db2.gz LAUAPSUSCLHHEP-JKSUJKDBSA-N 1 3 292.442 3.783 20 0 CHADHO C[C@@H](CNCCC[N@H+]1CCCC[C@H]1C)c1ccc(F)cc1 ZINC000527116834 330223287 /nfs/dbraw/zinc/22/32/87/330223287.db2.gz LAUAPSUSCLHHEP-JKSUJKDBSA-N 1 3 292.442 3.783 20 0 CHADHO CC(C)c1cccc([C@H](C)NC[C@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000527850776 330288317 /nfs/dbraw/zinc/28/83/17/330288317.db2.gz NZTYWPYVYPCWRB-JKSUJKDBSA-N 1 3 286.463 3.945 20 0 CHADHO CC(C)c1cccc([C@H](C)NC[C@H]2CC[N@H+](C3CC3)C2)c1 ZINC000527850776 330288318 /nfs/dbraw/zinc/28/83/18/330288318.db2.gz NZTYWPYVYPCWRB-JKSUJKDBSA-N 1 3 286.463 3.945 20 0 CHADHO CC[NH+](CC)CCCNC1CC(c2ccc(Cl)cc2)C1 ZINC000036842392 330292554 /nfs/dbraw/zinc/29/25/54/330292554.db2.gz HRISNBBDIGCEAY-UHFFFAOYSA-N 1 3 294.870 3.908 20 0 CHADHO CCN(CC)CCC[NH2+]C1CC(c2ccc(Cl)cc2)C1 ZINC000036842392 330292555 /nfs/dbraw/zinc/29/25/55/330292555.db2.gz HRISNBBDIGCEAY-UHFFFAOYSA-N 1 3 294.870 3.908 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC[C@@H]2CC=CCC2)CC1 ZINC000527988772 330299002 /nfs/dbraw/zinc/29/90/02/330299002.db2.gz YOQQACLVIFKIAE-OAHLLOKOSA-N 1 3 264.457 3.585 20 0 CHADHO CCCC[N@H+](C)CC1CCN(C/C=C(/C)Cl)CC1 ZINC000528358435 330322083 /nfs/dbraw/zinc/32/20/83/330322083.db2.gz ZXXMPWKJBWBDAG-NSIKDUERSA-N 1 3 272.864 3.573 20 0 CHADHO CCCC[N@@H+](C)CC1CCN(C/C=C(/C)Cl)CC1 ZINC000528358435 330322084 /nfs/dbraw/zinc/32/20/84/330322084.db2.gz ZXXMPWKJBWBDAG-NSIKDUERSA-N 1 3 272.864 3.573 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2c(C)cc(C)cc2C)[C@@H](C)C1 ZINC000533072666 330326959 /nfs/dbraw/zinc/32/69/59/330326959.db2.gz WZBXYBBOSYBNBI-PKOBYXMFSA-N 1 3 288.479 3.774 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2c(C)cc(C)cc2C)[C@@H](C)C1 ZINC000533072666 330326960 /nfs/dbraw/zinc/32/69/60/330326960.db2.gz WZBXYBBOSYBNBI-PKOBYXMFSA-N 1 3 288.479 3.774 20 0 CHADHO CC[C@H](NC[C@@H]1CCC[N@H+](C)C1)c1cccc(Cl)c1 ZINC000044534436 330329874 /nfs/dbraw/zinc/32/98/74/330329874.db2.gz IJKIHVIUJMJNFI-BBRMVZONSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@H](NC[C@@H]1CCC[N@@H+](C)C1)c1cccc(Cl)c1 ZINC000044534436 330329875 /nfs/dbraw/zinc/32/98/75/330329875.db2.gz IJKIHVIUJMJNFI-BBRMVZONSA-N 1 3 280.843 3.723 20 0 CHADHO CC(C)c1ccc([C@H](C)NC[C@H]2CCC[N@H+](C)C2)cc1 ZINC000044535657 330330010 /nfs/dbraw/zinc/33/00/10/330330010.db2.gz JAXUZRCCVSXJBF-JKSUJKDBSA-N 1 3 274.452 3.802 20 0 CHADHO CC(C)c1ccc([C@H](C)NC[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000044535657 330330011 /nfs/dbraw/zinc/33/00/11/330330011.db2.gz JAXUZRCCVSXJBF-JKSUJKDBSA-N 1 3 274.452 3.802 20 0 CHADHO CC(C)Cc1ccc([C@@H](C)NC[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000044534590 330330026 /nfs/dbraw/zinc/33/00/26/330330026.db2.gz FHZWOOBSUGIPED-AEFFLSMTSA-N 1 3 288.479 3.878 20 0 CHADHO CC(C)Cc1ccc([C@@H](C)NC[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000044534590 330330027 /nfs/dbraw/zinc/33/00/27/330330027.db2.gz FHZWOOBSUGIPED-AEFFLSMTSA-N 1 3 288.479 3.878 20 0 CHADHO C[C@@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccc(C(C)(C)C)cc1 ZINC000044534624 330330038 /nfs/dbraw/zinc/33/00/38/330330038.db2.gz BXEKIBGWIVEABJ-CVEARBPZSA-N 1 3 288.479 3.977 20 0 CHADHO C[C@@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccc(C(C)(C)C)cc1 ZINC000044534624 330330039 /nfs/dbraw/zinc/33/00/39/330330039.db2.gz BXEKIBGWIVEABJ-CVEARBPZSA-N 1 3 288.479 3.977 20 0 CHADHO Cc1cc([C@@H](C)NC2CC[NH+](C3CC3)CC2)cc(C)c1F ZINC000119732621 330377742 /nfs/dbraw/zinc/37/77/42/330377742.db2.gz DXTNYYPYWNBSBL-CQSZACIVSA-N 1 3 290.426 3.720 20 0 CHADHO CC[C@H](N[C@H]1CCC[C@@H]1C[NH3+])c1cccc(Cl)c1 ZINC000089148256 330380908 /nfs/dbraw/zinc/38/09/08/330380908.db2.gz TWKYFGAVNGAJMQ-SNPRPXQTSA-N 1 3 266.816 3.508 20 0 CHADHO CCc1ccc([C@H](C)NCCC2CC[NH+](CC)CC2)o1 ZINC000121831166 330407809 /nfs/dbraw/zinc/40/78/09/330407809.db2.gz BNKOOVXIAYMPKI-AWEZNQCLSA-N 1 3 278.440 3.615 20 0 CHADHO CCOCCCNC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449068514 330896944 /nfs/dbraw/zinc/89/69/44/330896944.db2.gz SVTWZPVAUAKNIT-UHFFFAOYSA-N 1 3 298.515 3.682 20 0 CHADHO CC[C@@H]([NH2+]C1CCN(C2CCCCC2)CC1)C1CCC1 ZINC000449178318 330903917 /nfs/dbraw/zinc/90/39/17/330903917.db2.gz SBFWINBHZZZMHM-GOSISDBHSA-N 1 3 278.484 3.952 20 0 CHADHO CC[C@@H](NCc1cccc(C[N@H+](C)CC)c1)c1ccncc1 ZINC000453109223 331089922 /nfs/dbraw/zinc/08/99/22/331089922.db2.gz OZBJIXYUJPDBMY-LJQANCHMSA-N 1 3 297.446 3.774 20 0 CHADHO CC[C@@H](NCc1cccc(C[N@@H+](C)CC)c1)c1ccncc1 ZINC000453109223 331089923 /nfs/dbraw/zinc/08/99/23/331089923.db2.gz OZBJIXYUJPDBMY-LJQANCHMSA-N 1 3 297.446 3.774 20 0 CHADHO CCC1([NH2+]C2CCN([C@H]3CCCC[C@@H]3C)CC2)CC1 ZINC000453290027 331111603 /nfs/dbraw/zinc/11/16/03/331111603.db2.gz NAQOLSHILFLDIR-HOCLYGCPSA-N 1 3 264.457 3.562 20 0 CHADHO CCC1(NC2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)CC1 ZINC000453290027 331111604 /nfs/dbraw/zinc/11/16/04/331111604.db2.gz NAQOLSHILFLDIR-HOCLYGCPSA-N 1 3 264.457 3.562 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC2(C3CCC3)CCC2)CC1 ZINC000453405483 331129310 /nfs/dbraw/zinc/12/93/10/331129310.db2.gz SQRABNDVVMTFLD-UHFFFAOYSA-N 1 3 278.484 3.809 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+]C2CC(C)(c3ccccc3)C2)C1 ZINC000459432638 331281120 /nfs/dbraw/zinc/28/11/20/331281120.db2.gz UAILNEZRRSLLLG-BKVYNOPKSA-N 1 3 286.463 3.569 20 0 CHADHO C[NH+](C)[C@@H]1CCC[C@H](NC2CC(C)(c3ccccc3)C2)C1 ZINC000459432638 331281121 /nfs/dbraw/zinc/28/11/21/331281121.db2.gz UAILNEZRRSLLLG-BKVYNOPKSA-N 1 3 286.463 3.569 20 0 CHADHO C[C@H]1CCC[C@H](N2CCC([NH2+]CCC3(C)CC3)CC2)C1 ZINC000475207411 331618137 /nfs/dbraw/zinc/61/81/37/331618137.db2.gz AKYLKHKAZIMHGG-RDJZCZTQSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@H](CCc1ccccc1)[NH2+]CC(C)(C)CN1CCCC1 ZINC000477915041 331693564 /nfs/dbraw/zinc/69/35/64/331693564.db2.gz KENJIYIOVKPWMZ-QGZVFWFLSA-N 1 3 288.479 3.719 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1C[NH2+]C1CCN(CC(C)C)CC1 ZINC000479547327 331736366 /nfs/dbraw/zinc/73/63/66/331736366.db2.gz WUZCMHFMKJAOKZ-WMZOPIPTSA-N 1 3 278.484 3.689 20 0 CHADHO C[C@@H](CCCC(F)(F)F)[NH2+]CC[C@H](C)N1CCCCC1 ZINC000480708884 331785497 /nfs/dbraw/zinc/78/54/97/331785497.db2.gz JDWYLCIVTRXSJI-KBPBESRZSA-N 1 3 294.405 3.962 20 0 CHADHO C[C@H](C[NH2+][C@H](C)C(C)(C)c1ccccc1)CN1CCCC1 ZINC000481323152 331803826 /nfs/dbraw/zinc/80/38/26/331803826.db2.gz OOWHQUWIFRBPLG-IAGOWNOFSA-N 1 3 288.479 3.674 20 0 CHADHO CC(C)C1CC([NH2+][C@H](C)[C@H]2CCCN(C3CCC3)C2)C1 ZINC000488509294 332014795 /nfs/dbraw/zinc/01/47/95/332014795.db2.gz VNICXEPIQCPGOD-XNIRIUNOSA-N 1 3 278.484 3.664 20 0 CHADHO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1cccc(CN(C)C)c1 ZINC000502021056 332645626 /nfs/dbraw/zinc/64/56/26/332645626.db2.gz XUJZQFRLGPKWBA-ROUUACIJSA-N 1 3 274.452 3.807 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CC=CCC1)[C@H]1CCCN(C2CCC2)C1 ZINC000183102164 333119113 /nfs/dbraw/zinc/11/91/13/333119113.db2.gz LQSQOFQRMGBBTK-ULQDDVLXSA-N 1 3 276.468 3.585 20 0 CHADHO CC[C@H](N[C@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(Cl)c1 ZINC000219234682 333145035 /nfs/dbraw/zinc/14/50/35/333145035.db2.gz GPADXURDIJDRIU-RCBQFDQVSA-N 1 3 280.843 3.863 20 0 CHADHO CC[C@H](N[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(Cl)c1 ZINC000219234682 333145037 /nfs/dbraw/zinc/14/50/37/333145037.db2.gz GPADXURDIJDRIU-RCBQFDQVSA-N 1 3 280.843 3.863 20 0 CHADHO N[C@@H]1C[C@H]([NH2+]CCc2ccc(Cl)s2)c2ccccc21 ZINC000226344404 333257628 /nfs/dbraw/zinc/25/76/28/333257628.db2.gz JUBFIKAMAGJTDX-KGLIPLIRSA-N 1 3 292.835 3.678 20 0 CHADHO Cc1ccc(CN[C@@H](CC[NH+](C)C)C(C)(C)C)cc1C ZINC000522557788 333290042 /nfs/dbraw/zinc/29/00/42/333290042.db2.gz GRPGLUSOEYBLRT-KRWDZBQOSA-N 1 3 276.468 3.759 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CC[C@H]([C@H](C)[NH3+])C2)cc1 ZINC000228150301 333295818 /nfs/dbraw/zinc/29/58/18/333295818.db2.gz WOYVXELLERAPPO-ZQIUZPCESA-N 1 3 260.425 3.540 20 0 CHADHO C[C@H]([NH2+]C1CC(C)(C)NC(C)(C)C1)C1CCCCC1 ZINC000037232521 333520395 /nfs/dbraw/zinc/52/03/95/333520395.db2.gz YKTUUTFNXZEJQJ-ZDUSSCGKSA-N 1 3 266.473 3.854 20 0 CHADHO C[C@H](CC[NH2+]C[C@H](C)CN1CCCC1)c1ccccc1 ZINC000062079387 333542164 /nfs/dbraw/zinc/54/21/64/333542164.db2.gz UMMZCBUBFKNZGG-DLBZAZTESA-N 1 3 274.452 3.502 20 0 CHADHO CC[NH+](CC)C[C@H]1CCN([C@@H](C)CCc2ccccc2)C1 ZINC000174226835 335150821 /nfs/dbraw/zinc/15/08/21/335150821.db2.gz CZOVFVZLZGVSDF-PKOBYXMFSA-N 1 3 288.479 3.671 20 0 CHADHO CCN(CC)C[C@H]1CC[N@@H+]([C@@H](C)CCc2ccccc2)C1 ZINC000174226835 335150822 /nfs/dbraw/zinc/15/08/22/335150822.db2.gz CZOVFVZLZGVSDF-PKOBYXMFSA-N 1 3 288.479 3.671 20 0 CHADHO CCN(CC)C[C@H]1CC[N@H+]([C@@H](C)CCc2ccccc2)C1 ZINC000174226835 335150823 /nfs/dbraw/zinc/15/08/23/335150823.db2.gz CZOVFVZLZGVSDF-PKOBYXMFSA-N 1 3 288.479 3.671 20 0 CHADHO C(C1CCCCC1)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000134862547 334105961 /nfs/dbraw/zinc/10/59/61/334105961.db2.gz DQADZARDUDACJO-AEFFLSMTSA-N 1 3 276.468 3.515 20 0 CHADHO C(C1CCCCC1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134862547 334105962 /nfs/dbraw/zinc/10/59/62/334105962.db2.gz DQADZARDUDACJO-AEFFLSMTSA-N 1 3 276.468 3.515 20 0 CHADHO C[N@H+](CC1CC1)C[C@H]1CCN([C@H]2C=CCCCCC2)C1 ZINC000549464462 334194548 /nfs/dbraw/zinc/19/45/48/334194548.db2.gz CNLFKFZFGUWNIU-MSOLQXFVSA-N 1 3 276.468 3.539 20 0 CHADHO C[N@@H+](CC1CC1)C[C@H]1CCN([C@H]2C=CCCCCC2)C1 ZINC000549464462 334194549 /nfs/dbraw/zinc/19/45/49/334194549.db2.gz CNLFKFZFGUWNIU-MSOLQXFVSA-N 1 3 276.468 3.539 20 0 CHADHO CN(CC1CC1)C[C@H]1CC[N@@H+]([C@H]2C=CCCCCC2)C1 ZINC000549464462 334194550 /nfs/dbraw/zinc/19/45/50/334194550.db2.gz CNLFKFZFGUWNIU-MSOLQXFVSA-N 1 3 276.468 3.539 20 0 CHADHO CN(CC1CC1)C[C@H]1CC[N@H+]([C@H]2C=CCCCCC2)C1 ZINC000549464462 334194551 /nfs/dbraw/zinc/19/45/51/334194551.db2.gz CNLFKFZFGUWNIU-MSOLQXFVSA-N 1 3 276.468 3.539 20 0 CHADHO C[N@H+](CC1CC1)C[C@@H]1CCN([C@@H]2C=CCCCCC2)C1 ZINC000549464465 334194732 /nfs/dbraw/zinc/19/47/32/334194732.db2.gz CNLFKFZFGUWNIU-ZWKOTPCHSA-N 1 3 276.468 3.539 20 0 CHADHO C[N@@H+](CC1CC1)C[C@@H]1CCN([C@@H]2C=CCCCCC2)C1 ZINC000549464465 334194733 /nfs/dbraw/zinc/19/47/33/334194733.db2.gz CNLFKFZFGUWNIU-ZWKOTPCHSA-N 1 3 276.468 3.539 20 0 CHADHO CN(CC1CC1)C[C@@H]1CC[N@@H+]([C@@H]2C=CCCCCC2)C1 ZINC000549464465 334194734 /nfs/dbraw/zinc/19/47/34/334194734.db2.gz CNLFKFZFGUWNIU-ZWKOTPCHSA-N 1 3 276.468 3.539 20 0 CHADHO CN(CC1CC1)C[C@@H]1CC[N@H+]([C@@H]2C=CCCCCC2)C1 ZINC000549464465 334194735 /nfs/dbraw/zinc/19/47/35/334194735.db2.gz CNLFKFZFGUWNIU-ZWKOTPCHSA-N 1 3 276.468 3.539 20 0 CHADHO C1=C[C@@H](N2CCC[C@@H]([NH+]3CCCC3)CC2)CCCCC1 ZINC000549464167 334194754 /nfs/dbraw/zinc/19/47/54/334194754.db2.gz LEAPTGPBWSVOGO-QZTJIDSGSA-N 1 3 276.468 3.826 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN([C@@H]2CCCc3ccccc32)C1 ZINC000081568198 334196953 /nfs/dbraw/zinc/19/69/53/334196953.db2.gz LVRADUGFSNRJIX-VQIMIIECSA-N 1 3 286.463 3.728 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN([C@@H]2CCCc3ccccc32)C1 ZINC000081568198 334196954 /nfs/dbraw/zinc/19/69/54/334196954.db2.gz LVRADUGFSNRJIX-VQIMIIECSA-N 1 3 286.463 3.728 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+]([C@@H]2CCCc3ccccc32)C1 ZINC000081568198 334196955 /nfs/dbraw/zinc/19/69/55/334196955.db2.gz LVRADUGFSNRJIX-VQIMIIECSA-N 1 3 286.463 3.728 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+]([C@@H]2CCCc3ccccc32)C1 ZINC000081568198 334196956 /nfs/dbraw/zinc/19/69/56/334196956.db2.gz LVRADUGFSNRJIX-VQIMIIECSA-N 1 3 286.463 3.728 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](CC(C)C)c2cccs2)C1 ZINC000246947496 334272456 /nfs/dbraw/zinc/27/24/56/334272456.db2.gz HXWZUZZBHDYOGB-HUUCEWRRSA-N 1 3 280.481 3.767 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](CC(C)C)c2cccs2)C1 ZINC000246947496 334272457 /nfs/dbraw/zinc/27/24/57/334272457.db2.gz HXWZUZZBHDYOGB-HUUCEWRRSA-N 1 3 280.481 3.767 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](CC(C)C)c2cccs2)C1 ZINC000246947496 334272459 /nfs/dbraw/zinc/27/24/59/334272459.db2.gz HXWZUZZBHDYOGB-HUUCEWRRSA-N 1 3 280.481 3.767 20 0 CHADHO CC1(C)CCC[C@H]1C[NH2+]C1CCN(C2CCCC2)CC1 ZINC000550933564 334234128 /nfs/dbraw/zinc/23/41/28/334234128.db2.gz LAMAFVZEXHJPGK-HNNXBMFYSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@H](CCC(C)(C)C)[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000551787758 334261123 /nfs/dbraw/zinc/26/11/23/334261123.db2.gz LWBIVFXJVXMQRO-RBSFLKMASA-N 1 3 254.462 3.664 20 0 CHADHO CC[C@H](c1ccc(F)cc1F)[N@H+](C)C[C@H]1CCCN(C)C1 ZINC000246766059 334269248 /nfs/dbraw/zinc/26/92/48/334269248.db2.gz GRATUCOPKOSWEC-SUMWQHHRSA-N 1 3 296.405 3.690 20 0 CHADHO CC[C@H](c1ccc(F)cc1F)[N@@H+](C)C[C@H]1CCCN(C)C1 ZINC000246766059 334269250 /nfs/dbraw/zinc/26/92/50/334269250.db2.gz GRATUCOPKOSWEC-SUMWQHHRSA-N 1 3 296.405 3.690 20 0 CHADHO C[C@@H](NCCCC[N@@H+]1CCCC[C@H]1C)c1ccoc1 ZINC000247225169 334277614 /nfs/dbraw/zinc/27/76/14/334277614.db2.gz XYIVZDQAKMXNGZ-HUUCEWRRSA-N 1 3 264.413 3.585 20 0 CHADHO C[C@@H](NCCCC[N@H+]1CCCC[C@H]1C)c1ccoc1 ZINC000247225169 334277616 /nfs/dbraw/zinc/27/76/16/334277616.db2.gz XYIVZDQAKMXNGZ-HUUCEWRRSA-N 1 3 264.413 3.585 20 0 CHADHO CC[NH+](CC)C[C@@H]1CCN([C@H](C)CCc2ccccc2)C1 ZINC000247226822 334277660 /nfs/dbraw/zinc/27/76/60/334277660.db2.gz CZOVFVZLZGVSDF-MJGOQNOKSA-N 1 3 288.479 3.671 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+]([C@H](C)CCc2ccccc2)C1 ZINC000247226822 334277661 /nfs/dbraw/zinc/27/76/61/334277661.db2.gz CZOVFVZLZGVSDF-MJGOQNOKSA-N 1 3 288.479 3.671 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+]([C@H](C)CCc2ccccc2)C1 ZINC000247226822 334277662 /nfs/dbraw/zinc/27/76/62/334277662.db2.gz CZOVFVZLZGVSDF-MJGOQNOKSA-N 1 3 288.479 3.671 20 0 CHADHO CC[NH+](CC)C[C@H]1CCN([C@H](C)CCc2ccccc2)C1 ZINC000247226814 334277685 /nfs/dbraw/zinc/27/76/85/334277685.db2.gz CZOVFVZLZGVSDF-IEBWSBKVSA-N 1 3 288.479 3.671 20 0 CHADHO CCN(CC)C[C@H]1CC[N@@H+]([C@H](C)CCc2ccccc2)C1 ZINC000247226814 334277686 /nfs/dbraw/zinc/27/76/86/334277686.db2.gz CZOVFVZLZGVSDF-IEBWSBKVSA-N 1 3 288.479 3.671 20 0 CHADHO CCN(CC)C[C@H]1CC[N@H+]([C@H](C)CCc2ccccc2)C1 ZINC000247226814 334277687 /nfs/dbraw/zinc/27/76/87/334277687.db2.gz CZOVFVZLZGVSDF-IEBWSBKVSA-N 1 3 288.479 3.671 20 0 CHADHO C[C@H](N[C@H]1CCc2ccccc21)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248397580 334300145 /nfs/dbraw/zinc/30/01/45/334300145.db2.gz IBMJUXDJSANWFL-VPWXQRGCSA-N 1 3 298.474 3.917 20 0 CHADHO C[C@H](N[C@H]1CCc2ccccc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248397580 334300146 /nfs/dbraw/zinc/30/01/46/334300146.db2.gz IBMJUXDJSANWFL-VPWXQRGCSA-N 1 3 298.474 3.917 20 0 CHADHO C[C@H]([NH2+][C@H]1CCc2ccccc21)[C@@H]1CCCN(C2CCC2)C1 ZINC000248397580 334300148 /nfs/dbraw/zinc/30/01/48/334300148.db2.gz IBMJUXDJSANWFL-VPWXQRGCSA-N 1 3 298.474 3.917 20 0 CHADHO CC[C@H](C)[C@H](C)[NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000248406664 334300386 /nfs/dbraw/zinc/30/03/86/334300386.db2.gz SRSNCUSBUFXBTA-VGWMRTNUSA-N 1 3 266.473 3.664 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](c2ccc(F)c(F)c2)C(C)C)C1 ZINC000248459377 334302907 /nfs/dbraw/zinc/30/29/07/334302907.db2.gz VPNVOHIPIUZNPO-GUYCJALGSA-N 1 3 296.405 3.593 20 0 CHADHO C[N@@H+]1CC[C@H](NCc2cccc3ccccc32)[C@H]2CCC[C@H]21 ZINC000552248725 334308462 /nfs/dbraw/zinc/30/84/62/334308462.db2.gz QWCKWZYFQGGAGQ-HSALFYBXSA-N 1 3 294.442 3.802 20 0 CHADHO C[N@H+]1CC[C@H](NCc2cccc3ccccc32)[C@H]2CCC[C@H]21 ZINC000552248725 334308464 /nfs/dbraw/zinc/30/84/64/334308464.db2.gz QWCKWZYFQGGAGQ-HSALFYBXSA-N 1 3 294.442 3.802 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](Cc2ccccc2)C(C)C)C1 ZINC000249773834 334340176 /nfs/dbraw/zinc/34/01/76/334340176.db2.gz BZEVSBDEVZHCQV-RTBURBONSA-N 1 3 288.479 3.575 20 0 CHADHO c1ccc(CCC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCCN2)cc1 ZINC000250825551 334351506 /nfs/dbraw/zinc/35/15/06/334351506.db2.gz WXXZLLQXQZBJPW-IPMKNSEASA-N 1 3 286.463 3.520 20 0 CHADHO c1ccc(CCCN[C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000250825551 334351507 /nfs/dbraw/zinc/35/15/07/334351507.db2.gz WXXZLLQXQZBJPW-IPMKNSEASA-N 1 3 286.463 3.520 20 0 CHADHO CC(C)[C@H](N[C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000251268335 334359220 /nfs/dbraw/zinc/35/92/20/334359220.db2.gz BGPAQWZNTRRHPU-BZSNNMDCSA-N 1 3 272.436 3.600 20 0 CHADHO CC(C)[C@H](N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000251268335 334359221 /nfs/dbraw/zinc/35/92/21/334359221.db2.gz BGPAQWZNTRRHPU-BZSNNMDCSA-N 1 3 272.436 3.600 20 0 CHADHO C[C@H](c1ccccc1Cl)N(C)CC[C@H]1CCC[NH2+]C1 ZINC000251598199 334365314 /nfs/dbraw/zinc/36/53/14/334365314.db2.gz YSPNCVMOIQEYPU-ZIAGYGMSSA-N 1 3 280.843 3.723 20 0 CHADHO C1=C(CC[NH2+]C2CCN(C3CCCCC3)CC2)CCC1 ZINC000090798519 334367845 /nfs/dbraw/zinc/36/78/45/334367845.db2.gz SYYODNZGFHXBMC-UHFFFAOYSA-N 1 3 276.468 3.874 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+][C@H]1CCCc2sccc21 ZINC000252217839 334377381 /nfs/dbraw/zinc/37/73/81/334377381.db2.gz YFBSIWLQXVZCIZ-ZBFHGGJFSA-N 1 3 292.492 3.980 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](C)CC(C)(C)c2ccccc2)C1 ZINC000252440250 334380156 /nfs/dbraw/zinc/38/01/56/334380156.db2.gz YYVXTJHGSQVJDT-IAGOWNOFSA-N 1 3 288.479 3.674 20 0 CHADHO CCCc1cc(N2CC[C@H](C[NH+](C)C)C2)c2ccccc2n1 ZINC000555194843 334470630 /nfs/dbraw/zinc/47/06/30/334470630.db2.gz IDTIMCVDJQHJIO-OAHLLOKOSA-N 1 3 297.446 3.575 20 0 CHADHO C1CC12CCC[C@H]2[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000568274571 334811462 /nfs/dbraw/zinc/81/14/62/334811462.db2.gz DBBITBCNFPKVCV-QGZVFWFLSA-N 1 3 276.468 3.706 20 0 CHADHO CC(C)[C@H]1C[C@@H](N[C@H](C)[C@@H]2CCC[NH2+]C2)c2ccccc21 ZINC000577274100 335333097 /nfs/dbraw/zinc/33/30/97/335333097.db2.gz BRWQXPMFISCLDO-OHDICMOHSA-N 1 3 286.463 3.849 20 0 CHADHO CC[C@@H](NCc1ccc(C[NH3+])cc1)c1cc(C)ccc1OC ZINC000581726990 336138377 /nfs/dbraw/zinc/13/83/77/336138377.db2.gz WJFLEYKUKGRVFG-GOSISDBHSA-N 1 3 298.430 3.703 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(F)cc2)C1 ZINC000125946474 519676883 /nfs/dbraw/zinc/67/68/83/519676883.db2.gz UFIIKVQODBVLKB-GJZGRUSLSA-N 1 3 278.415 3.597 20 0 CHADHO Cc1ccccc1C[C@H](C)N[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227538869 525198438 /nfs/dbraw/zinc/19/84/38/525198438.db2.gz MYRORJRFFBDDPQ-KYNGSXCRSA-N 1 3 280.415 3.660 20 0 CHADHO CSc1ccc([C@@H](C)[NH2+]CC[C@H]2CCCN2C)cc1 ZINC000337213792 526060653 /nfs/dbraw/zinc/06/06/53/526060653.db2.gz DFFMKBJVWNKXDF-UKRRQHHQSA-N 1 3 278.465 3.543 20 0 CHADHO c1cc(N2CCC([NH2+]CCC3CCCCC3)CC2)ccn1 ZINC000037739966 526431442 /nfs/dbraw/zinc/43/14/42/526431442.db2.gz YWWFIPFGYVFIIK-UHFFFAOYSA-N 1 3 287.451 3.610 20 0 CHADHO [NH3+][C@H]1C[C@H](NCCc2ccc(Cl)cc2)c2ccccc21 ZINC000157263554 527419022 /nfs/dbraw/zinc/41/90/22/527419022.db2.gz ZSRFUSKSVXTSEQ-IRXDYDNUSA-N 1 3 286.806 3.617 20 0 CHADHO CC(C)Cc1ccc([C@@H](C)N[C@@H]2CCC[NH2+]CC2)cc1 ZINC000133640449 1125480818 /nfs/dbraw/zinc/48/08/18/1125480818.db2.gz HYULYVMHDCUAAJ-CRAIPNDOSA-N 1 3 274.452 3.678 20 0 CHADHO CN(C)[C@H]1CCC[C@@H]([NH2+]C2CCCCCCC2)C1 ZINC000715510619 1118308696 /nfs/dbraw/zinc/30/86/96/1118308696.db2.gz QSKXSZGJZLJWIV-CVEARBPZSA-N 1 3 252.446 3.562 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@@H](C)c1csc(C)c1 ZINC000650755626 1119413894 /nfs/dbraw/zinc/41/38/94/1119413894.db2.gz JNAWXCSILSREME-ZDUSSCGKSA-N 1 3 274.433 3.627 20 0 CHADHO C[C@@H](NCCCCCC[NH3+])c1c(F)cccc1Cl ZINC000846222442 1131701573 /nfs/dbraw/zinc/70/15/73/1131701573.db2.gz CQOVPYMZVUWONA-LLVKDONJSA-N 1 3 272.795 3.649 20 0 CHADHO CCCC1CCC([N@@H+]2CCC[C@@]23CCCNC3)CC1 ZINC001246605718 1131714020 /nfs/dbraw/zinc/71/40/20/1131714020.db2.gz CJLOGFOYQOCRSW-OFLPRAFFSA-N 1 3 264.457 3.563 20 0 CHADHO CCCC1CCC([N@H+]2CCC[C@@]23CCCNC3)CC1 ZINC001246605718 1131714023 /nfs/dbraw/zinc/71/40/23/1131714023.db2.gz CJLOGFOYQOCRSW-OFLPRAFFSA-N 1 3 264.457 3.563 20 0 CHADHO CCCCCC[C@H](C)[N@H+]1CCCC12CCNCC2 ZINC001246653310 1131777163 /nfs/dbraw/zinc/77/71/63/1131777163.db2.gz MCZCUNIKHBIZAI-HNNXBMFYSA-N 1 3 252.446 3.563 20 0 CHADHO CN1C(C)(C)CC([NH2+]C(C)(C)CC2CC2)CC1(C)C ZINC001171627140 1132066398 /nfs/dbraw/zinc/06/63/98/1132066398.db2.gz LRWYOTWSTCVBAC-UHFFFAOYSA-N 1 3 266.473 3.806 20 0 CHADHO CCC[N@H+](Cc1cc(F)cc(CN(C)C)c1)[C@H](C)CC ZINC001232143466 1132428461 /nfs/dbraw/zinc/42/84/61/1132428461.db2.gz FFPNKGAHHSFNRW-CQSZACIVSA-N 1 3 280.431 3.898 20 0 CHADHO CCC[N@@H+](Cc1cc(F)cc(CN(C)C)c1)[C@H](C)CC ZINC001232143466 1132428465 /nfs/dbraw/zinc/42/84/65/1132428465.db2.gz FFPNKGAHHSFNRW-CQSZACIVSA-N 1 3 280.431 3.898 20 0 CHADHO C[C@@H](NCCCC[N@@H+]1CCCC[C@H]1C)c1ccco1 ZINC000247167164 1125654665 /nfs/dbraw/zinc/65/46/65/1125654665.db2.gz ULWIRZDMIORSBA-HUUCEWRRSA-N 1 3 264.413 3.585 20 0 CHADHO C[C@@H](NCCCC[N@H+]1CCCC[C@H]1C)c1ccco1 ZINC000247167164 1125654669 /nfs/dbraw/zinc/65/46/69/1125654669.db2.gz ULWIRZDMIORSBA-HUUCEWRRSA-N 1 3 264.413 3.585 20 0 CHADHO CCC1(N2CCC2)CC[NH+](CCCCOC(C)(C)C)CC1 ZINC000886715828 1125712099 /nfs/dbraw/zinc/71/20/99/1125712099.db2.gz FVNYSTIKHPCWGQ-UHFFFAOYSA-N 1 3 296.499 3.532 20 0 CHADHO C[C@H](Cc1cccc(F)c1)[NH2+]CCCN1CCCC[C@@H]1C ZINC000221810397 1125750563 /nfs/dbraw/zinc/75/05/63/1125750563.db2.gz JDTUUQPCXMYRMN-CVEARBPZSA-N 1 3 292.442 3.611 20 0 CHADHO [NH3+][C@H]1CCC[C@@H](NCc2cc(-c3ccccc3)cs2)C1 ZINC000414933433 1129206263 /nfs/dbraw/zinc/20/62/63/1129206263.db2.gz WWNRUBAJVLJXEM-JKSUJKDBSA-N 1 3 286.444 3.775 20 0 CHADHO CCN(Cc1ccc(Cl)cc1)[C@H]1CCC[N@H+](C)CC1 ZINC001254525652 1130262203 /nfs/dbraw/zinc/26/22/03/1130262203.db2.gz KKDZNOVDGYPKAO-INIZCTEOSA-N 1 3 280.843 3.646 20 0 CHADHO CCN(Cc1ccc(Cl)cc1)[C@H]1CCC[N@@H+](C)CC1 ZINC001254525652 1130262206 /nfs/dbraw/zinc/26/22/06/1130262206.db2.gz KKDZNOVDGYPKAO-INIZCTEOSA-N 1 3 280.843 3.646 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@@H]2CC[N@@H+](C)C[C@H]2C)c1C ZINC000482330895 1126751422 /nfs/dbraw/zinc/75/14/22/1126751422.db2.gz JCTTXEGTVKHEGL-FZKQIMNGSA-N 1 3 299.462 3.523 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@@H]2CC[N@H+](C)C[C@H]2C)c1C ZINC000482330895 1126751426 /nfs/dbraw/zinc/75/14/26/1126751426.db2.gz JCTTXEGTVKHEGL-FZKQIMNGSA-N 1 3 299.462 3.523 20 0 CHADHO C[N@H+](CC1CC1)C[C@H]1CCN(CCCC2CCCC2)C1 ZINC000483220810 1126774068 /nfs/dbraw/zinc/77/40/68/1126774068.db2.gz POMKVFMTTZKJDM-GOSISDBHSA-N 1 3 278.484 3.621 20 0 CHADHO C[N@@H+](CC1CC1)C[C@H]1CCN(CCCC2CCCC2)C1 ZINC000483220810 1126774070 /nfs/dbraw/zinc/77/40/70/1126774070.db2.gz POMKVFMTTZKJDM-GOSISDBHSA-N 1 3 278.484 3.621 20 0 CHADHO Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H](N(C)C)C2)c(C)c1 ZINC000484466051 1126816835 /nfs/dbraw/zinc/81/68/35/1126816835.db2.gz JEECOSZLJKNUSG-YESZJQIVSA-N 1 3 274.452 3.827 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)c1cccc(Cl)c1 ZINC000484500314 1126822101 /nfs/dbraw/zinc/82/21/01/1126822101.db2.gz KOSGRLNHCKKOOT-MAZHCROVSA-N 1 3 280.843 3.863 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC(C)(C)c3ccccc32)C1 ZINC000484463587 1126817967 /nfs/dbraw/zinc/81/79/67/1126817967.db2.gz ADRGNEDOSVGTKW-IIDMSEBBSA-N 1 3 286.463 3.871 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)c1ccc2c(c1)CCC2 ZINC000484488289 1126819715 /nfs/dbraw/zinc/81/97/15/1126819715.db2.gz HHWDMDPOAZDZJX-KYNGSXCRSA-N 1 3 286.463 3.699 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)c1cc2c(s1)CCC2 ZINC000484504837 1126822913 /nfs/dbraw/zinc/82/29/13/1126822913.db2.gz QXHBPJZNGNSFAP-CFVMTHIKSA-N 1 3 292.492 3.760 20 0 CHADHO CCC[C@@H]([NH2+]C1CCN(CC(C)C)CC1)c1cccnc1 ZINC000184972606 1126896912 /nfs/dbraw/zinc/89/69/12/1126896912.db2.gz MDTUJTJGZGIJFY-GOSISDBHSA-N 1 3 289.467 3.633 20 0 CHADHO Cc1ccccc1[C@H](C)N1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000485430889 1126912803 /nfs/dbraw/zinc/91/28/03/1126912803.db2.gz AXILODQDHMJTAA-ZWKOTPCHSA-N 1 3 286.463 3.864 20 0 CHADHO Cc1ccccc1[C@H](C)[N@@H+]1CC[C@H](CN2CCCCC2)C1 ZINC000485430889 1126912805 /nfs/dbraw/zinc/91/28/05/1126912805.db2.gz AXILODQDHMJTAA-ZWKOTPCHSA-N 1 3 286.463 3.864 20 0 CHADHO Cc1ccccc1[C@H](C)[N@H+]1CC[C@H](CN2CCCCC2)C1 ZINC000485430889 1126912808 /nfs/dbraw/zinc/91/28/08/1126912808.db2.gz AXILODQDHMJTAA-ZWKOTPCHSA-N 1 3 286.463 3.864 20 0 CHADHO CCCN1CCC([NH2+]Cc2cccc(CSC)c2)CC1 ZINC000188725500 1126925391 /nfs/dbraw/zinc/92/53/91/1126925391.db2.gz LEPSBPXFBAONNW-UHFFFAOYSA-N 1 3 292.492 3.514 20 0 CHADHO Cc1ccc([C@@H](C)NC2CC[NH+](C3CCC3)CC2)cc1 ZINC000269057722 1127033636 /nfs/dbraw/zinc/03/36/36/1127033636.db2.gz XCQVKPUZRDUJQZ-OAHLLOKOSA-N 1 3 272.436 3.663 20 0 CHADHO CC(C)(C)CN(Cc1cccc(Cl)c1)C1CC[NH2+]CC1 ZINC001236456340 1130946963 /nfs/dbraw/zinc/94/69/63/1130946963.db2.gz CIEFAEYKPLKISW-UHFFFAOYSA-N 1 3 294.870 3.940 20 0 CHADHO Cc1sccc1CN1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000351813360 1127210328 /nfs/dbraw/zinc/21/03/28/1127210328.db2.gz QZZFOUCGPNQHND-RDJZCZTQSA-N 1 3 290.476 3.505 20 0 CHADHO Cc1sccc1CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000351813360 1127210330 /nfs/dbraw/zinc/21/03/30/1127210330.db2.gz QZZFOUCGPNQHND-RDJZCZTQSA-N 1 3 290.476 3.505 20 0 CHADHO Cc1ccnc([C@@H](C)NCCCC[N@@H+]2CCCC[C@@H]2C)c1 ZINC000285472524 1127229847 /nfs/dbraw/zinc/22/98/47/1127229847.db2.gz AXWCMCKSJQGELK-DLBZAZTESA-N 1 3 289.467 3.695 20 0 CHADHO Cc1ccnc([C@@H](C)NCCCC[N@H+]2CCCC[C@@H]2C)c1 ZINC000285472524 1127229849 /nfs/dbraw/zinc/22/98/49/1127229849.db2.gz AXWCMCKSJQGELK-DLBZAZTESA-N 1 3 289.467 3.695 20 0 CHADHO Cc1oc2ccccc2c1CN1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000355215373 1127325729 /nfs/dbraw/zinc/32/57/29/1127325729.db2.gz ZDTYUMDFQTWFLG-QAPCUYQASA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1CN1CC[C@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000355215373 1127325730 /nfs/dbraw/zinc/32/57/30/1127325730.db2.gz ZDTYUMDFQTWFLG-QAPCUYQASA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1C[N@@H+]1CC[C@H]2[C@H](CCCN2C)C1 ZINC000355215373 1127325734 /nfs/dbraw/zinc/32/57/34/1127325734.db2.gz ZDTYUMDFQTWFLG-QAPCUYQASA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1C[N@H+]1CC[C@H]2[C@H](CCCN2C)C1 ZINC000355215373 1127325738 /nfs/dbraw/zinc/32/57/38/1127325738.db2.gz ZDTYUMDFQTWFLG-QAPCUYQASA-N 1 3 298.430 3.657 20 0 CHADHO Cc1cc(N2CC[C@@H]([NH+]3CCCCC3)C2)c2ccccc2n1 ZINC000594006234 1127407448 /nfs/dbraw/zinc/40/74/48/1127407448.db2.gz YINWWKUMPYELSU-MRXNPFEDSA-N 1 3 295.430 3.608 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H]2CCCc3sccc32)C1 ZINC000361062355 1127534934 /nfs/dbraw/zinc/53/49/34/1127534934.db2.gz XAQJGFMVIOQQDU-ZBFHGGJFSA-N 1 3 292.492 3.836 20 0 CHADHO c1c2c[nH]ccc-2nc1C[NH+]1CCCCCCCC1 ZINC001232017257 1127575213 /nfs/dbraw/zinc/57/52/13/1127575213.db2.gz OJUOGVHXOJOZOQ-UHFFFAOYSA-N 1 3 257.381 3.719 20 0 CHADHO CCN(CC)CC[C@@H](C)[NH2+]C[C@H](C)C1CCCCC1 ZINC001308987220 1127640685 /nfs/dbraw/zinc/64/06/85/1127640685.db2.gz NEDMVFQBJTYXRZ-JKSUJKDBSA-N 1 3 268.489 3.913 20 0 CHADHO CC[C@H](CC(F)F)CN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000659945178 1127665982 /nfs/dbraw/zinc/66/59/82/1127665982.db2.gz SYPRBKRUEYIMKL-CABCVRRESA-N 1 3 288.426 3.618 20 0 CHADHO C[C@@H](N[C@@H](CC[NH+](C)C)C(C)(C)C)c1ccc(F)cc1 ZINC000604773717 1127715019 /nfs/dbraw/zinc/71/50/19/1127715019.db2.gz ZXWNNJHXHQEWCV-CJNGLKHVSA-N 1 3 280.431 3.843 20 0 CHADHO CCN(C)C[C@H]1CC[N@H+](C[C@@H](C)CCc2ccccc2)C1 ZINC000539405107 1127921492 /nfs/dbraw/zinc/92/14/92/1127921492.db2.gz NAVCOJMDDVHJBN-PKOBYXMFSA-N 1 3 288.479 3.529 20 0 CHADHO CCN(C)C[C@H]1CC[N@@H+](C[C@@H](C)CCc2ccccc2)C1 ZINC000539405107 1127921496 /nfs/dbraw/zinc/92/14/96/1127921496.db2.gz NAVCOJMDDVHJBN-PKOBYXMFSA-N 1 3 288.479 3.529 20 0 CHADHO CC(C)[NH2+]C1CCN(C[C@@H]2CCCC(C)(C)C2)CC1 ZINC000539816432 1127942390 /nfs/dbraw/zinc/94/23/90/1127942390.db2.gz VCCHEWCSWRGWQJ-OAHLLOKOSA-N 1 3 266.473 3.665 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2CC[C@@H](C)C[C@@H]2CC)C1 ZINC000539857713 1127948006 /nfs/dbraw/zinc/94/80/06/1127948006.db2.gz BNBSQLUDRLYHKG-WCXIOVBPSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@H](CCN(C)CCC[NH+]1CCCC1)c1ccccc1 ZINC000467517046 1127972025 /nfs/dbraw/zinc/97/20/25/1127972025.db2.gz RJVFGOHFCJHJBT-QGZVFWFLSA-N 1 3 274.452 3.598 20 0 CHADHO Cc1ccccc1[C@H]([NH2+]CC[C@H]1CCCN1C)C(C)C ZINC000540360141 1127976687 /nfs/dbraw/zinc/97/66/87/1127976687.db2.gz PLTGFBXZLIFFGM-SJLPKXTDSA-N 1 3 274.452 3.766 20 0 CHADHO Cc1ccccc1[C@H](NCC[C@H]1CCC[N@@H+]1C)C(C)C ZINC000540360141 1127976688 /nfs/dbraw/zinc/97/66/88/1127976688.db2.gz PLTGFBXZLIFFGM-SJLPKXTDSA-N 1 3 274.452 3.766 20 0 CHADHO Cc1ccccc1[C@H](NCC[C@H]1CCC[N@H+]1C)C(C)C ZINC000540360141 1127976690 /nfs/dbraw/zinc/97/66/90/1127976690.db2.gz PLTGFBXZLIFFGM-SJLPKXTDSA-N 1 3 274.452 3.766 20 0 CHADHO CC[C@H](CN[C@H]1C[C@H]([NH3+])c2ccccc21)CC(F)(F)F ZINC000402674556 1128023138 /nfs/dbraw/zinc/02/31/38/1128023138.db2.gz PFBOBAVVYCZLNT-BPNCWPANSA-N 1 3 286.341 3.699 20 0 CHADHO CC[C@H](c1ccccc1)[C@@H]1CCC[N@@H+]1C[C@@H]1CCCNC1 ZINC000469873906 1128056777 /nfs/dbraw/zinc/05/67/77/1128056777.db2.gz OJCKOMXSKLRRCO-QRQLOZEOSA-N 1 3 286.463 3.644 20 0 CHADHO CC[C@H](c1ccccc1)[C@@H]1CCC[N@H+]1C[C@@H]1CCCNC1 ZINC000469873906 1128056780 /nfs/dbraw/zinc/05/67/80/1128056780.db2.gz OJCKOMXSKLRRCO-QRQLOZEOSA-N 1 3 286.463 3.644 20 0 CHADHO Cc1ccccc1[C@H](C(C)C)[N@H+](C)C[C@@H]1CCCNC1 ZINC000469972475 1128060547 /nfs/dbraw/zinc/06/05/47/1128060547.db2.gz LKHPRDWKOCQIHE-AEFFLSMTSA-N 1 3 274.452 3.624 20 0 CHADHO Cc1ccccc1[C@H](C(C)C)[N@@H+](C)C[C@@H]1CCCNC1 ZINC000469972475 1128060552 /nfs/dbraw/zinc/06/05/52/1128060552.db2.gz LKHPRDWKOCQIHE-AEFFLSMTSA-N 1 3 274.452 3.624 20 0 CHADHO CC[N@H+](C)C[C@@H]1CCN(CCCc2ccc(Cl)cc2)C1 ZINC000173898184 1128094486 /nfs/dbraw/zinc/09/44/86/1128094486.db2.gz RCJNGBGFLYLJKW-INIZCTEOSA-N 1 3 294.870 3.546 20 0 CHADHO CC[N@@H+](C)C[C@@H]1CCN(CCCc2ccc(Cl)cc2)C1 ZINC000173898184 1128094488 /nfs/dbraw/zinc/09/44/88/1128094488.db2.gz RCJNGBGFLYLJKW-INIZCTEOSA-N 1 3 294.870 3.546 20 0 CHADHO CCN(C)C[C@@H]1CC[N@H+](CCCc2ccc(Cl)cc2)C1 ZINC000173898184 1128094490 /nfs/dbraw/zinc/09/44/90/1128094490.db2.gz RCJNGBGFLYLJKW-INIZCTEOSA-N 1 3 294.870 3.546 20 0 CHADHO CCN(C)C[C@@H]1CC[N@@H+](CCCc2ccc(Cl)cc2)C1 ZINC000173898184 1128094491 /nfs/dbraw/zinc/09/44/91/1128094491.db2.gz RCJNGBGFLYLJKW-INIZCTEOSA-N 1 3 294.870 3.546 20 0 CHADHO CCC[C@H](NCC1CC[NH+](C)CC1)c1ncccc1Cl ZINC000924962712 1128118005 /nfs/dbraw/zinc/11/80/05/1128118005.db2.gz GAQMERFUWYQLOG-HNNXBMFYSA-N 1 3 295.858 3.508 20 0 CHADHO CC[C@@H](NCCC(C)(C)[NH3+])c1ccc(Cl)s1 ZINC000925739663 1128139915 /nfs/dbraw/zinc/13/99/15/1128139915.db2.gz CHBNZDRNVWCODE-SECBINFHSA-N 1 3 260.834 3.570 20 0 CHADHO C[C@H](NCCC(C)(C)[NH3+])c1ccc(SC(F)F)cc1 ZINC000925740299 1128139959 /nfs/dbraw/zinc/13/99/59/1128139959.db2.gz IBTVSVMFGHLNGA-JTQLQIEISA-N 1 3 288.407 3.779 20 0 CHADHO CCC1([NH3+])CCN([C@H](c2ccc(C)o2)C2CCC2)CC1 ZINC000925760050 1128140950 /nfs/dbraw/zinc/14/09/50/1128140950.db2.gz NSHYYQIXULBLLW-INIZCTEOSA-N 1 3 276.424 3.633 20 0 CHADHO Cc1cccc([C@@H](C)[NH2+]CC[C@@H](C)N2CCCCC2)c1 ZINC000542487345 1128179533 /nfs/dbraw/zinc/17/95/33/1128179533.db2.gz UXMHZXPGVHCHLM-IAGOWNOFSA-N 1 3 274.452 3.910 20 0 CHADHO Cc1cc(C)c(CN[C@H](C)c2cccc(C[NH+](C)C)c2)cn1 ZINC000926552915 1128179893 /nfs/dbraw/zinc/17/98/93/1128179893.db2.gz ZSVSWXLKUWKJLV-MRXNPFEDSA-N 1 3 297.446 3.611 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1cc2ccccc2[nH]1 ZINC000926753300 1128192076 /nfs/dbraw/zinc/19/20/76/1128192076.db2.gz MYQPSRVJJCXGMF-HUUCEWRRSA-N 1 3 285.435 3.550 20 0 CHADHO CC(C)CCN1CCC([NH2+]CC(C)(C)C(C)(F)F)CC1 ZINC000926798536 1128195729 /nfs/dbraw/zinc/19/57/29/1128195729.db2.gz BIBDAVORYZSKGQ-UHFFFAOYSA-N 1 3 290.442 3.768 20 0 CHADHO Cc1csc([C@H](C)NC2CCC(C)([NH+]3CCC3)CC2)n1 ZINC000927036161 1128210329 /nfs/dbraw/zinc/21/03/29/1128210329.db2.gz FHTCDNKHZZRQIO-HLIUYOAVSA-N 1 3 293.480 3.509 20 0 CHADHO C[NH2+]CC1CCN(Cc2ccc(Cl)c(C(C)C)c2)CC1 ZINC001235678863 1128347322 /nfs/dbraw/zinc/34/73/22/1128347322.db2.gz GSQNNLQLATXUDK-UHFFFAOYSA-N 1 3 294.870 3.895 20 0 CHADHO CCCC[C@@H](CC)[NH+]1CCC(N2CCCC2)CC1 ZINC001257419581 1128351967 /nfs/dbraw/zinc/35/19/67/1128351967.db2.gz YBNZFTHEHGNGTA-OAHLLOKOSA-N 1 3 252.446 3.515 20 0 CHADHO CCCC[C@@H](CC)N1CCC([NH+]2CCCC2)CC1 ZINC001257419581 1128351970 /nfs/dbraw/zinc/35/19/70/1128351970.db2.gz YBNZFTHEHGNGTA-OAHLLOKOSA-N 1 3 252.446 3.515 20 0 CHADHO CC(C)SCCNC1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1 ZINC000562063184 1128375424 /nfs/dbraw/zinc/37/54/24/1128375424.db2.gz AUTOCPCLFJMVJM-WBVHZDCISA-N 1 3 298.540 3.761 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2cccc3ccccc32)C1 ZINC000037644130 1128433571 /nfs/dbraw/zinc/43/35/71/1128433571.db2.gz SFIMVMBBGGQFLF-HOTGVXAUSA-N 1 3 282.431 3.832 20 0 CHADHO Cc1ccc([C@H](NC[C@H](C)C[NH+]2CCCC2)C2CC2)cc1 ZINC000062078635 1128437193 /nfs/dbraw/zinc/43/71/93/1128437193.db2.gz FSRMWCNVUNUCHS-LPHOPBHVSA-N 1 3 286.463 3.768 20 0 CHADHO Cc1ccc([C@@H](NC[C@@H](C)C[NH+]2CCCC2)C2CC2)cc1 ZINC000062078633 1128437344 /nfs/dbraw/zinc/43/73/44/1128437344.db2.gz FSRMWCNVUNUCHS-VQIMIIECSA-N 1 3 286.463 3.768 20 0 CHADHO Cc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)CC2 ZINC000125909588 1128456662 /nfs/dbraw/zinc/45/66/62/1128456662.db2.gz GAOZNJKUVURGDN-APWZRJJASA-N 1 3 286.463 3.692 20 0 CHADHO CC(C)C[C@H](CN1CC[C@H]([NH3+])C[C@@H]1C)c1ccccc1 ZINC000566411163 1128544051 /nfs/dbraw/zinc/54/40/51/1128544051.db2.gz AEYPVCAAVFOLMI-JQHSSLGASA-N 1 3 274.452 3.628 20 0 CHADHO CC(C)C[C@H](C[N@@H+]1CC[C@H](N)C[C@@H]1C)c1ccccc1 ZINC000566411163 1128544052 /nfs/dbraw/zinc/54/40/52/1128544052.db2.gz AEYPVCAAVFOLMI-JQHSSLGASA-N 1 3 274.452 3.628 20 0 CHADHO CC(C)C[C@H](C[N@H+]1CC[C@H](N)C[C@@H]1C)c1ccccc1 ZINC000566411163 1128544056 /nfs/dbraw/zinc/54/40/56/1128544056.db2.gz AEYPVCAAVFOLMI-JQHSSLGASA-N 1 3 274.452 3.628 20 0 CHADHO CC(C)C[C@H](CN1CC[C@@H]([NH3+])C[C@@H]1C)c1ccccc1 ZINC000566411162 1128544149 /nfs/dbraw/zinc/54/41/49/1128544149.db2.gz AEYPVCAAVFOLMI-CGTJXYLNSA-N 1 3 274.452 3.628 20 0 CHADHO CC(C)C[C@H](C[N@@H+]1CC[C@@H](N)C[C@@H]1C)c1ccccc1 ZINC000566411162 1128544152 /nfs/dbraw/zinc/54/41/52/1128544152.db2.gz AEYPVCAAVFOLMI-CGTJXYLNSA-N 1 3 274.452 3.628 20 0 CHADHO CC(C)C[C@H](C[N@H+]1CC[C@@H](N)C[C@@H]1C)c1ccccc1 ZINC000566411162 1128544156 /nfs/dbraw/zinc/54/41/56/1128544156.db2.gz AEYPVCAAVFOLMI-CGTJXYLNSA-N 1 3 274.452 3.628 20 0 CHADHO CC[C@H](Cc1ccc(C)cc1)[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000569039323 1128597140 /nfs/dbraw/zinc/59/71/40/1128597140.db2.gz TXBAJEUKHBSXDX-RTBURBONSA-N 1 3 288.479 3.636 20 0 CHADHO CC(C)c1cccc(CN[C@@H]2CC[N@H+](C)[C@H]3CCC[C@H]32)c1 ZINC000556889246 1128636445 /nfs/dbraw/zinc/63/64/45/1128636445.db2.gz AZCLFFAKYGIDNB-OTWHNJEPSA-N 1 3 286.463 3.772 20 0 CHADHO CC(C)c1cccc(CN[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@H]32)c1 ZINC000556889246 1128636448 /nfs/dbraw/zinc/63/64/48/1128636448.db2.gz AZCLFFAKYGIDNB-OTWHNJEPSA-N 1 3 286.463 3.772 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCc1ccc(-c2ccccc2)s1 ZINC000570842161 1128633876 /nfs/dbraw/zinc/63/38/76/1128633876.db2.gz CAZCKUKUDTWXLV-OLZOCXBDSA-N 1 3 274.433 3.631 20 0 CHADHO Cc1ccc(CC[C@@H](C)[NH2+]C[C@@H]2CCN(C(C)C)C2)cc1 ZINC000578370007 1128716435 /nfs/dbraw/zinc/71/64/35/1128716435.db2.gz MCWZKBPRVXWOSU-MJGOQNOKSA-N 1 3 288.479 3.636 20 0 CHADHO CC(C)[NH+]1CCC(N[C@@H](c2ccccc2)C2CC2)CC1 ZINC000035053249 1117764269 /nfs/dbraw/zinc/76/42/69/1117764269.db2.gz XLODXXXUXUAMAI-SFHVURJKSA-N 1 3 272.436 3.600 20 0 CHADHO Cc1cccc(CN(C)CC2CC[NH+](C(C)C)CC2)c1F ZINC001137676162 1117789780 /nfs/dbraw/zinc/78/97/80/1117789780.db2.gz LPKMPOOITMPKGL-UHFFFAOYSA-N 1 3 292.442 3.686 20 0 CHADHO Cc1ccc([C@@H](N[C@H]2CC[NH2+]C3(CCC3)C2)C2CC2)cc1 ZINC000643549062 1117799988 /nfs/dbraw/zinc/79/99/88/1117799988.db2.gz ZRPHRSYYLZNMEF-ZWKOTPCHSA-N 1 3 284.447 3.710 20 0 CHADHO CC[C@H](N[C@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(C)cc1 ZINC000623337925 1117833772 /nfs/dbraw/zinc/83/37/72/1117833772.db2.gz BMBOSUDKQHVCCZ-IRXDYDNUSA-N 1 3 274.452 3.909 20 0 CHADHO CC[C@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(C)cc1 ZINC000623337925 1117833777 /nfs/dbraw/zinc/83/37/77/1117833777.db2.gz BMBOSUDKQHVCCZ-IRXDYDNUSA-N 1 3 274.452 3.909 20 0 CHADHO CCC[NH+]1CCC(N[C@@H](c2ccccc2)C2CCC2)CC1 ZINC000119224328 1117877578 /nfs/dbraw/zinc/87/75/78/1117877578.db2.gz FWXPGLSKWPVOCV-IBGZPJMESA-N 1 3 286.463 3.992 20 0 CHADHO CN1CCCC[C@@H](C[NH2+]Cc2cc3ccccc3s2)C1 ZINC000623656325 1117883935 /nfs/dbraw/zinc/88/39/35/1117883935.db2.gz SAJTWOIQKHBOEB-AWEZNQCLSA-N 1 3 288.460 3.723 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@@H]2CCSc3ccccc32)C1 ZINC000624119848 1117983434 /nfs/dbraw/zinc/98/34/34/1117983434.db2.gz KWEXDPSTKDUESQ-GDBMZVCRSA-N 1 3 290.476 3.545 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCCN(C)C1)[C@@H](C)c1ccccc1 ZINC000624121180 1117984505 /nfs/dbraw/zinc/98/45/05/1117984505.db2.gz PPARYTJDHMEOBO-IXDOHACOSA-N 1 3 274.452 3.500 20 0 CHADHO CN1CCCC[C@@H](C[NH2+][C@H](c2ccc(F)cc2)C2CC2)C1 ZINC000624121734 1117985198 /nfs/dbraw/zinc/98/51/98/1117985198.db2.gz CCCZGZBHLWIZEQ-KSSFIOAISA-N 1 3 290.426 3.598 20 0 CHADHO C[C@@H](CCC(C)(C)C)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000624123962 1117985207 /nfs/dbraw/zinc/98/52/07/1117985207.db2.gz UTJJDTVWQWYLBJ-LSDHHAIUSA-N 1 3 254.462 3.523 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccc(F)c(Cl)c1 ZINC000624120713 1117985724 /nfs/dbraw/zinc/98/57/24/1117985724.db2.gz FPMDBIBTOOTLDO-QWHCGFSZSA-N 1 3 298.833 3.862 20 0 CHADHO CCC[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccsc1 ZINC000624123683 1117986861 /nfs/dbraw/zinc/98/68/61/1117986861.db2.gz QHQKMALCDAODSC-ZBFHGGJFSA-N 1 3 280.481 3.911 20 0 CHADHO C[C@H]1C[C@H](N[C@H]2CCCc3ccc(Cl)cc32)CC[N@@H+]1C ZINC000624220154 1118015654 /nfs/dbraw/zinc/01/56/54/1118015654.db2.gz LIZKAWCPXGJDBL-MJEQTWJJSA-N 1 3 292.854 3.790 20 0 CHADHO C[C@H]1C[C@H](N[C@H]2CCCc3ccc(Cl)cc32)CC[N@H+]1C ZINC000624220154 1118015659 /nfs/dbraw/zinc/01/56/59/1118015659.db2.gz LIZKAWCPXGJDBL-MJEQTWJJSA-N 1 3 292.854 3.790 20 0 CHADHO C[C@H]1C[C@@H](N[C@H]2CCCc3ccc(Cl)cc32)CC[N@@H+]1C ZINC000624220155 1118016214 /nfs/dbraw/zinc/01/62/14/1118016214.db2.gz LIZKAWCPXGJDBL-NUTKFTJISA-N 1 3 292.854 3.790 20 0 CHADHO C[C@H]1C[C@@H](N[C@H]2CCCc3ccc(Cl)cc32)CC[N@H+]1C ZINC000624220155 1118016218 /nfs/dbraw/zinc/01/62/18/1118016218.db2.gz LIZKAWCPXGJDBL-NUTKFTJISA-N 1 3 292.854 3.790 20 0 CHADHO C[C@@H]1CCC[C@@H]([NH2+]C2CCN(C3CCCC3)CC2)CC1 ZINC000443215391 1118025619 /nfs/dbraw/zinc/02/56/19/1118025619.db2.gz XWOGIHNOROJHFD-HZPDHXFCSA-N 1 3 278.484 3.952 20 0 CHADHO CC(C)(C)N1CCC([NH2+][C@@H]2CCc3ccc(F)cc32)CC1 ZINC000089513105 1118056321 /nfs/dbraw/zinc/05/63/21/1118056321.db2.gz PCMLWDUXZHEIQL-QGZVFWFLSA-N 1 3 290.426 3.666 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)c1ccccc1C(F)(F)F)CN(C)C ZINC000380422880 1118069409 /nfs/dbraw/zinc/06/94/09/1118069409.db2.gz IFPIMVFWRPDVII-RYUDHWBXSA-N 1 3 288.357 3.554 20 0 CHADHO C[C@H]1CC[N@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)CCN1 ZINC001210473201 1118293601 /nfs/dbraw/zinc/29/36/01/1118293601.db2.gz BSOVWHGABZYYIF-AWEZNQCLSA-N 1 3 299.462 3.649 20 0 CHADHO C[C@H]1CC[N@@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)CCN1 ZINC001210473201 1118293603 /nfs/dbraw/zinc/29/36/03/1118293603.db2.gz BSOVWHGABZYYIF-AWEZNQCLSA-N 1 3 299.462 3.649 20 0 CHADHO CC[C@H](C)C[C@H](CC)[NH2+][C@H]1CCC[C@@H](N(C)C)C1 ZINC000715510950 1118308084 /nfs/dbraw/zinc/30/80/84/1118308084.db2.gz RLNJXOBEGRUFAW-YHUYYLMFSA-N 1 3 254.462 3.664 20 0 CHADHO CC(C)c1ccc(CN(C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000123577660 1118339510 /nfs/dbraw/zinc/33/95/10/1118339510.db2.gz DBFCCOLSOIVMCP-MAUKXSAKSA-N 1 3 274.452 3.725 20 0 CHADHO CC(C)c1ccc(CN(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000123577660 1118339512 /nfs/dbraw/zinc/33/95/12/1118339512.db2.gz DBFCCOLSOIVMCP-MAUKXSAKSA-N 1 3 274.452 3.725 20 0 CHADHO CC[C@H](CSC)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000580227159 1118404772 /nfs/dbraw/zinc/40/47/72/1118404772.db2.gz SLTFDGXZBMIRSA-CQSZACIVSA-N 1 3 284.513 3.515 20 0 CHADHO CC[N@H+](CCC1CCN(CC2(F)CC2)CC1)CC(C)C ZINC000580364331 1118437517 /nfs/dbraw/zinc/43/75/17/1118437517.db2.gz LIYJNHRQYHTDJQ-UHFFFAOYSA-N 1 3 284.463 3.569 20 0 CHADHO CC[N@@H+](CCC1CCN(CC2(F)CC2)CC1)CC(C)C ZINC000580364331 1118437520 /nfs/dbraw/zinc/43/75/20/1118437520.db2.gz LIYJNHRQYHTDJQ-UHFFFAOYSA-N 1 3 284.463 3.569 20 0 CHADHO C[NH2+]C1CCN(CC2CCC(C(C)(C)C)CC2)CC1 ZINC000261580860 1118439309 /nfs/dbraw/zinc/43/93/09/1118439309.db2.gz FRHOAWKVBNWJCT-UHFFFAOYSA-N 1 3 266.473 3.523 20 0 CHADHO c1sc2ccccc2c1CNC1CC[NH+](C2CC2)CC1 ZINC000050499411 1118504282 /nfs/dbraw/zinc/50/42/82/1118504282.db2.gz FWTMSOHDVVKUDL-UHFFFAOYSA-N 1 3 286.444 3.618 20 0 CHADHO c1ccc2c(c1)CC[C@@H]2C[NH2+]C1CCN(C2CCCC2)CC1 ZINC000161000056 1118673091 /nfs/dbraw/zinc/67/30/91/1118673091.db2.gz GGHZVCZRYNEAHC-QGZVFWFLSA-N 1 3 298.474 3.713 20 0 CHADHO C[C@H](c1ccc(Cl)c(Cl)c1)N1CC[C@@H](CC[NH3+])C1 ZINC000723691311 1118706852 /nfs/dbraw/zinc/70/68/52/1118706852.db2.gz MAGBJFWOEOBRSY-GHMZBOCLSA-N 1 3 287.234 3.725 20 0 CHADHO Cc1cccc(CC[NH2+]C2CCN(C3CCCC3)CC2)c1 ZINC000130780909 1118741201 /nfs/dbraw/zinc/74/12/01/1118741201.db2.gz KLGXRUMHVWSEPY-UHFFFAOYSA-N 1 3 286.463 3.534 20 0 CHADHO CCSc1cccc(C[NH2+]C[C@H]2CCCN(CC)C2)c1 ZINC000349564329 1118754765 /nfs/dbraw/zinc/75/47/65/1118754765.db2.gz KGKIDOXTFBSPLN-MRXNPFEDSA-N 1 3 292.492 3.620 20 0 CHADHO CCCCN1CCC([NH2+][C@@H]2CCc3c2cccc3F)CC1 ZINC000211868221 1118763545 /nfs/dbraw/zinc/76/35/45/1118763545.db2.gz OFURFURJEZUBTE-GOSISDBHSA-N 1 3 290.426 3.667 20 0 CHADHO CC[C@@H]1CCC[C@H]1C[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000449433548 1118906035 /nfs/dbraw/zinc/90/60/35/1118906035.db2.gz MUCMYZKPIIBQKH-CABCVRRESA-N 1 3 266.473 3.665 20 0 CHADHO Cc1ccc2[nH]c(C[NH2+][C@H]3CCC[C@@H](N(C)C)C3)cc2c1C ZINC000472080382 1118960609 /nfs/dbraw/zinc/96/06/09/1118960609.db2.gz OENPAYCVJOSKFE-DOTOQJQBSA-N 1 3 299.462 3.747 20 0 CHADHO CCC[NH+]1CCC(N(C)Cc2cccc3cccnc32)CC1 ZINC000109786622 1119050097 /nfs/dbraw/zinc/05/00/97/1119050097.db2.gz AXVZHPBUSHXEAS-UHFFFAOYSA-N 1 3 297.446 3.541 20 0 CHADHO Cc1ccc([C@H](C)C[NH2+]C[C@@H]2CCCN(C(C)C)C2)cc1 ZINC000628213895 1128829272 /nfs/dbraw/zinc/82/92/72/1128829272.db2.gz CKKCBVHHZZEKGB-MSOLQXFVSA-N 1 3 288.479 3.809 20 0 CHADHO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCc1ccccc1 ZINC000148483037 1119265386 /nfs/dbraw/zinc/26/53/86/1119265386.db2.gz YZGHAOLYPGNJJY-YLJYHZDGSA-N 1 3 294.442 3.687 20 0 CHADHO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1ccccc1 ZINC000148483037 1119265388 /nfs/dbraw/zinc/26/53/88/1119265388.db2.gz YZGHAOLYPGNJJY-YLJYHZDGSA-N 1 3 294.442 3.687 20 0 CHADHO C[N@@H+](CCCNC1CC2(CCC2)C1)C1CCCCC1 ZINC000448069356 1119373571 /nfs/dbraw/zinc/37/35/71/1119373571.db2.gz MRGIZAJMJDSPOQ-UHFFFAOYSA-N 1 3 264.457 3.563 20 0 CHADHO C[N@H+](CCCNC1CC2(CCC2)C1)C1CCCCC1 ZINC000448069356 1119373566 /nfs/dbraw/zinc/37/35/66/1119373566.db2.gz MRGIZAJMJDSPOQ-UHFFFAOYSA-N 1 3 264.457 3.563 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H](C)c2ccc(C)c(C)c2)C1 ZINC000151111414 1119398948 /nfs/dbraw/zinc/39/89/48/1119398948.db2.gz HZRUASLERNNPBB-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H](C)c2ccc(C)c(C)c2)C1 ZINC000151111414 1119398950 /nfs/dbraw/zinc/39/89/50/1119398950.db2.gz HZRUASLERNNPBB-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO C[C@@H](N(C)CCC[N@H+](C)[C@@H](C)C1(C)CC1)C1(C)CC1 ZINC000343741057 1119499924 /nfs/dbraw/zinc/49/99/24/1119499924.db2.gz MXMSZVDWKDCCTP-GASCZTMLSA-N 1 3 266.473 3.617 20 0 CHADHO C[C@@H](N(C)CCC[N@@H+](C)[C@@H](C)C1(C)CC1)C1(C)CC1 ZINC000343741057 1119499927 /nfs/dbraw/zinc/49/99/27/1119499927.db2.gz MXMSZVDWKDCCTP-GASCZTMLSA-N 1 3 266.473 3.617 20 0 CHADHO C[C@@H]([N@@H+](C)CCCN(C)[C@@H](C)C1(C)CC1)C1(C)CC1 ZINC000343741057 1119499930 /nfs/dbraw/zinc/49/99/30/1119499930.db2.gz MXMSZVDWKDCCTP-GASCZTMLSA-N 1 3 266.473 3.617 20 0 CHADHO C[C@@H]([N@H+](C)CCCN(C)[C@@H](C)C1(C)CC1)C1(C)CC1 ZINC000343741057 1119499933 /nfs/dbraw/zinc/49/99/33/1119499933.db2.gz MXMSZVDWKDCCTP-GASCZTMLSA-N 1 3 266.473 3.617 20 0 CHADHO CC(C)[N@H+](C)CCCNC1CC(c2cc(F)cc(F)c2)C1 ZINC000565143760 1119525626 /nfs/dbraw/zinc/52/56/26/1119525626.db2.gz PUMNQPNKKCVUTP-UHFFFAOYSA-N 1 3 296.405 3.531 20 0 CHADHO CC(C)[N@@H+](C)CCCNC1CC(c2cc(F)cc(F)c2)C1 ZINC000565143760 1119525628 /nfs/dbraw/zinc/52/56/28/1119525628.db2.gz PUMNQPNKKCVUTP-UHFFFAOYSA-N 1 3 296.405 3.531 20 0 CHADHO CC[NH+](CC)C[C@@H]1CCN(C[C@@H](C)Cc2ccccc2)C1 ZINC000182042754 1119645083 /nfs/dbraw/zinc/64/50/83/1119645083.db2.gz FAOUDDGZQBFAMT-HKUYNNGSSA-N 1 3 288.479 3.529 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](C[C@@H](C)Cc2ccccc2)C1 ZINC000182042754 1119645085 /nfs/dbraw/zinc/64/50/85/1119645085.db2.gz FAOUDDGZQBFAMT-HKUYNNGSSA-N 1 3 288.479 3.529 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](C[C@@H](C)Cc2ccccc2)C1 ZINC000182042754 1119645086 /nfs/dbraw/zinc/64/50/86/1119645086.db2.gz FAOUDDGZQBFAMT-HKUYNNGSSA-N 1 3 288.479 3.529 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1cc([O-])cc(F)c1 ZINC000924526479 1119693967 /nfs/dbraw/zinc/69/39/67/1119693967.db2.gz GAEWHAUVKZQWHB-KBPBESRZSA-N 1 3 296.430 3.692 20 0 CHADHO C[C@@H](C[N@H+](C1CC1)C1CCNCC1)c1cccc(Cl)c1 ZINC000647482473 1119793638 /nfs/dbraw/zinc/79/36/38/1119793638.db2.gz HTSFXLPSAFZMKH-ZDUSSCGKSA-N 1 3 292.854 3.660 20 0 CHADHO C[C@@H](C[N@@H+](C1CC1)C1CCNCC1)c1cccc(Cl)c1 ZINC000647482473 1119793640 /nfs/dbraw/zinc/79/36/40/1119793640.db2.gz HTSFXLPSAFZMKH-ZDUSSCGKSA-N 1 3 292.854 3.660 20 0 CHADHO C[C@@H](CN(C1CC1)C1CC[NH2+]CC1)c1cccc(Cl)c1 ZINC000647482473 1119793642 /nfs/dbraw/zinc/79/36/42/1119793642.db2.gz HTSFXLPSAFZMKH-ZDUSSCGKSA-N 1 3 292.854 3.660 20 0 CHADHO CC[C@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)[C@@H]1CC1(C)C ZINC000414111333 1119901853 /nfs/dbraw/zinc/90/18/53/1119901853.db2.gz IYKZWWOTWWFCER-PMPSAXMXSA-N 1 3 266.473 3.521 20 0 CHADHO C[C@@H](NCC[C@@H]1CCC[N@H+](C)C1)c1ccc(F)cc1Cl ZINC000414188345 1119930904 /nfs/dbraw/zinc/93/09/04/1119930904.db2.gz QOTKGYLAJVPRKP-OLZOCXBDSA-N 1 3 298.833 3.862 20 0 CHADHO C[C@@H](NCC[C@@H]1CCC[N@@H+](C)C1)c1ccc(F)cc1Cl ZINC000414188345 1119930907 /nfs/dbraw/zinc/93/09/07/1119930907.db2.gz QOTKGYLAJVPRKP-OLZOCXBDSA-N 1 3 298.833 3.862 20 0 CHADHO CC[NH+](CC)Cc1ccc(CNCc2ccc(O)cc2)cc1 ZINC000107800593 1119998209 /nfs/dbraw/zinc/99/82/09/1119998209.db2.gz MNKWKDVQJAHRNR-UHFFFAOYSA-N 1 3 298.430 3.524 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@H]2CCc3c2cccc3Cl)C1 ZINC000624121149 1120076086 /nfs/dbraw/zinc/07/60/86/1120076086.db2.gz PFJWVGCUEKBJEA-DYVFJYSZSA-N 1 3 292.854 3.649 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@@H]2CCCc3ccc(F)cc32)C1 ZINC000624121834 1120101723 /nfs/dbraw/zinc/10/17/23/1120101723.db2.gz DOZLAFFFIPFFIS-RDTXWAMCSA-N 1 3 290.426 3.525 20 0 CHADHO CC(C)(C)N1CCC([NH2+]C[C@H]2CCc3ccccc32)CC1 ZINC000765905154 1120171888 /nfs/dbraw/zinc/17/18/88/1120171888.db2.gz NLFCNRREHZRSTO-MRXNPFEDSA-N 1 3 286.463 3.569 20 0 CHADHO CCCC[N@H+](C)CCCN[C@@H]1Cc2cccc(Cl)c2C1 ZINC001168684592 1120244215 /nfs/dbraw/zinc/24/42/15/1120244215.db2.gz KPMANAHJOBSIHG-OAHLLOKOSA-N 1 3 294.870 3.519 20 0 CHADHO CCCC[N@@H+](C)CCCN[C@@H]1Cc2cccc(Cl)c2C1 ZINC001168684592 1120244218 /nfs/dbraw/zinc/24/42/18/1120244218.db2.gz KPMANAHJOBSIHG-OAHLLOKOSA-N 1 3 294.870 3.519 20 0 CHADHO CCCCN(C)CCC[NH2+][C@@H]1Cc2cccc(Cl)c2C1 ZINC001168684592 1120244220 /nfs/dbraw/zinc/24/42/20/1120244220.db2.gz KPMANAHJOBSIHG-OAHLLOKOSA-N 1 3 294.870 3.519 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@H](C)Cc2ccc(Cl)cc2)C1 ZINC000300529229 1120375545 /nfs/dbraw/zinc/37/55/45/1120375545.db2.gz MLYBTVPKRWLRNP-GDBMZVCRSA-N 1 3 294.870 3.591 20 0 CHADHO C(CC1CCC1)CN1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000660114226 1120381673 /nfs/dbraw/zinc/38/16/73/1120381673.db2.gz GIXUJUSZQUVWQX-WMZOPIPTSA-N 1 3 276.468 3.515 20 0 CHADHO C(CC1CCC1)CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000660114226 1120381680 /nfs/dbraw/zinc/38/16/80/1120381680.db2.gz GIXUJUSZQUVWQX-WMZOPIPTSA-N 1 3 276.468 3.515 20 0 CHADHO CC(C)[C@@H]1C[C@H](N[C@H]2CCC[NH2+]CC2)c2ccccc21 ZINC000629532337 1128914248 /nfs/dbraw/zinc/91/42/48/1128914248.db2.gz VYROMWUHMBVLGO-WBAXXEDZSA-N 1 3 272.436 3.603 20 0 CHADHO C[C@H](C[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1)CN(C)C ZINC000425939159 1120475065 /nfs/dbraw/zinc/47/50/65/1120475065.db2.gz ZDEKKAIQEXHKBA-IWMBGFJWSA-N 1 3 294.405 3.531 20 0 CHADHO C[N@H+](CCCN1CCCC1)[C@@H]1CCc2ccc(Cl)cc21 ZINC000499951168 1120560512 /nfs/dbraw/zinc/56/05/12/1120560512.db2.gz ROUZTUKXEFVGAH-QGZVFWFLSA-N 1 3 292.854 3.745 20 0 CHADHO C[N@@H+](CCCN1CCCC1)[C@@H]1CCc2ccc(Cl)cc21 ZINC000499951168 1120560513 /nfs/dbraw/zinc/56/05/13/1120560513.db2.gz ROUZTUKXEFVGAH-QGZVFWFLSA-N 1 3 292.854 3.745 20 0 CHADHO CCCCCN1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000253620312 1128935136 /nfs/dbraw/zinc/93/51/36/1128935136.db2.gz UEZDVZOPGUTSGG-IAGOWNOFSA-N 1 3 266.473 3.763 20 0 CHADHO CCCCCN1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000253620312 1128935139 /nfs/dbraw/zinc/93/51/39/1128935139.db2.gz UEZDVZOPGUTSGG-IAGOWNOFSA-N 1 3 266.473 3.763 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H]2CCCCC[C@H]2C)C1 ZINC000651706116 1120717207 /nfs/dbraw/zinc/71/72/07/1120717207.db2.gz TUBYIHJEDTZSGA-IKGGRYGDSA-N 1 3 266.473 3.665 20 0 CHADHO CC[C@@]1(C)CCC[C@@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000651731548 1120728772 /nfs/dbraw/zinc/72/87/72/1120728772.db2.gz RROIHQUERDSFFU-ROUUACIJSA-N 1 3 278.484 3.952 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC000257709776 1120742909 /nfs/dbraw/zinc/74/29/09/1120742909.db2.gz NMFDGRWHHCXPOB-MAUKXSAKSA-N 1 3 272.436 3.556 20 0 CHADHO CCCC1CCC([N@@H+]2CCC[C@]3(CCCNC3)C2)CC1 ZINC000228083065 1120767836 /nfs/dbraw/zinc/76/78/36/1120767836.db2.gz AERRXSJAEDBZMR-ABHNRTSZSA-N 1 3 278.484 3.811 20 0 CHADHO CCCC1CCC([N@H+]2CCC[C@]3(CCCNC3)C2)CC1 ZINC000228083065 1120767840 /nfs/dbraw/zinc/76/78/40/1120767840.db2.gz AERRXSJAEDBZMR-ABHNRTSZSA-N 1 3 278.484 3.811 20 0 CHADHO CC1=C[C@@H](C)C[N@@H+]([C@H](C)CCN2CC(C)=C[C@H](C)C2)C1 ZINC000430264918 1120855362 /nfs/dbraw/zinc/85/53/62/1120855362.db2.gz CDQPZDHTPDYCRJ-YXJHDRRASA-N 1 3 276.468 3.561 20 0 CHADHO CC1=C[C@@H](C)C[N@H+]([C@H](C)CCN2CC(C)=C[C@H](C)C2)C1 ZINC000430264918 1120855364 /nfs/dbraw/zinc/85/53/64/1120855364.db2.gz CDQPZDHTPDYCRJ-YXJHDRRASA-N 1 3 276.468 3.561 20 0 CHADHO CC1=C[C@@H](C)CN([C@H](C)CC[N@H+]2CC(C)=C[C@H](C)C2)C1 ZINC000430264918 1120855367 /nfs/dbraw/zinc/85/53/67/1120855367.db2.gz CDQPZDHTPDYCRJ-YXJHDRRASA-N 1 3 276.468 3.561 20 0 CHADHO CC1=C[C@@H](C)CN([C@H](C)CC[N@@H+]2CC(C)=C[C@H](C)C2)C1 ZINC000430264918 1120855369 /nfs/dbraw/zinc/85/53/69/1120855369.db2.gz CDQPZDHTPDYCRJ-YXJHDRRASA-N 1 3 276.468 3.561 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCCN(CC2CC2)C1)C1CCCCC1 ZINC000663466953 1120982445 /nfs/dbraw/zinc/98/24/45/1120982445.db2.gz BWKCXDSWMIXZNA-WBVHZDCISA-N 1 3 278.484 3.667 20 0 CHADHO CCCCN1CCC([NH2+]Cc2csc(C)c2C)CC1 ZINC001648933552 1121005203 /nfs/dbraw/zinc/00/52/03/1121005203.db2.gz ZPMRALOYHQRSMK-UHFFFAOYSA-N 1 3 280.481 3.719 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N1CCC[C@@H]1c1nccs1 ZINC001167836460 1121038667 /nfs/dbraw/zinc/03/86/67/1121038667.db2.gz DTEDEJYDGJMQRG-HUUCEWRRSA-N 1 3 295.496 3.791 20 0 CHADHO C[NH+](C)CC[C@@H](NCc1ccc2occc2c1)C(C)(C)C ZINC000512051675 1121041207 /nfs/dbraw/zinc/04/12/07/1121041207.db2.gz JBNHASUPLHQCSZ-QGZVFWFLSA-N 1 3 288.435 3.889 20 0 CHADHO C/C(=C/c1ccccc1)C[NH2+]CCCN1CCCCC1 ZINC000141072824 1121136955 /nfs/dbraw/zinc/13/69/55/1121136955.db2.gz ZGJZBCWEFYQPRT-ICFOKQHNSA-N 1 3 272.436 3.556 20 0 CHADHO CC[C@@H](NC[C@H](C)C[NH+]1CCCC1)c1ccc(C)cc1 ZINC000062077495 1121185997 /nfs/dbraw/zinc/18/59/97/1121185997.db2.gz XNEAWNACSAJWIV-FUHWJXTLSA-N 1 3 274.452 3.768 20 0 CHADHO C[C@@H](c1ccccc1Cl)N1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000063197607 1121202084 /nfs/dbraw/zinc/20/20/84/1121202084.db2.gz GLJYLCZJPXCCGI-SUMWQHHRSA-N 1 3 292.854 3.865 20 0 CHADHO C[C@H]([NH2+]CCCN1CCCCC1)c1cc2ccccc2o1 ZINC000021801769 1121215972 /nfs/dbraw/zinc/21/59/72/1121215972.db2.gz AIDLDLWUXAKQOU-HNNXBMFYSA-N 1 3 286.419 3.959 20 0 CHADHO C[C@H](C[NH2+]CCCN1CCCC[C@H]1C)c1ccccc1 ZINC000021812528 1121217268 /nfs/dbraw/zinc/21/72/68/1121217268.db2.gz UOYWQACWGYAADK-IAGOWNOFSA-N 1 3 274.452 3.644 20 0 CHADHO C[C@@H](CCc1ccccc1)C[N@@H+]1CCC[C@@H](N(C)C)CC1 ZINC000432801635 1121365839 /nfs/dbraw/zinc/36/58/39/1121365839.db2.gz XHHUTUPTCRNYSN-PKOBYXMFSA-N 1 3 288.479 3.671 20 0 CHADHO C[C@@H](CCc1ccccc1)C[N@H+]1CCC[C@@H](N(C)C)CC1 ZINC000432801635 1121365852 /nfs/dbraw/zinc/36/58/52/1121365852.db2.gz XHHUTUPTCRNYSN-PKOBYXMFSA-N 1 3 288.479 3.671 20 0 CHADHO c1ccc2c(c1)cccc2CN1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000314763617 1121445172 /nfs/dbraw/zinc/44/51/72/1121445172.db2.gz RDKABHUUHFICEH-AZUAARDMSA-N 1 3 294.442 3.804 20 0 CHADHO CCC1([NH+]2CCCCC2)CCN(CC2CC(C)C2)CC1 ZINC001175766985 1121459515 /nfs/dbraw/zinc/45/95/15/1121459515.db2.gz GUMHIXSZTPZEGD-UHFFFAOYSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@H](c1nc2ccccc2s1)N(C)CCCCCC[NH3+] ZINC000710684293 1121475018 /nfs/dbraw/zinc/47/50/18/1121475018.db2.gz ZUYPQHIGPYIGNJ-CYBMUJFWSA-N 1 3 291.464 3.808 20 0 CHADHO c1ccc(CN2C[C@@H]3CCC[C@@H]([NH2+]CC4CCC4)[C@H]3C2)cc1 ZINC000512614295 1121494297 /nfs/dbraw/zinc/49/42/97/1121494297.db2.gz VMQBSPJGUOGBMA-SLFFLAALSA-N 1 3 298.474 3.677 20 0 CHADHO C1[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)C12CCCC2 ZINC000429427084 1121577535 /nfs/dbraw/zinc/57/75/35/1121577535.db2.gz OCIIYARDDGNLPE-KRWDZBQOSA-N 1 3 276.468 3.706 20 0 CHADHO C1[C@H](NC2CC[NH+](C3CCCCC3)CC2)C12CCCC2 ZINC000429427084 1121577538 /nfs/dbraw/zinc/57/75/38/1121577538.db2.gz OCIIYARDDGNLPE-KRWDZBQOSA-N 1 3 276.468 3.706 20 0 CHADHO CCCN1CCC([NH2+]Cc2ccc(Cl)c(C)c2)CC1 ZINC000161691571 1121651015 /nfs/dbraw/zinc/65/10/15/1121651015.db2.gz OPSHXCPVELILAY-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO C[C@@H]([NH2+]CC[C@H]1CCCN1C)c1ccc(C2CC2)cc1 ZINC000419347664 1121674090 /nfs/dbraw/zinc/67/40/90/1121674090.db2.gz XAYJGVCKIOCMJP-RDTXWAMCSA-N 1 3 272.436 3.699 20 0 CHADHO C1CCC2(C1)CCC([N@@H+]1CC[C@]3(C1)CCCNC3)CC2 ZINC000709972775 1121692747 /nfs/dbraw/zinc/69/27/47/1121692747.db2.gz XTJVRUIUNJFPIN-GOSISDBHSA-N 1 3 276.468 3.565 20 0 CHADHO C1CCC2(C1)CCC([N@H+]1CC[C@]3(C1)CCCNC3)CC2 ZINC000709972775 1121692750 /nfs/dbraw/zinc/69/27/50/1121692750.db2.gz XTJVRUIUNJFPIN-GOSISDBHSA-N 1 3 276.468 3.565 20 0 CHADHO Cc1cccc(CC[NH2+]C2CCC(c3ccccc3)C2)n1 ZINC000280626269 1121724284 /nfs/dbraw/zinc/72/42/84/1121724284.db2.gz PZMAZSDVQLPULY-MJGOQNOKSA-N 1 3 280.415 3.858 20 0 CHADHO C[C@@H](CC[NH2+]Cc1cccc(C2CCCC2)c1)N(C)C ZINC001179265735 1121865804 /nfs/dbraw/zinc/86/58/04/1121865804.db2.gz CEPPYBGJIGUOKW-HNNXBMFYSA-N 1 3 274.452 3.774 20 0 CHADHO CCCC1CCC(C[NH2+]CC[C@@H](C)N(C)C)CC1 ZINC001179266885 1121866293 /nfs/dbraw/zinc/86/62/93/1121866293.db2.gz YLRBFDGDHGPUHL-QQFBHYJXSA-N 1 3 254.462 3.523 20 0 CHADHO CC(C)C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H]3CN(C)C[C@@H]32)C1 ZINC001179816788 1121912896 /nfs/dbraw/zinc/91/28/96/1121912896.db2.gz NTFCEMJDPIULLY-KFGODFMUSA-N 1 3 278.484 3.521 20 0 CHADHO CCCc1ccc([C@@H](NC[C@H]2CC[NH2+]C2)C(C)C)cc1 ZINC000420376583 1122003882 /nfs/dbraw/zinc/00/38/82/1122003882.db2.gz QUJUBBUEFBZLIC-WMZOPIPTSA-N 1 3 274.452 3.535 20 0 CHADHO FC(F)(F)C[C@@H]1CCC[N@H+](CCCN2CCCCC2)C1 ZINC000420944993 1122046936 /nfs/dbraw/zinc/04/69/36/1122046936.db2.gz JXVSOMWNMXYCDD-AWEZNQCLSA-N 1 3 292.389 3.527 20 0 CHADHO FC(F)(F)C[C@@H]1CCC[N@@H+](CCCN2CCCCC2)C1 ZINC000420944993 1122046939 /nfs/dbraw/zinc/04/69/39/1122046939.db2.gz JXVSOMWNMXYCDD-AWEZNQCLSA-N 1 3 292.389 3.527 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@@H](C)Cc1cccc(C)c1 ZINC001184418879 1122276389 /nfs/dbraw/zinc/27/63/89/1122276389.db2.gz SXOWRGYYRWCWAB-IRXDYDNUSA-N 1 3 276.468 3.636 20 0 CHADHO C[C@H]([NH2+]C[C@@H](N)C1CC1)c1ccc(-c2ccccc2)cc1 ZINC000423320765 1122285072 /nfs/dbraw/zinc/28/50/72/1122285072.db2.gz MPTVAJWURFOCEH-IFXJQAMLSA-N 1 3 280.415 3.742 20 0 CHADHO CCN(Cc1cc(C)c2ncccc2c1)[C@@H]1CCC[NH2+]CC1 ZINC000435390111 1122462565 /nfs/dbraw/zinc/46/25/65/1122462565.db2.gz ABTRDOLNQQZGQI-GOSISDBHSA-N 1 3 297.446 3.507 20 0 CHADHO CCN(Cc1cc(C)nc2ccccc12)[C@H]1CCC[NH2+]CC1 ZINC000435611907 1122478616 /nfs/dbraw/zinc/47/86/16/1122478616.db2.gz DAYMPSZUIPWMIA-KRWDZBQOSA-N 1 3 297.446 3.507 20 0 CHADHO C(=C\C1CC1)\CN[C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716693189 1122636527 /nfs/dbraw/zinc/63/65/27/1122636527.db2.gz OPHFIYMBASPBLC-DBYYDSSQSA-N 1 3 296.458 3.595 20 0 CHADHO C(=C\C1CC1)\CN[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716693189 1122636530 /nfs/dbraw/zinc/63/65/30/1122636530.db2.gz OPHFIYMBASPBLC-DBYYDSSQSA-N 1 3 296.458 3.595 20 0 CHADHO C(=C\C1CC1)\C[NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000716693189 1122636532 /nfs/dbraw/zinc/63/65/32/1122636532.db2.gz OPHFIYMBASPBLC-DBYYDSSQSA-N 1 3 296.458 3.595 20 0 CHADHO CCN(CC)CCC[N@H+](CC)[C@H]1CCCC[C@H]1C ZINC001193412569 1122690515 /nfs/dbraw/zinc/69/05/15/1122690515.db2.gz FOUQSSRCAPHSRU-CVEARBPZSA-N 1 3 254.462 3.619 20 0 CHADHO CCN(CC)CCC[N@@H+](CC)[C@H]1CCCC[C@H]1C ZINC001193412569 1122690517 /nfs/dbraw/zinc/69/05/17/1122690517.db2.gz FOUQSSRCAPHSRU-CVEARBPZSA-N 1 3 254.462 3.619 20 0 CHADHO Cc1ccc([C@H]([NH2+]C[C@H](C)CN(C)C)C2CCC2)cc1 ZINC000425940827 1122671986 /nfs/dbraw/zinc/67/19/86/1122671986.db2.gz AWNFZTWCLISYNU-MAUKXSAKSA-N 1 3 274.452 3.624 20 0 CHADHO CC(C)[C@H]([NH2+]C[C@H](C)CN(C)C)c1cc2ccccc2o1 ZINC000425943773 1122673378 /nfs/dbraw/zinc/67/33/78/1122673378.db2.gz SUUNFYFOAYRTHK-KSSFIOAISA-N 1 3 288.435 3.917 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)CCc1ccc(Cl)s1)CN(C)C ZINC000425947106 1122675488 /nfs/dbraw/zinc/67/54/88/1122675488.db2.gz ZHZDJWZZFBHIFA-NEPJUHHUSA-N 1 3 288.888 3.510 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+]C[C@@H](C)CN(C)C ZINC000425947148 1122675533 /nfs/dbraw/zinc/67/55/33/1122675533.db2.gz RMCQLXZFXYMJAV-SJLPKXTDSA-N 1 3 276.468 3.575 20 0 CHADHO CC(C)CSCCCN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000154062533 1129082255 /nfs/dbraw/zinc/08/22/55/1129082255.db2.gz LAGOAJKSHJYLDI-KRWDZBQOSA-N 1 3 298.540 3.716 20 0 CHADHO C(C1CC1)N1[C@@H]2CC[C@H]1CC([NH+]1C[C@H]3CCCC[C@@H]3C1)C2 ZINC001167982828 1122903145 /nfs/dbraw/zinc/90/31/45/1122903145.db2.gz BNZZYJZUVOUFKD-ZWRCUJBNSA-N 1 3 288.479 3.514 20 0 CHADHO CC(C)C[C@H](CN1CC[C@@H]2[NH2+]CC[C@H]2C1)c1ccccc1 ZINC000427120194 1122944738 /nfs/dbraw/zinc/94/47/38/1122944738.db2.gz AHMZKWRLXVPXNB-OTWHNJEPSA-N 1 3 286.463 3.500 20 0 CHADHO C[C@@H]1CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C[C@@H]1C ZINC001167985084 1122944927 /nfs/dbraw/zinc/94/49/27/1122944927.db2.gz VCVXMXPPJZBPML-XARAWCMASA-N 1 3 290.495 3.760 20 0 CHADHO C[C@@H]1CCC[N@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C[C@@H]1C ZINC001167985084 1122944929 /nfs/dbraw/zinc/94/49/29/1122944929.db2.gz VCVXMXPPJZBPML-XARAWCMASA-N 1 3 290.495 3.760 20 0 CHADHO CCC[C@@H](C)CCCN1CCN(c2cc[nH+]cc2)C[C@@H]1C ZINC001197931069 1122973894 /nfs/dbraw/zinc/97/38/94/1122973894.db2.gz UXFZCQTVRBSLEJ-SJORKVTESA-N 1 3 289.467 3.809 20 0 CHADHO CCC[C@@H](C)CCC[N@@H+]1CCN(c2ccncc2)C[C@@H]1C ZINC001197931069 1122973896 /nfs/dbraw/zinc/97/38/96/1122973896.db2.gz UXFZCQTVRBSLEJ-SJORKVTESA-N 1 3 289.467 3.809 20 0 CHADHO CCC[C@@H](C)CCC[N@H+]1CCN(c2ccncc2)C[C@@H]1C ZINC001197931069 1122973899 /nfs/dbraw/zinc/97/38/99/1122973899.db2.gz UXFZCQTVRBSLEJ-SJORKVTESA-N 1 3 289.467 3.809 20 0 CHADHO C[C@H](C[NH2+]C[C@@H](C)CC1CCCCC1)CN1CCCC1 ZINC001199403577 1123030370 /nfs/dbraw/zinc/03/03/70/1123030370.db2.gz VYWVHKRHBGWJHG-DLBZAZTESA-N 1 3 280.500 3.914 20 0 CHADHO CC[C@H](c1ccccc1)N(C)CC[C@@H]1CCCC[N@@H+]1C ZINC000441342234 1123080053 /nfs/dbraw/zinc/08/00/53/1123080053.db2.gz YDGIDQNXYXRKFQ-ZWKOTPCHSA-N 1 3 274.452 3.944 20 0 CHADHO CC[C@H](c1ccccc1)N(C)CC[C@@H]1CCCC[N@H+]1C ZINC000441342234 1123080058 /nfs/dbraw/zinc/08/00/58/1123080058.db2.gz YDGIDQNXYXRKFQ-ZWKOTPCHSA-N 1 3 274.452 3.944 20 0 CHADHO C(CN1CCCC1)[C@@H]1CCCC[N@@H+]1CC1CCCCC1 ZINC001201397533 1123091236 /nfs/dbraw/zinc/09/12/36/1123091236.db2.gz JGYLINNXFYWNTI-SFHVURJKSA-N 1 3 278.484 3.907 20 0 CHADHO C(CN1CCCC1)[C@@H]1CCCC[N@H+]1CC1CCCCC1 ZINC001201397533 1123091242 /nfs/dbraw/zinc/09/12/42/1123091242.db2.gz JGYLINNXFYWNTI-SFHVURJKSA-N 1 3 278.484 3.907 20 0 CHADHO C[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)c1ccc(-c2cccnc2)cc1 ZINC000520428946 1123099071 /nfs/dbraw/zinc/09/90/71/1123099071.db2.gz DUYFBSQTPLRVDO-KYNGSXCRSA-N 1 3 295.430 3.669 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+][C@@H]2CCCC(C)(C)C2)C1 ZINC001201557503 1123123067 /nfs/dbraw/zinc/12/30/67/1123123067.db2.gz KHNBAQJSPPJCMV-IAGOWNOFSA-N 1 3 280.500 3.913 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1CCc1ccccc1 ZINC001201606115 1123130791 /nfs/dbraw/zinc/13/07/91/1123130791.db2.gz JRKHLSUWQWVKPR-OALUTQOASA-N 1 3 286.463 3.568 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@H+]1CCc1ccccc1 ZINC001201606115 1123130792 /nfs/dbraw/zinc/13/07/92/1123130792.db2.gz JRKHLSUWQWVKPR-OALUTQOASA-N 1 3 286.463 3.568 20 0 CHADHO CC(C)CC[NH+]1CCC2(CN(Cc3ccccc3)C2)CC1 ZINC001201624489 1123132965 /nfs/dbraw/zinc/13/29/65/1123132965.db2.gz SSUOLNOIVUVIJX-UHFFFAOYSA-N 1 3 286.463 3.631 20 0 CHADHO c1ccc(C[N@H+]2C[C@H]3CCN(CC4CCCC4)C[C@H]3C2)cc1 ZINC001202189936 1123184643 /nfs/dbraw/zinc/18/46/43/1123184643.db2.gz GUXXHEHVYFQDPF-UXHICEINSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(C[N@@H+]2C[C@H]3CCN(CC4CCCC4)C[C@H]3C2)cc1 ZINC001202189936 1123184644 /nfs/dbraw/zinc/18/46/44/1123184644.db2.gz GUXXHEHVYFQDPF-UXHICEINSA-N 1 3 298.474 3.631 20 0 CHADHO Cc1ccc(CCN[C@H]2C[C@@H]([NH3+])c3ccccc32)cc1C ZINC000665245282 1123251606 /nfs/dbraw/zinc/25/16/06/1123251606.db2.gz DJZLGFCVOVPHDN-MOPGFXCFSA-N 1 3 280.415 3.580 20 0 CHADHO C[C@H]([NH2+]CC1(N)CCCC1)c1cccc(-c2ccncc2)c1 ZINC000665249528 1123263841 /nfs/dbraw/zinc/26/38/41/1123263841.db2.gz RZULQAOUSIEHDJ-HNNXBMFYSA-N 1 3 295.430 3.671 20 0 CHADHO [NH3+][C@H]1C[C@@H](NC2CCC3(CC3(F)F)CC2)c2ccccc21 ZINC000665273776 1123303260 /nfs/dbraw/zinc/30/32/60/1123303260.db2.gz DFBNVXOCHYNSHH-VYROYRMRSA-N 1 3 292.373 3.689 20 0 CHADHO CC(C)C[C@H](NCC[C@@H]([NH3+])C(C)C)c1cccs1 ZINC000665281125 1123312912 /nfs/dbraw/zinc/31/29/12/1123312912.db2.gz VISKCSZMGPEFSI-KGLIPLIRSA-N 1 3 268.470 3.798 20 0 CHADHO [NH3+][C@@H]1C[C@H](NC2CCC(C(F)F)CC2)c2ccccc21 ZINC000335615193 1123385159 /nfs/dbraw/zinc/38/51/59/1123385159.db2.gz QPCSOXCBXUXPIC-FBDPFYNOSA-N 1 3 280.362 3.545 20 0 CHADHO CC(C)[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1ccccc1F ZINC000895346929 1123463390 /nfs/dbraw/zinc/46/33/90/1123463390.db2.gz OQWYQXVDAAGYQS-KRWWSPQJSA-N 1 3 290.426 3.738 20 0 CHADHO CCC(CC)(CC)C[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000395171171 1123465801 /nfs/dbraw/zinc/46/58/01/1123465801.db2.gz CZSDOWFGPNNUEU-OAHLLOKOSA-N 1 3 254.462 3.523 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1NCc1ccc2ccccc2c1 ZINC000157307829 1129126803 /nfs/dbraw/zinc/12/68/03/1129126803.db2.gz DDKLNRFRMRWSHR-ZRGWGRIASA-N 1 3 282.431 3.658 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1NCc1ccc2ccccc2c1 ZINC000157307829 1129126804 /nfs/dbraw/zinc/12/68/04/1129126804.db2.gz DDKLNRFRMRWSHR-ZRGWGRIASA-N 1 3 282.431 3.658 20 0 CHADHO CCN1CC[C@H](C[NH2+]C[C@@H](CC(C)C)c2ccccc2)C1 ZINC000474497804 1123541342 /nfs/dbraw/zinc/54/13/42/1123541342.db2.gz ZBSRURNBGHKBOI-IEBWSBKVSA-N 1 3 288.479 3.748 20 0 CHADHO CC1(C)CCC[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000157557189 1129129409 /nfs/dbraw/zinc/12/94/09/1129129409.db2.gz YXZSEFWCTOPQMV-QGZVFWFLSA-N 1 3 278.484 3.952 20 0 CHADHO C[NH2+]C[C@@H]1CCCN(Cc2sc3ccccc3c2C)C1 ZINC001205009248 1123644942 /nfs/dbraw/zinc/64/49/42/1123644942.db2.gz KPHNQLUZCGJMOE-AWEZNQCLSA-N 1 3 288.460 3.641 20 0 CHADHO C[C@@H]1CC[C@@H](C)C1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000777127828 1123708676 /nfs/dbraw/zinc/70/86/76/1123708676.db2.gz VKILSSQLKGPZMF-HUUCEWRRSA-N 1 3 278.484 3.808 20 0 CHADHO CSc1ccc([C@@H](C)N[C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000281585665 1123728865 /nfs/dbraw/zinc/72/88/65/1123728865.db2.gz LJMYAGNKCUUPPZ-NFAWXSAZSA-N 1 3 278.465 3.542 20 0 CHADHO CSc1ccc([C@@H](C)N[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000281585665 1123728867 /nfs/dbraw/zinc/72/88/67/1123728867.db2.gz LJMYAGNKCUUPPZ-NFAWXSAZSA-N 1 3 278.465 3.542 20 0 CHADHO Cc1ccc2c(c1)[C@@H](NCC(C)(C)C[NH+](C)C)CCC2 ZINC000339066110 1123918534 /nfs/dbraw/zinc/91/85/34/1123918534.db2.gz BISXQEFKWGURJA-KRWDZBQOSA-N 1 3 274.452 3.550 20 0 CHADHO C(C[C@H]1CCSC1)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000865651797 1124002853 /nfs/dbraw/zinc/00/28/53/1124002853.db2.gz FSMNCAOGODZVQX-HNNXBMFYSA-N 1 3 296.524 3.516 20 0 CHADHO CS[C@H]1C[C@H](NC2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)C1 ZINC000866486344 1124071831 /nfs/dbraw/zinc/07/18/31/1124071831.db2.gz FDHHQFWLVLLPNH-LLLHUVSDSA-N 1 3 296.524 3.513 20 0 CHADHO CS[C@H]1C[C@H]([NH2+]C2CCN([C@@H]3CCC[C@H](C)C3)CC2)C1 ZINC000866486344 1124071837 /nfs/dbraw/zinc/07/18/37/1124071837.db2.gz FDHHQFWLVLLPNH-LLLHUVSDSA-N 1 3 296.524 3.513 20 0 CHADHO COc1c(C)cc(CNCc2ccc([C@H](C)[NH3+])cc2)cc1C ZINC000841030235 1124108202 /nfs/dbraw/zinc/10/82/02/1124108202.db2.gz VEMMDRMGTVRIBI-HNNXBMFYSA-N 1 3 298.430 3.622 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@H+](C)C[C@H]1CCCNC1 ZINC000469977570 1124110427 /nfs/dbraw/zinc/11/04/27/1124110427.db2.gz VOJXAKLPIHTNPL-ZNMIVQPWSA-N 1 3 294.870 3.763 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@@H+](C)C[C@H]1CCCNC1 ZINC000469977570 1124110429 /nfs/dbraw/zinc/11/04/29/1124110429.db2.gz VOJXAKLPIHTNPL-ZNMIVQPWSA-N 1 3 294.870 3.763 20 0 CHADHO CC[C@H](N[C@H]1CC[NH2+]CC(C)(C)C1)c1ccc(OC)cc1 ZINC000635012183 1129170197 /nfs/dbraw/zinc/17/01/97/1129170197.db2.gz RPNMNCHFUUZRLP-RDJZCZTQSA-N 1 3 290.451 3.514 20 0 CHADHO CC[NH+]1CCC(N[C@@H]2C[C@H](C(C)C)c3ccccc32)CC1 ZINC000447521200 1124479781 /nfs/dbraw/zinc/47/97/81/1124479781.db2.gz VPSNXKOZRILUNH-RTBURBONSA-N 1 3 286.463 3.945 20 0 CHADHO CC(C)[C@@H]1C[C@H](N[C@@H]2CC[N@H+](C)[C@H](C)C2)c2ccccc21 ZINC000447542244 1124486736 /nfs/dbraw/zinc/48/67/36/1124486736.db2.gz INWLQYCGDSGEMI-LTDCPUDJSA-N 1 3 286.463 3.943 20 0 CHADHO CC(C)[C@@H]1C[C@H](N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c2ccccc21 ZINC000447542244 1124486738 /nfs/dbraw/zinc/48/67/38/1124486738.db2.gz INWLQYCGDSGEMI-LTDCPUDJSA-N 1 3 286.463 3.943 20 0 CHADHO CC(C)CCC[NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000527354874 1124572463 /nfs/dbraw/zinc/57/24/63/1124572463.db2.gz BXCVHYBFSCWJIB-HOTGVXAUSA-N 1 3 266.473 3.665 20 0 CHADHO CCC[NH+]1CCC(N(C)Cc2cccc3ccoc32)CC1 ZINC000449018227 1124630558 /nfs/dbraw/zinc/63/05/58/1124630558.db2.gz RWOXBCUIXBYMQS-UHFFFAOYSA-N 1 3 286.419 3.739 20 0 CHADHO CCN(CC)CCC[NH2+]C1CCC(OC2CCCC2)CC1 ZINC000449222275 1124673853 /nfs/dbraw/zinc/67/38/53/1124673853.db2.gz WAYIJYDYZRXLLK-UHFFFAOYSA-N 1 3 296.499 3.578 20 0 CHADHO CC[N@@H+]1CC[C@H](N[C@@H]2CCCc3c(F)cccc32)[C@@H](C)C1 ZINC000449349855 1124696696 /nfs/dbraw/zinc/69/66/96/1124696696.db2.gz KNFVJMGQBVFWHY-DOPJRALCSA-N 1 3 290.426 3.523 20 0 CHADHO CC[N@H+]1CC[C@H](N[C@@H]2CCCc3c(F)cccc32)[C@@H](C)C1 ZINC000449349855 1124696698 /nfs/dbraw/zinc/69/66/98/1124696698.db2.gz KNFVJMGQBVFWHY-DOPJRALCSA-N 1 3 290.426 3.523 20 0 CHADHO CCC(CC)(CN[C@H]1CCCCC[C@H]1[NH3+])C(F)(F)F ZINC000873251796 1124754465 /nfs/dbraw/zinc/75/44/65/1124754465.db2.gz XPPSHBQWBQFSEL-NEPJUHHUSA-N 1 3 280.378 3.605 20 0 CHADHO CC/C=C\CNC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449463656 1124759212 /nfs/dbraw/zinc/75/92/12/1124759212.db2.gz XDZZGIBDOGJRFA-RLXIPRIJSA-N 1 3 286.463 3.638 20 0 CHADHO C[N@H+](CC1CC1)C[C@H]1CCN(CCC2=CCCCC2)C1 ZINC000450456554 1125034006 /nfs/dbraw/zinc/03/40/06/1125034006.db2.gz UBOXKGJVKGDOME-GOSISDBHSA-N 1 3 276.468 3.541 20 0 CHADHO C[N@@H+](CC1CC1)C[C@H]1CCN(CCC2=CCCCC2)C1 ZINC000450456554 1125034012 /nfs/dbraw/zinc/03/40/12/1125034012.db2.gz UBOXKGJVKGDOME-GOSISDBHSA-N 1 3 276.468 3.541 20 0 CHADHO C[N@H+](CC1CC1)C[C@H]1CCN(CC/C=C/c2ccccc2)C1 ZINC000450459109 1125036741 /nfs/dbraw/zinc/03/67/41/1125036741.db2.gz ZRGCURRDFKBSFK-MVHVFESUSA-N 1 3 298.474 3.754 20 0 CHADHO C[N@@H+](CC1CC1)C[C@H]1CCN(CC/C=C/c2ccccc2)C1 ZINC000450459109 1125036749 /nfs/dbraw/zinc/03/67/49/1125036749.db2.gz ZRGCURRDFKBSFK-MVHVFESUSA-N 1 3 298.474 3.754 20 0 CHADHO CCc1ccc(CCN(C)[C@@H]2CC[N@@H+](CC)[C@@H](C)C2)cc1 ZINC000530901509 1125185510 /nfs/dbraw/zinc/18/55/10/1125185510.db2.gz GNVRNFKHUQHJAC-QFBILLFUSA-N 1 3 288.479 3.596 20 0 CHADHO CCc1ccc(CCN(C)[C@@H]2CC[N@H+](CC)[C@@H](C)C2)cc1 ZINC000530901509 1125185511 /nfs/dbraw/zinc/18/55/11/1125185511.db2.gz GNVRNFKHUQHJAC-QFBILLFUSA-N 1 3 288.479 3.596 20 0 CHADHO CC(C)(F)C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000631660346 1125206259 /nfs/dbraw/zinc/20/62/59/1125206259.db2.gz VKWOSDIKEXTRFQ-OSYLJGHBSA-N 1 3 290.426 3.520 20 0 CHADHO CC(C)[N@@H+]1CC[C@@H](CNCc2cccc3ccccc32)C1 ZINC000040620682 1125388978 /nfs/dbraw/zinc/38/89/78/1125388978.db2.gz BEKQGWDPRUEEBI-INIZCTEOSA-N 1 3 282.431 3.660 20 0 CHADHO CC(C)[N@H+]1CC[C@@H](CNCc2cccc3ccccc32)C1 ZINC000040620682 1125388980 /nfs/dbraw/zinc/38/89/80/1125388980.db2.gz BEKQGWDPRUEEBI-INIZCTEOSA-N 1 3 282.431 3.660 20 0 CHADHO CC(C)[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCN(C(C)C)C2)C1 ZINC000230992950 1125395929 /nfs/dbraw/zinc/39/59/29/1125395929.db2.gz VCHCKMSSNSFOMP-BBWFWOEESA-N 1 3 266.473 3.521 20 0 CHADHO Cc1ccc(C[NH2+]CCCN2CCC(C)CC2)cc1C ZINC000035016885 1125422136 /nfs/dbraw/zinc/42/21/36/1125422136.db2.gz DPBZSCSKEPULBD-UHFFFAOYSA-N 1 3 274.452 3.515 20 0 CHADHO C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1ccc(F)c(Cl)c1 ZINC000296044769 1129220856 /nfs/dbraw/zinc/22/08/56/1129220856.db2.gz UQVKJDSQSKMKND-HLVVYCRESA-N 1 3 296.817 3.755 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]C[C@@]2(C)C[C@@H]2c2ccccc2)C1 ZINC000639169106 1129288506 /nfs/dbraw/zinc/28/85/06/1129288506.db2.gz CFNQXOHVZQGVRM-BHIYHBOVSA-N 1 3 286.463 3.500 20 0 CHADHO CCC[C@@H](C[NH+]1CCC(N(C)C)CC1)c1ccccc1 ZINC000179728009 1129432545 /nfs/dbraw/zinc/43/25/45/1129432545.db2.gz NWZZUCROYLJNDJ-KRWDZBQOSA-N 1 3 274.452 3.596 20 0 CHADHO CCC[C@@H](CN1CCC([NH+](C)C)CC1)c1ccccc1 ZINC000179728009 1129432546 /nfs/dbraw/zinc/43/25/46/1129432546.db2.gz NWZZUCROYLJNDJ-KRWDZBQOSA-N 1 3 274.452 3.596 20 0 CHADHO c1ccc([C@@H]2CC[C@@H]([NH2+][C@@H]3CCNC4(CCC4)C3)C2)cc1 ZINC000643548869 1129446256 /nfs/dbraw/zinc/44/62/56/1129446256.db2.gz WKMFZAKCGPWTIR-KZNAEPCWSA-N 1 3 284.447 3.587 20 0 CHADHO C[C@H](CN)C[N@H+](Cc1ccccc1)[C@@H]1CCC(C)(C)C1 ZINC001258598469 1129454735 /nfs/dbraw/zinc/45/47/35/1129454735.db2.gz HLTNIRILNWHCLV-NVXWUHKLSA-N 1 3 274.452 3.662 20 0 CHADHO C[C@H](CN)C[N@@H+](Cc1ccccc1)[C@@H]1CCC(C)(C)C1 ZINC001258598469 1129454737 /nfs/dbraw/zinc/45/47/37/1129454737.db2.gz HLTNIRILNWHCLV-NVXWUHKLSA-N 1 3 274.452 3.662 20 0 CHADHO [NH3+][C@H]1C[C@H](NC[C@H]2C[C@@H]2c2ccccc2)c2ccccc21 ZINC000647800501 1129585035 /nfs/dbraw/zinc/58/50/35/1129585035.db2.gz CTGYCMXSMAKNAX-OAOYMFHYSA-N 1 3 278.399 3.525 20 0 CHADHO CCC(CC)(N[C@@H]1CC[NH2+]C(C)(C)C1)c1ccccc1 ZINC001246186257 1131383753 /nfs/dbraw/zinc/38/37/53/1131383753.db2.gz YIYZWRVGADKSIC-MRXNPFEDSA-N 1 3 274.452 3.822 20 0 CHADHO CCC(CC)([NH2+][C@@H]1CCNC(C)(C)C1)c1ccccc1 ZINC001246186257 1131383757 /nfs/dbraw/zinc/38/37/57/1131383757.db2.gz YIYZWRVGADKSIC-MRXNPFEDSA-N 1 3 274.452 3.822 20 0 CHADHO CC[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc(C)c1 ZINC001169099543 1129696732 /nfs/dbraw/zinc/69/67/32/1129696732.db2.gz ATPOCOQFUXODEK-XMTFNYHQSA-N 1 3 272.436 3.661 20 0 CHADHO CC[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(C)c1 ZINC001169099543 1129696735 /nfs/dbraw/zinc/69/67/35/1129696735.db2.gz ATPOCOQFUXODEK-XMTFNYHQSA-N 1 3 272.436 3.661 20 0 CHADHO CC(C)[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001169101269 1129697098 /nfs/dbraw/zinc/69/70/98/1129697098.db2.gz QEOAHCNKLZYPHX-FJIDUMEYSA-N 1 3 290.426 3.738 20 0 CHADHO CC(C)[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001169101269 1129697100 /nfs/dbraw/zinc/69/71/00/1129697100.db2.gz QEOAHCNKLZYPHX-FJIDUMEYSA-N 1 3 290.426 3.738 20 0 CHADHO Cc1cccc(C2(N[C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4C)CCC2)c1 ZINC001169109563 1129703621 /nfs/dbraw/zinc/70/36/21/1129703621.db2.gz DIUNDQKSFJQFAD-BCDXTJNWSA-N 1 3 284.447 3.589 20 0 CHADHO Cc1cccc(C2(N[C@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CCC2)c1 ZINC001169109563 1129703623 /nfs/dbraw/zinc/70/36/23/1129703623.db2.gz DIUNDQKSFJQFAD-BCDXTJNWSA-N 1 3 284.447 3.589 20 0 CHADHO CC[NH+]1CCC(N(C)[C@H](C)c2ccc(Cl)cc2)CC1 ZINC001169266379 1129712660 /nfs/dbraw/zinc/71/26/60/1129712660.db2.gz WGXQESVVLDRUNB-CYBMUJFWSA-N 1 3 280.843 3.817 20 0 CHADHO CC[N@H+](CCC1CCN(Cc2ccoc2)CC1)CC1CC1 ZINC000770596213 1129952094 /nfs/dbraw/zinc/95/20/94/1129952094.db2.gz CWOBIKDIKKJKSP-UHFFFAOYSA-N 1 3 290.451 3.614 20 0 CHADHO CC[N@@H+](CCC1CCN(Cc2ccoc2)CC1)CC1CC1 ZINC000770596213 1129952099 /nfs/dbraw/zinc/95/20/99/1129952099.db2.gz CWOBIKDIKKJKSP-UHFFFAOYSA-N 1 3 290.451 3.614 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C[C@@H]1CCC=CCCC1 ZINC000902456650 1130012384 /nfs/dbraw/zinc/01/23/84/1130012384.db2.gz PYFRHRQMEGUWRY-GDBMZVCRSA-N 1 3 287.451 3.636 20 0 CHADHO C[NH+](C)Cc1ccccc1-c1ccc(C2=NCCC2)cc1 ZINC001239682114 1130053068 /nfs/dbraw/zinc/05/30/68/1130053068.db2.gz VAJFYSUVMNVGGC-UHFFFAOYSA-N 1 3 278.399 3.998 20 0 CHADHO C1CCC(N2CCC([NH2+][C@@H]3C[C@H]4CCC[C@H]4C3)CC2)C1 ZINC000902831947 1130066877 /nfs/dbraw/zinc/06/68/77/1130066877.db2.gz HHKQPOAGNPFXLC-SCAQPMJSSA-N 1 3 276.468 3.562 20 0 CHADHO FC1(F)CCCC[C@H]1CNC1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903177101 1130125195 /nfs/dbraw/zinc/12/51/95/1130125195.db2.gz HNFYBJHJGUQDAU-WYQXTGKHSA-N 1 3 298.421 3.559 20 0 CHADHO FC1(F)CCCC[C@H]1CNC1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1 ZINC000903177101 1130125198 /nfs/dbraw/zinc/12/51/98/1130125198.db2.gz HNFYBJHJGUQDAU-WYQXTGKHSA-N 1 3 298.421 3.559 20 0 CHADHO Cl/C=C/C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000903443175 1130177574 /nfs/dbraw/zinc/17/75/74/1130177574.db2.gz CNUNAFUJOJYTGA-YKMDKHMNSA-N 1 3 290.838 3.524 20 0 CHADHO CC[C@H](NC[C@@H]([NH3+])CC(F)F)c1cccc2ccccc21 ZINC000903959996 1130212569 /nfs/dbraw/zinc/21/25/69/1130212569.db2.gz URDGGWKHLQTNFR-BBRMVZONSA-N 1 3 292.373 3.863 20 0 CHADHO CC[C@@H](NC[C@H]([NH3+])CC(F)F)c1cccc2ccccc21 ZINC000903959998 1130213395 /nfs/dbraw/zinc/21/33/95/1130213395.db2.gz URDGGWKHLQTNFR-CZUORRHYSA-N 1 3 292.373 3.863 20 0 CHADHO C[C@H]1CC[C@@H](N2CCC([NH3+])(c3cccc(Cl)c3)CC2)C1 ZINC001170119613 1130275068 /nfs/dbraw/zinc/27/50/68/1130275068.db2.gz ZCZVSHRMADFLMK-XJKSGUPXSA-N 1 3 292.854 3.778 20 0 CHADHO [NH3+]Cc1cccc(C2=CCCN(Cc3ccccc3)C2)c1F ZINC001240387780 1130286669 /nfs/dbraw/zinc/28/66/69/1130286669.db2.gz XAQIUPFTJMAODR-UHFFFAOYSA-N 1 3 296.389 3.574 20 0 CHADHO Cc1cc(C[NH2+]C[C@H]2CCN(Cc3ccccc3)C2)c(C)o1 ZINC000793206202 1130533592 /nfs/dbraw/zinc/53/35/92/1130533592.db2.gz CNAQDSPHKQXMFS-GOSISDBHSA-N 1 3 298.430 3.508 20 0 CHADHO CN(CC[C@H]1CCCC[N@@H+]1C)C[C@@H]1CCc2ccccc21 ZINC000679535076 1130536170 /nfs/dbraw/zinc/53/61/70/1130536170.db2.gz UNUNPVHNIZIAJU-ZWKOTPCHSA-N 1 3 286.463 3.523 20 0 CHADHO CN(CC[C@H]1CCCC[N@H+]1C)C[C@@H]1CCc2ccccc21 ZINC000679535076 1130536172 /nfs/dbraw/zinc/53/61/72/1130536172.db2.gz UNUNPVHNIZIAJU-ZWKOTPCHSA-N 1 3 286.463 3.523 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](C[N@@H+]2CCC3(CNC3)C2)CC1 ZINC001235024487 1130703261 /nfs/dbraw/zinc/70/32/61/1130703261.db2.gz MLLDQPGYXSPAQX-GOSISDBHSA-N 1 3 288.479 3.755 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](C[N@H+]2CCC3(CNC3)C2)CC1 ZINC001235024487 1130703269 /nfs/dbraw/zinc/70/32/69/1130703269.db2.gz MLLDQPGYXSPAQX-GOSISDBHSA-N 1 3 288.479 3.755 20 0 CHADHO Cc1cc(-n2c(-c3ccccc3)cnc2[C@H](C)N)cc(C)[nH+]1 ZINC001170682824 1130705678 /nfs/dbraw/zinc/70/56/78/1130705678.db2.gz UVVJQXKKAKDGIT-AWEZNQCLSA-N 1 3 292.386 3.571 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CCC12CCNCC2 ZINC001235102532 1130710798 /nfs/dbraw/zinc/71/07/98/1130710798.db2.gz OTRUNIQAGNHUSU-ARJAWSKDSA-N 1 3 264.457 3.731 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CCC12CCNCC2 ZINC001235102532 1130710803 /nfs/dbraw/zinc/71/08/03/1130710803.db2.gz OTRUNIQAGNHUSU-ARJAWSKDSA-N 1 3 264.457 3.731 20 0 CHADHO CC/C=C\CCCCCCN1CCC12CC[NH2+]CC2 ZINC001235102532 1130710805 /nfs/dbraw/zinc/71/08/05/1130710805.db2.gz OTRUNIQAGNHUSU-ARJAWSKDSA-N 1 3 264.457 3.731 20 0 CHADHO c1cc(C[N@@H+]2CCCCC23CCNCC3)c2c(c1)CCCC2 ZINC001235188976 1130721351 /nfs/dbraw/zinc/72/13/51/1130721351.db2.gz DASMJQOTOFBCMJ-UHFFFAOYSA-N 1 3 298.474 3.674 20 0 CHADHO c1cc(C[N@H+]2CCCCC23CCNCC3)c2c(c1)CCCC2 ZINC001235188976 1130721355 /nfs/dbraw/zinc/72/13/55/1130721355.db2.gz DASMJQOTOFBCMJ-UHFFFAOYSA-N 1 3 298.474 3.674 20 0 CHADHO Clc1ccc(CN2CCC([C@@H]3CCCC[NH2+]3)CC2)cc1 ZINC001235229287 1130724357 /nfs/dbraw/zinc/72/43/57/1130724357.db2.gz KVEMTHHBPWDPGO-KRWDZBQOSA-N 1 3 292.854 3.694 20 0 CHADHO C[C@H](CN1CC[C@H]2[NH2+]CC[C@H]2C1)c1cccc2ccccc21 ZINC001235257011 1130728836 /nfs/dbraw/zinc/72/88/36/1130728836.db2.gz WMYAUSKRLFFIST-OXFYSEKESA-N 1 3 294.442 3.627 20 0 CHADHO CC(C)=CCCC1=CC[C@H](CN2C[C@@H]3C[NH2+]CC[C@@H]32)CC1 ZINC001235254714 1130728950 /nfs/dbraw/zinc/72/89/50/1130728950.db2.gz CRXYQAGLJSPIBS-FHWLQOOXSA-N 1 3 288.479 3.753 20 0 CHADHO CC(C)=CCCC1=CC[C@H](C[N@@H+]2C[C@@H]3CNCC[C@@H]32)CC1 ZINC001235254714 1130728955 /nfs/dbraw/zinc/72/89/55/1130728955.db2.gz CRXYQAGLJSPIBS-FHWLQOOXSA-N 1 3 288.479 3.753 20 0 CHADHO CC(C)=CCCC1=CC[C@H](C[N@H+]2C[C@@H]3CNCC[C@@H]32)CC1 ZINC001235254714 1130728960 /nfs/dbraw/zinc/72/89/60/1130728960.db2.gz CRXYQAGLJSPIBS-FHWLQOOXSA-N 1 3 288.479 3.753 20 0 CHADHO Cc1ccc(N(C)c2ccc(CN(C)CCC[NH3+])cc2)cc1 ZINC001235435119 1130743743 /nfs/dbraw/zinc/74/37/43/1130743743.db2.gz APDHWNLZWIAAIQ-UHFFFAOYSA-N 1 3 297.446 3.544 20 0 CHADHO CC[N@H+](Cc1ccc(F)c2ccccc12)C1CCNCC1 ZINC001235761494 1130777217 /nfs/dbraw/zinc/77/72/17/1130777217.db2.gz LFLKSCLMQGOOOC-UHFFFAOYSA-N 1 3 286.394 3.553 20 0 CHADHO CC[N@@H+](Cc1ccc(F)c2ccccc12)C1CCNCC1 ZINC001235761494 1130777220 /nfs/dbraw/zinc/77/72/20/1130777220.db2.gz LFLKSCLMQGOOOC-UHFFFAOYSA-N 1 3 286.394 3.553 20 0 CHADHO CCN(Cc1ccc(F)c2ccccc12)C1CC[NH2+]CC1 ZINC001235761494 1130777227 /nfs/dbraw/zinc/77/72/27/1130777227.db2.gz LFLKSCLMQGOOOC-UHFFFAOYSA-N 1 3 286.394 3.553 20 0 CHADHO Cc1csc(CN2CCC([C@H]3CCC[NH2+]3)CC2)c1Cl ZINC001235883384 1130792758 /nfs/dbraw/zinc/79/27/58/1130792758.db2.gz FJPITZKHYHYRKX-CYBMUJFWSA-N 1 3 298.883 3.674 20 0 CHADHO CC[C@@H]1CO[C@@](C)(CCC(C)C)N1CCC12CC([NH3+])(C1)C2 ZINC001235962551 1130819623 /nfs/dbraw/zinc/81/96/23/1130819623.db2.gz MRANZFBWEXNNSX-VEZWFGLTSA-N 1 3 294.483 3.521 20 0 CHADHO CCC(CC)N1CCC([NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170730658 1130834294 /nfs/dbraw/zinc/83/42/94/1130834294.db2.gz KTXIXJLBULWFHX-XGBSXSJOSA-N 1 3 278.484 3.664 20 0 CHADHO c1cc(C[N@@H+]2CCC[C@@H]2C2CCCCC2)cc2c1CNC2 ZINC001236040977 1130835612 /nfs/dbraw/zinc/83/56/12/1130835612.db2.gz GOBHBNMWKMZZHF-LJQANCHMSA-N 1 3 284.447 3.835 20 0 CHADHO c1cc(C[N@H+]2CCC[C@@H]2C2CCCCC2)cc2c1CNC2 ZINC001236040977 1130835618 /nfs/dbraw/zinc/83/56/18/1130835618.db2.gz GOBHBNMWKMZZHF-LJQANCHMSA-N 1 3 284.447 3.835 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@@H+]1C[C@H](C)C[C@H](N)C1 ZINC001236049863 1130839063 /nfs/dbraw/zinc/83/90/63/1130839063.db2.gz QZIOGPIHUXMEIT-QAPCUYQASA-N 1 3 294.442 3.831 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@H+]1C[C@H](C)C[C@H](N)C1 ZINC001236049863 1130839067 /nfs/dbraw/zinc/83/90/67/1130839067.db2.gz QZIOGPIHUXMEIT-QAPCUYQASA-N 1 3 294.442 3.831 20 0 CHADHO CC[C@H](N)C[N@H+](C)CCC(c1ccccc1)c1ccccc1 ZINC001236092083 1130858257 /nfs/dbraw/zinc/85/82/57/1130858257.db2.gz GEKRSSLRKVDPAV-IBGZPJMESA-N 1 3 296.458 3.878 20 0 CHADHO CC[C@H](N)C[N@@H+](C)CCC(c1ccccc1)c1ccccc1 ZINC001236092083 1130858266 /nfs/dbraw/zinc/85/82/66/1130858266.db2.gz GEKRSSLRKVDPAV-IBGZPJMESA-N 1 3 296.458 3.878 20 0 CHADHO CCCN(Cc1coc2ccc(F)cc12)C1CC[NH2+]CC1 ZINC001236183128 1130881382 /nfs/dbraw/zinc/88/13/82/1130881382.db2.gz UTGUIIIMFAOHEL-UHFFFAOYSA-N 1 3 290.382 3.536 20 0 CHADHO CC(C)c1ccccc1C[N@H+](C)[C@H]1CCCC[C@H]1N ZINC001236219146 1130893839 /nfs/dbraw/zinc/89/38/39/1130893839.db2.gz VCKDPIIMHRAOEP-SJORKVTESA-N 1 3 260.425 3.512 20 0 CHADHO CC(C)c1ccccc1C[N@@H+](C)[C@H]1CCCC[C@H]1N ZINC001236219146 1130893847 /nfs/dbraw/zinc/89/38/47/1130893847.db2.gz VCKDPIIMHRAOEP-SJORKVTESA-N 1 3 260.425 3.512 20 0 CHADHO c1c(C[NH+]2CCCCCCCC2)sc2c1CCNC2 ZINC001236308741 1130912625 /nfs/dbraw/zinc/91/26/25/1130912625.db2.gz YBXFKIHYCHXIAO-UHFFFAOYSA-N 1 3 278.465 3.550 20 0 CHADHO CCC(CC)C[N@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236370492 1130921979 /nfs/dbraw/zinc/92/19/79/1130921979.db2.gz GOTKDRNOQZQURQ-MRXNPFEDSA-N 1 3 266.473 3.667 20 0 CHADHO CCC(CC)C[N@@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236370492 1130921982 /nfs/dbraw/zinc/92/19/82/1130921982.db2.gz GOTKDRNOQZQURQ-MRXNPFEDSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@H]1[C@@H](N)CCC[N@@H+]1Cc1cccc2c3ccccc3oc21 ZINC001236419413 1130934358 /nfs/dbraw/zinc/93/43/58/1130934358.db2.gz INSOLOLECCMIBI-GUYCJALGSA-N 1 3 294.398 3.898 20 0 CHADHO C[C@H]1[C@@H](N)CCC[N@H+]1Cc1cccc2c3ccccc3oc21 ZINC001236419413 1130934360 /nfs/dbraw/zinc/93/43/60/1130934360.db2.gz INSOLOLECCMIBI-GUYCJALGSA-N 1 3 294.398 3.898 20 0 CHADHO CC(C)(C)C[N@H+](Cc1cccc(Cl)c1)C1CCNCC1 ZINC001236456340 1130946970 /nfs/dbraw/zinc/94/69/70/1130946970.db2.gz CIEFAEYKPLKISW-UHFFFAOYSA-N 1 3 294.870 3.940 20 0 CHADHO CC(C)(C)C[N@@H+](Cc1cccc(Cl)c1)C1CCNCC1 ZINC001236456340 1130946974 /nfs/dbraw/zinc/94/69/74/1130946974.db2.gz CIEFAEYKPLKISW-UHFFFAOYSA-N 1 3 294.870 3.940 20 0 CHADHO Cc1ccsc1CN(CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236458223 1130947359 /nfs/dbraw/zinc/94/73/59/1130947359.db2.gz TWGFIQSRMSCWKC-UHFFFAOYSA-N 1 3 280.481 3.657 20 0 CHADHO Cc1ccsc1C[N@H+](CC(C)(C)C)C1CCNCC1 ZINC001236458223 1130947353 /nfs/dbraw/zinc/94/73/53/1130947353.db2.gz TWGFIQSRMSCWKC-UHFFFAOYSA-N 1 3 280.481 3.657 20 0 CHADHO Cc1ccsc1C[N@@H+](CC(C)(C)C)C1CCNCC1 ZINC001236458223 1130947355 /nfs/dbraw/zinc/94/73/55/1130947355.db2.gz TWGFIQSRMSCWKC-UHFFFAOYSA-N 1 3 280.481 3.657 20 0 CHADHO CC[C@@H](C)C[N@H+](Cc1cc(C)cc(F)c1)C1CCNCC1 ZINC001236481333 1130952114 /nfs/dbraw/zinc/95/21/14/1130952114.db2.gz RFYMKFGBMHOQRK-CQSZACIVSA-N 1 3 292.442 3.734 20 0 CHADHO CC[C@@H](C)C[N@@H+](Cc1cc(C)cc(F)c1)C1CCNCC1 ZINC001236481333 1130952117 /nfs/dbraw/zinc/95/21/17/1130952117.db2.gz RFYMKFGBMHOQRK-CQSZACIVSA-N 1 3 292.442 3.734 20 0 CHADHO CC[C@@H](C)CN(Cc1cc(C)cc(F)c1)C1CC[NH2+]CC1 ZINC001236481333 1130952119 /nfs/dbraw/zinc/95/21/19/1130952119.db2.gz RFYMKFGBMHOQRK-CQSZACIVSA-N 1 3 292.442 3.734 20 0 CHADHO Cc1ccc([C@@H](C)CC[N@H+](CCN)Cc2ccccc2)o1 ZINC001236521447 1130963270 /nfs/dbraw/zinc/96/32/70/1130963270.db2.gz BRALPBRHICQOHH-HNNXBMFYSA-N 1 3 286.419 3.543 20 0 CHADHO Cc1ccc([C@@H](C)CC[N@@H+](CCN)Cc2ccccc2)o1 ZINC001236521447 1130963273 /nfs/dbraw/zinc/96/32/73/1130963273.db2.gz BRALPBRHICQOHH-HNNXBMFYSA-N 1 3 286.419 3.543 20 0 CHADHO CC1=CC[C@@H](CC[N@H+](C[C@@H]2CCCNC2)C2CC2)C1(C)C ZINC001236584620 1130980319 /nfs/dbraw/zinc/98/03/19/1130980319.db2.gz MIVVBCUOTZUAAF-SJORKVTESA-N 1 3 290.495 3.833 20 0 CHADHO CC1=CC[C@@H](CC[N@@H+](C[C@@H]2CCCNC2)C2CC2)C1(C)C ZINC001236584620 1130980324 /nfs/dbraw/zinc/98/03/24/1130980324.db2.gz MIVVBCUOTZUAAF-SJORKVTESA-N 1 3 290.495 3.833 20 0 CHADHO CC1=CC[C@H](CC[N@H+](C[C@H]2CCCNC2)C2CC2)C1(C)C ZINC001236584611 1130981078 /nfs/dbraw/zinc/98/10/78/1130981078.db2.gz MIVVBCUOTZUAAF-DLBZAZTESA-N 1 3 290.495 3.833 20 0 CHADHO CC1=CC[C@H](CC[N@@H+](C[C@H]2CCCNC2)C2CC2)C1(C)C ZINC001236584611 1130981082 /nfs/dbraw/zinc/98/10/82/1130981082.db2.gz MIVVBCUOTZUAAF-DLBZAZTESA-N 1 3 290.495 3.833 20 0 CHADHO Cc1ccc(-c2ccc(CN3CC[C@@](C)(C[NH3+])C3)cc2)cc1 ZINC001236605474 1130983322 /nfs/dbraw/zinc/98/33/22/1130983322.db2.gz VKNHCBFRJILIEA-FQEVSTJZSA-N 1 3 294.442 3.833 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CC[C@@](C)(CN)C1 ZINC001236604794 1130983869 /nfs/dbraw/zinc/98/38/69/1130983869.db2.gz OBCQFFDQMYKPKV-AWFCHZOYSA-N 1 3 252.446 3.574 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CC[C@@](C)(CN)C1 ZINC001236604794 1130983874 /nfs/dbraw/zinc/98/38/74/1130983874.db2.gz OBCQFFDQMYKPKV-AWFCHZOYSA-N 1 3 252.446 3.574 20 0 CHADHO Cc1cccc(-c2ccc(CN3CC[C@@](C)(C[NH3+])C3)cc2)c1 ZINC001236618149 1130984793 /nfs/dbraw/zinc/98/47/93/1130984793.db2.gz YYDOENLZWACYOJ-FQEVSTJZSA-N 1 3 294.442 3.833 20 0 CHADHO Cc1cc(F)ccc1[C@H](C)[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000815576590 1131002034 /nfs/dbraw/zinc/00/20/34/1131002034.db2.gz UHMCHBRDCLGUTE-HOTGVXAUSA-N 1 3 292.442 3.905 20 0 CHADHO CCN1CCC[C@@H](C[NH2+][C@H](C)c2ccc(Cl)s2)C1 ZINC001116293374 1131140139 /nfs/dbraw/zinc/14/01/39/1131140139.db2.gz PUJWOMUCFMILTC-NEPJUHHUSA-N 1 3 286.872 3.784 20 0 CHADHO CC[C@@H](C)[N@H+](C)Cc1ccc2c(c1)C(C(C)C)=NCC2 ZINC001237876670 1131147450 /nfs/dbraw/zinc/14/74/50/1131147450.db2.gz HBXKTXOJYLRXNS-CQSZACIVSA-N 1 3 272.436 3.918 20 0 CHADHO CC[C@@H](C)[N@@H+](C)Cc1ccc2c(c1)C(C(C)C)=NCC2 ZINC001237876670 1131147453 /nfs/dbraw/zinc/14/74/53/1131147453.db2.gz HBXKTXOJYLRXNS-CQSZACIVSA-N 1 3 272.436 3.918 20 0 CHADHO C[C@@H](CSC(C)(C)C)NCC1([NH3+])CCCCCC1 ZINC000817944040 1131189485 /nfs/dbraw/zinc/18/94/85/1131189485.db2.gz WODHDSVXIIOEOP-ZDUSSCGKSA-N 1 3 272.502 3.548 20 0 CHADHO C[C@H](C[NH3+])CN[C@H](C)c1ccccc1SC(C)(C)C ZINC000817962404 1131192464 /nfs/dbraw/zinc/19/24/64/1131192464.db2.gz LERTWCPZCWZQGA-CHWSQXEVSA-N 1 3 280.481 3.823 20 0 CHADHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccc(Cl)nc1 ZINC000817962301 1131192835 /nfs/dbraw/zinc/19/28/35/1131192835.db2.gz HIMUMKFISBNBFP-NWDGAFQWSA-N 1 3 289.810 3.606 20 0 CHADHO CCCCC[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)C(C)(C)C ZINC000817970779 1131193942 /nfs/dbraw/zinc/19/39/42/1131193942.db2.gz FCHAEWJUWACVIT-KFWWJZLASA-N 1 3 254.462 3.712 20 0 CHADHO COc1c(C)cc([C@H](C)N[C@@H]2CCC[C@@H]([NH3+])C2)cc1Cl ZINC000817970354 1131194291 /nfs/dbraw/zinc/19/42/91/1131194291.db2.gz RZSNGJAEPQYWCU-IACUBPJLSA-N 1 3 296.842 3.578 20 0 CHADHO Cc1ccc(/C=C/c2ccc(N[C@H](N)CCC[NH3+])cc2)cc1 ZINC001170901038 1131208367 /nfs/dbraw/zinc/20/83/67/1131208367.db2.gz ULPKIFHYPPMMQE-SGQUHAKNSA-N 1 3 295.430 3.601 20 0 CHADHO Cc1c(Cl)ccc(CN(C)CC2CC[NH+](C)CC2)c1F ZINC001238519983 1131213791 /nfs/dbraw/zinc/21/37/91/1131213791.db2.gz WLIKEDQJDJNYDO-UHFFFAOYSA-N 1 3 298.833 3.561 20 0 CHADHO COc1c(C)cc([C@@H](C)[NH2+][C@@H]2CCCC[C@H]2N)cc1Cl ZINC000818614657 1131218979 /nfs/dbraw/zinc/21/89/79/1131218979.db2.gz DMVIXTGLAXFGGX-KCPJHIHWSA-N 1 3 296.842 3.578 20 0 CHADHO C[C@H](CCN)[NH2+][C@@H](C)CCc1ccc(Cl)c(Cl)c1 ZINC001246302217 1131454511 /nfs/dbraw/zinc/45/45/11/1131454511.db2.gz WPAZGVGBLWPVSS-WDEREUQCSA-N 1 3 289.250 3.641 20 0 CHADHO CCC[C@H](C)CC[C@@H](C)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246332885 1131472278 /nfs/dbraw/zinc/47/22/78/1131472278.db2.gz NQMJIPPDWVARKE-DMRKSPOLSA-N 1 3 266.473 3.854 20 0 CHADHO CCC(C)(C)C1CCC(NCC[NH2+]C(C)C)CC1 ZINC001246452658 1131504314 /nfs/dbraw/zinc/50/43/14/1131504314.db2.gz LONYMQWPKBUVPP-UHFFFAOYSA-N 1 3 254.462 3.569 20 0 CHADHO C[C@H](CSc1ccc(F)cc1)N1CCC[C@](C)([NH3+])CC1 ZINC001246550713 1131606207 /nfs/dbraw/zinc/60/62/07/1131606207.db2.gz JPRVPTHSRYTFIU-CJNGLKHVSA-N 1 3 296.455 3.510 20 0 CHADHO [NH3+][C@@H]1C[C@H](NCCC[C@H]2CC2(Cl)Cl)c2ccccc21 ZINC000844926063 1131608247 /nfs/dbraw/zinc/60/82/47/1131608247.db2.gz UBFNMKWFEPWGNY-GDLCADMTSA-N 1 3 299.245 3.695 20 0 CHADHO C[C@H]1CCCC[N@@H+]([C@@H]2CCNC3(CCCCC3)C2)C1 ZINC001246557876 1131620751 /nfs/dbraw/zinc/62/07/51/1131620751.db2.gz LQLASSOJHNABMA-JKSUJKDBSA-N 1 3 264.457 3.563 20 0 CHADHO C[C@H]1CCCC[N@H+]([C@@H]2CCNC3(CCCCC3)C2)C1 ZINC001246557876 1131620754 /nfs/dbraw/zinc/62/07/54/1131620754.db2.gz LQLASSOJHNABMA-JKSUJKDBSA-N 1 3 264.457 3.563 20 0 CHADHO CCCCC(CCCC)[N@@H+]1CCC[C@H](CN)[C@H]1C ZINC001246567278 1131635202 /nfs/dbraw/zinc/63/52/02/1131635202.db2.gz WXGKGZGIHYSACY-HUUCEWRRSA-N 1 3 254.462 3.795 20 0 CHADHO CCCCC(CCCC)[N@H+]1CCC[C@H](CN)[C@H]1C ZINC001246567278 1131635204 /nfs/dbraw/zinc/63/52/04/1131635204.db2.gz WXGKGZGIHYSACY-HUUCEWRRSA-N 1 3 254.462 3.795 20 0 CHADHO CCCCCC[C@H](C)[N@@H+]1CCCC12CCNCC2 ZINC001246653310 1131777161 /nfs/dbraw/zinc/77/71/61/1131777161.db2.gz MCZCUNIKHBIZAI-HNNXBMFYSA-N 1 3 252.446 3.563 20 0 CHADHO CCCC[C@H](CC(C)C)[N@@H+]1C[C@H](CF)[C@@H](C2(N)CC2)C1 ZINC001246689311 1131781698 /nfs/dbraw/zinc/78/16/98/1131781698.db2.gz INTDLKHXRBRWHH-XHSDSOJGSA-N 1 3 284.463 3.600 20 0 CHADHO CCCC[C@H](CC(C)C)[N@H+]1C[C@H](CF)[C@@H](C2(N)CC2)C1 ZINC001246689311 1131781703 /nfs/dbraw/zinc/78/17/03/1131781703.db2.gz INTDLKHXRBRWHH-XHSDSOJGSA-N 1 3 284.463 3.600 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[N@@H+]1C[C@H](CF)[C@@H](C2(N)CC2)C1 ZINC001246687058 1131782247 /nfs/dbraw/zinc/78/22/47/1131782247.db2.gz CXOZSLRDWOYION-VGWMRTNUSA-N 1 3 284.463 3.600 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[N@H+]1C[C@H](CF)[C@@H](C2(N)CC2)C1 ZINC001246687058 1131782254 /nfs/dbraw/zinc/78/22/54/1131782254.db2.gz CXOZSLRDWOYION-VGWMRTNUSA-N 1 3 284.463 3.600 20 0 CHADHO CCC[C@@H]1CCCC[N@@H+]1[C@H]1CCN[C@@H](C(C)(C)C)C1 ZINC001246787671 1131782369 /nfs/dbraw/zinc/78/23/69/1131782369.db2.gz FEJFKCBIBBEIJE-OWCLPIDISA-N 1 3 266.473 3.808 20 0 CHADHO CCC[C@@H]1CCCC[N@H+]1[C@H]1CCN[C@@H](C(C)(C)C)C1 ZINC001246787671 1131782374 /nfs/dbraw/zinc/78/23/74/1131782374.db2.gz FEJFKCBIBBEIJE-OWCLPIDISA-N 1 3 266.473 3.808 20 0 CHADHO CCCC[C@H]1C[C@@H]([N@H+](C)CC2CCCCC2)CCN1 ZINC001246843476 1131789766 /nfs/dbraw/zinc/78/97/66/1131789766.db2.gz CPGDQZZKGHKDLV-IRXDYDNUSA-N 1 3 266.473 3.809 20 0 CHADHO CCCC[C@H]1C[C@@H]([N@@H+](C)CC2CCCCC2)CCN1 ZINC001246843476 1131789770 /nfs/dbraw/zinc/78/97/70/1131789770.db2.gz CPGDQZZKGHKDLV-IRXDYDNUSA-N 1 3 266.473 3.809 20 0 CHADHO CNCC[C@H](C)[N@H+](C)C1CCC(C(C)(C)C)CC1 ZINC001246852741 1131789813 /nfs/dbraw/zinc/78/98/13/1131789813.db2.gz GBVJUHBTTYIKOY-NFOMZHRRSA-N 1 3 254.462 3.521 20 0 CHADHO CNCC[C@H](C)[N@@H+](C)C1CCC(C(C)(C)C)CC1 ZINC001246852741 1131789816 /nfs/dbraw/zinc/78/98/16/1131789816.db2.gz GBVJUHBTTYIKOY-NFOMZHRRSA-N 1 3 254.462 3.521 20 0 CHADHO C[C@H]1CC[C@H]([N@H+](C)[C@H]2CCNC3(CCCCC3)C2)CC1 ZINC001247003202 1131840080 /nfs/dbraw/zinc/84/00/80/1131840080.db2.gz MARDVBVTRHZXOC-ULQDDVLXSA-N 1 3 278.484 3.952 20 0 CHADHO C[C@H]1CC[C@H]([N@@H+](C)[C@H]2CCNC3(CCCCC3)C2)CC1 ZINC001247003202 1131840088 /nfs/dbraw/zinc/84/00/88/1131840088.db2.gz MARDVBVTRHZXOC-ULQDDVLXSA-N 1 3 278.484 3.952 20 0 CHADHO CCCCN1CCC([NH2+]Cc2ccc(Cl)cc2)CC1 ZINC000037149912 1132002136 /nfs/dbraw/zinc/00/21/36/1132002136.db2.gz IBDONKXKRLXDHR-UHFFFAOYSA-N 1 3 280.843 3.694 20 0 CHADHO CN1CC[C@@]2(CC[N@H+](Cc3cccc(C(C)(C)C)c3)C2)C1 ZINC001141106303 1132019721 /nfs/dbraw/zinc/01/97/21/1132019721.db2.gz WTQOWRKVURYETJ-LJQANCHMSA-N 1 3 286.463 3.512 20 0 CHADHO CN1CC[C@@]2(CC[N@@H+](Cc3cccc(C(C)(C)C)c3)C2)C1 ZINC001141106303 1132019728 /nfs/dbraw/zinc/01/97/28/1132019728.db2.gz WTQOWRKVURYETJ-LJQANCHMSA-N 1 3 286.463 3.512 20 0 CHADHO CN1C(C)(C)CC([NH2+]CCc2ccc(F)cc2)CC1(C)C ZINC001171617226 1132064887 /nfs/dbraw/zinc/06/48/87/1132064887.db2.gz IGAFPZLFFARSLG-UHFFFAOYSA-N 1 3 292.442 3.609 20 0 CHADHO CN1C(C)(C)CC([NH2+]C(C)(C)c2ccncc2)CC1(C)C ZINC001171626021 1132067976 /nfs/dbraw/zinc/06/79/76/1132067976.db2.gz SHXTXOMJPPYAKA-UHFFFAOYSA-N 1 3 289.467 3.558 20 0 CHADHO CCN1CCC[C@H](C[NH2+][C@@H](C)c2ccc(Cl)s2)C1 ZINC000121814096 1132111594 /nfs/dbraw/zinc/11/15/94/1132111594.db2.gz PUJWOMUCFMILTC-NWDGAFQWSA-N 1 3 286.872 3.784 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1Cc3cccc(Cl)c3C1)C2 ZINC001172127970 1132127227 /nfs/dbraw/zinc/12/72/27/1132127227.db2.gz MKSSUFKQJVUMFJ-FICVDOATSA-N 1 3 290.838 3.671 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1Cc3cccc(Cl)c3C1)C2 ZINC001172127970 1132127231 /nfs/dbraw/zinc/12/72/31/1132127231.db2.gz MKSSUFKQJVUMFJ-FICVDOATSA-N 1 3 290.838 3.671 20 0 CHADHO CCCc1ccc(CN[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172106253 1132130945 /nfs/dbraw/zinc/13/09/45/1132130945.db2.gz OEKRFSXHSTZHPD-LDLYASANSA-N 1 3 286.463 3.744 20 0 CHADHO CCCc1ccc(CN[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172106253 1132130947 /nfs/dbraw/zinc/13/09/47/1132130947.db2.gz OEKRFSXHSTZHPD-LDLYASANSA-N 1 3 286.463 3.744 20 0 CHADHO C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H](NC(C)(C)c1cccc(F)c1)C2 ZINC001172111279 1132132127 /nfs/dbraw/zinc/13/21/27/1132132127.db2.gz RGCQMCNJCITBFC-BJWYYQGGSA-N 1 3 290.426 3.666 20 0 CHADHO C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H](NC(C)(C)c1cccc(F)c1)C2 ZINC001172111279 1132132129 /nfs/dbraw/zinc/13/21/29/1132132129.db2.gz RGCQMCNJCITBFC-BJWYYQGGSA-N 1 3 290.426 3.666 20 0 CHADHO Cc1cc([C@@H](C)N[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)ccc1F ZINC001172119446 1132132939 /nfs/dbraw/zinc/13/29/39/1132132939.db2.gz ZVYNTILIBMFXSH-MXASKKJJSA-N 1 3 290.426 3.800 20 0 CHADHO Cc1cc([C@@H](C)N[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)ccc1F ZINC001172119446 1132132944 /nfs/dbraw/zinc/13/29/44/1132132944.db2.gz ZVYNTILIBMFXSH-MXASKKJJSA-N 1 3 290.426 3.800 20 0 CHADHO CC[C@H](C)OCC[C@H](C)[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001172324985 1132160879 /nfs/dbraw/zinc/16/08/79/1132160879.db2.gz PMXWZFUPBHXZAT-GJZGRUSLSA-N 1 3 298.515 3.821 20 0 CHADHO C[C@@H]1CC[C@@H]([NH+]2C(C)(C)CC(N)CC2(C)C)C[C@H]1C ZINC001172360307 1132188322 /nfs/dbraw/zinc/18/83/22/1132188322.db2.gz RQGSVOXVRRRRMM-UMVBOHGHSA-N 1 3 266.473 3.791 20 0 CHADHO CCC[N@H+](CCCN)C1CCC(Cc2ccccc2)CC1 ZINC001172818869 1132317454 /nfs/dbraw/zinc/31/74/54/1132317454.db2.gz VQLYJJWIACTLOQ-UHFFFAOYSA-N 1 3 288.479 3.849 20 0 CHADHO CCC[N@@H+](CCCN)C1CCC(Cc2ccccc2)CC1 ZINC001172818869 1132317461 /nfs/dbraw/zinc/31/74/61/1132317461.db2.gz VQLYJJWIACTLOQ-UHFFFAOYSA-N 1 3 288.479 3.849 20 0 CHADHO CN1CC2(C1)CC[NH+](C1CCC3(CCCCC3)CC1)CC2 ZINC001173121226 1132401777 /nfs/dbraw/zinc/40/17/77/1132401777.db2.gz MZCPAJQWHXZRFA-UHFFFAOYSA-N 1 3 290.495 3.907 20 0 CHADHO CCC[N@H+](Cc1cc2cnccc2[nH]1)Cc1ccccc1 ZINC001232014455 1132410490 /nfs/dbraw/zinc/41/04/90/1132410490.db2.gz IPGGGKDXEHEDTG-UHFFFAOYSA-N 1 3 279.387 3.975 20 0 CHADHO CCC[N@@H+](Cc1cc2cnccc2[nH]1)Cc1ccccc1 ZINC001232014455 1132410494 /nfs/dbraw/zinc/41/04/94/1132410494.db2.gz IPGGGKDXEHEDTG-UHFFFAOYSA-N 1 3 279.387 3.975 20 0 CHADHO c1c2cnccc2[nH]c1C[N@@H+]1CCCC2(CCCC2)C1 ZINC001232012459 1132411516 /nfs/dbraw/zinc/41/15/16/1132411516.db2.gz JAEJOTCQOJMPCJ-UHFFFAOYSA-N 1 3 269.392 3.719 20 0 CHADHO c1c2cnccc2[nH]c1C[N@H+]1CCCC2(CCCC2)C1 ZINC001232012459 1132411520 /nfs/dbraw/zinc/41/15/20/1132411520.db2.gz JAEJOTCQOJMPCJ-UHFFFAOYSA-N 1 3 269.392 3.719 20 0 CHADHO CC[N@H+](Cc1cc2cnccc2[nH]1)Cc1ccc(C)cc1 ZINC001232017018 1132413459 /nfs/dbraw/zinc/41/34/59/1132413459.db2.gz JRZVPFHZHJWAGK-UHFFFAOYSA-N 1 3 279.387 3.893 20 0 CHADHO CC[N@@H+](Cc1cc2cnccc2[nH]1)Cc1ccc(C)cc1 ZINC001232017018 1132413462 /nfs/dbraw/zinc/41/34/62/1132413462.db2.gz JRZVPFHZHJWAGK-UHFFFAOYSA-N 1 3 279.387 3.893 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@H+](C)C2CCCCC2)c1 ZINC001232143861 1132428198 /nfs/dbraw/zinc/42/81/98/1132428198.db2.gz IUCFWBCGABRVQX-UHFFFAOYSA-N 1 3 278.415 3.652 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@@H+](C)C2CCCCC2)c1 ZINC001232143861 1132428201 /nfs/dbraw/zinc/42/82/01/1132428201.db2.gz IUCFWBCGABRVQX-UHFFFAOYSA-N 1 3 278.415 3.652 20 0 CHADHO CCC(CC)N1CCC([NH2+][C@@H]2CC[C@H](CC)C2)CC1 ZINC001173270180 1132435136 /nfs/dbraw/zinc/43/51/36/1132435136.db2.gz BAZOCPQWCXWKLU-GOEBONIOSA-N 1 3 266.473 3.808 20 0 CHADHO CC[C@H]1CC[C@H](N2CCC([NH3+])(c3ccc(F)cc3)CC2)C1 ZINC001173270600 1132435280 /nfs/dbraw/zinc/43/52/80/1132435280.db2.gz NWOYBUFDCUSRDD-YOEHRIQHSA-N 1 3 290.426 3.654 20 0 CHADHO CC[C@H]1CC[C@H]([NH2+]C2CCN(CC3CCCC3)CC2)C1 ZINC001173270076 1132435403 /nfs/dbraw/zinc/43/54/03/1132435403.db2.gz AGVDDSPGAQCTSK-YJBOKZPZSA-N 1 3 278.484 3.809 20 0 CHADHO CN1CCC[C@H]1CC[NH2+][C@H]1CCCC2(CCCCC2)C1 ZINC001173349786 1132474521 /nfs/dbraw/zinc/47/45/21/1132474521.db2.gz UKWXUEAQWNYKAL-IRXDYDNUSA-N 1 3 278.484 3.953 20 0 CHADHO CC(C)[NH+]1CCC(CN(C)Cc2ccccc2Cl)CC1 ZINC001203382383 1133263802 /nfs/dbraw/zinc/26/38/02/1133263802.db2.gz XRFXOWZHMIRNRV-UHFFFAOYSA-N 1 3 294.870 3.892 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1cccs1 ZINC001204015419 1133398819 /nfs/dbraw/zinc/39/88/19/1133398819.db2.gz AVKROKPBBIPTNB-GJZGRUSLSA-N 1 3 278.465 3.587 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1cccs1 ZINC001204015419 1133398821 /nfs/dbraw/zinc/39/88/21/1133398821.db2.gz AVKROKPBBIPTNB-GJZGRUSLSA-N 1 3 278.465 3.587 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CCC[C@H](N)CC1 ZINC001205087763 1133526290 /nfs/dbraw/zinc/52/62/90/1133526290.db2.gz IVOPILJQTAAZFD-HOTGVXAUSA-N 1 3 252.446 3.572 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CCC[C@H](N)CC1 ZINC001205087763 1133526292 /nfs/dbraw/zinc/52/62/92/1133526292.db2.gz IVOPILJQTAAZFD-HOTGVXAUSA-N 1 3 252.446 3.572 20 0 CHADHO C[C@H]1CN(Cc2cccc(Oc3ccccc3)c2)C[C@H]1C[NH3+] ZINC001205130878 1133534003 /nfs/dbraw/zinc/53/40/03/1133534003.db2.gz NLBNKXFJRCRVAI-DOTOQJQBSA-N 1 3 296.414 3.506 20 0 CHADHO C[C@H]1c2ccccc2CCN1Cc1cc2c(s1)C[NH2+]CC2 ZINC001205164632 1133539533 /nfs/dbraw/zinc/53/95/33/1133539533.db2.gz JXQQRCPLUQCDEL-ZDUSSCGKSA-N 1 3 298.455 3.513 20 0 CHADHO C[C@H]1CCNCC[N@@H+]1Cc1cccc(-c2ccccc2)c1 ZINC001205332334 1133563480 /nfs/dbraw/zinc/56/34/80/1133563480.db2.gz OVUKESXJCXULCD-INIZCTEOSA-N 1 3 280.415 3.537 20 0 CHADHO C[C@H]1CCNCC[N@H+]1Cc1cccc(-c2ccccc2)c1 ZINC001205332334 1133563482 /nfs/dbraw/zinc/56/34/82/1133563482.db2.gz OVUKESXJCXULCD-INIZCTEOSA-N 1 3 280.415 3.537 20 0 CHADHO C[C@@H]1CCNCC[N@@H+]1Cc1cccc(-c2ccccc2)c1 ZINC001205332335 1133563964 /nfs/dbraw/zinc/56/39/64/1133563964.db2.gz OVUKESXJCXULCD-MRXNPFEDSA-N 1 3 280.415 3.537 20 0 CHADHO C[C@@H]1CCNCC[N@H+]1Cc1cccc(-c2ccccc2)c1 ZINC001205332335 1133563966 /nfs/dbraw/zinc/56/39/66/1133563966.db2.gz OVUKESXJCXULCD-MRXNPFEDSA-N 1 3 280.415 3.537 20 0 CHADHO C[C@H]1CCC[C@@H](C[NH2+]CC(C)(C)CN2CCCC2)C1 ZINC001205646159 1133598180 /nfs/dbraw/zinc/59/81/80/1133598180.db2.gz YRMYFNLMUGMGJS-JKSUJKDBSA-N 1 3 266.473 3.524 20 0 CHADHO N[C@H]1CCCC[N@H+](Cc2ccc(-c3ccc(F)cc3)cc2)C1 ZINC001205930852 1133632487 /nfs/dbraw/zinc/63/24/87/1133632487.db2.gz DTRLHTCLQJNZLU-IBGZPJMESA-N 1 3 298.405 3.806 20 0 CHADHO N[C@H]1CCCC[N@@H+](Cc2ccc(-c3ccc(F)cc3)cc2)C1 ZINC001205930852 1133632490 /nfs/dbraw/zinc/63/24/90/1133632490.db2.gz DTRLHTCLQJNZLU-IBGZPJMESA-N 1 3 298.405 3.806 20 0 CHADHO CSc1cccc(Cl)c1CN1CCC(CC[NH3+])CC1 ZINC001206506480 1133711909 /nfs/dbraw/zinc/71/19/09/1133711909.db2.gz BYJAOILIJWBTRK-UHFFFAOYSA-N 1 3 298.883 3.623 20 0 CHADHO C[C@@]1(C[NH3+])CCCCN(Cc2ccc(F)c3ccoc32)C1 ZINC001206573907 1133720634 /nfs/dbraw/zinc/72/06/34/1133720634.db2.gz PDBYDIGQOREVBZ-KRWDZBQOSA-N 1 3 290.382 3.523 20 0 CHADHO CC(C)c1cccc(CN2CCCC[C@](C)(C[NH3+])C2)c1 ZINC001206573214 1133721085 /nfs/dbraw/zinc/72/10/85/1133721085.db2.gz JZSKVFZYRUVEPD-GOSISDBHSA-N 1 3 274.452 3.761 20 0 CHADHO CC(C)N(Cc1cccc(Cl)c1)[C@H]1CCC[NH2+]CC1 ZINC001206580943 1133722408 /nfs/dbraw/zinc/72/24/08/1133722408.db2.gz GNZFMNGOABKBNC-INIZCTEOSA-N 1 3 280.843 3.693 20 0 CHADHO CC(C)N(Cc1cc2ccccc2o1)[C@@H]1CCC[NH2+]CC1 ZINC001206589058 1133723218 /nfs/dbraw/zinc/72/32/18/1133723218.db2.gz FKAPGMPDGQAESI-MRXNPFEDSA-N 1 3 286.419 3.785 20 0 CHADHO CC/C=C\CCCCC[N@@H+]1C[C@@H](CN)CC[C@H]1C ZINC001206761316 1133743255 /nfs/dbraw/zinc/74/32/55/1133743255.db2.gz WTBZLPRLEXPXDY-KSLSASGISA-N 1 3 252.446 3.572 20 0 CHADHO CC/C=C\CCCCC[N@H+]1C[C@@H](CN)CC[C@H]1C ZINC001206761316 1133743258 /nfs/dbraw/zinc/74/32/58/1133743258.db2.gz WTBZLPRLEXPXDY-KSLSASGISA-N 1 3 252.446 3.572 20 0 CHADHO C[C@H]1CC[C@H](C[NH3+])CN1Cc1ccc(F)c2ccccc12 ZINC001206767883 1133745346 /nfs/dbraw/zinc/74/53/46/1133745346.db2.gz FVSBECOTBMGAFL-UONOGXRCSA-N 1 3 286.394 3.538 20 0 CHADHO CN(C)CC(C)(C)C[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001207285362 1133788658 /nfs/dbraw/zinc/78/86/58/1133788658.db2.gz HXYVBSOYQZUKDU-INIZCTEOSA-N 1 3 278.415 3.550 20 0 CHADHO CN(C)CC(C)(C)C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001207285362 1133788665 /nfs/dbraw/zinc/78/86/65/1133788665.db2.gz HXYVBSOYQZUKDU-INIZCTEOSA-N 1 3 278.415 3.550 20 0 CHADHO CC(C)c1ccc(CC[N@H+](C)CCCN2CCCC2)cc1 ZINC001207521331 1133814082 /nfs/dbraw/zinc/81/40/82/1133814082.db2.gz STLFHWVIJJKVSB-UHFFFAOYSA-N 1 3 288.479 3.770 20 0 CHADHO CC(C)c1ccc(CC[N@@H+](C)CCCN2CCCC2)cc1 ZINC001207521331 1133814087 /nfs/dbraw/zinc/81/40/87/1133814087.db2.gz STLFHWVIJJKVSB-UHFFFAOYSA-N 1 3 288.479 3.770 20 0 CHADHO CN(C1CC1)C1CC[NH+](CCCC2CCCCC2)CC1 ZINC001207608692 1133829664 /nfs/dbraw/zinc/82/96/64/1133829664.db2.gz CNYSLGMSTHTLEU-UHFFFAOYSA-N 1 3 278.484 3.906 20 0 CHADHO CCN(CC)CC[C@H]([NH2+][C@@H]1CC[C@H]1C)c1ccccc1 ZINC001207805836 1133849167 /nfs/dbraw/zinc/84/91/67/1133849167.db2.gz KZKUQGIVZBIOQB-NXHRZFHOSA-N 1 3 274.452 3.848 20 0 CHADHO CN(CC1(C[NH+](C)C)CCCC1)[C@@H]1CCc2ccccc21 ZINC001208189670 1133902245 /nfs/dbraw/zinc/90/22/45/1133902245.db2.gz YCRZMHYQGSWGOS-GOSISDBHSA-N 1 3 286.463 3.728 20 0 CHADHO C(C[N@@H+]1CCCC[C@@H]1CCN1CCCC1)C1CCCC1 ZINC001208695386 1133928662 /nfs/dbraw/zinc/92/86/62/1133928662.db2.gz PFTUJGLKAPXFKN-GOSISDBHSA-N 1 3 278.484 3.907 20 0 CHADHO C(C[N@H+]1CCCC[C@@H]1CCN1CCCC1)C1CCCC1 ZINC001208695386 1133928667 /nfs/dbraw/zinc/92/86/67/1133928667.db2.gz PFTUJGLKAPXFKN-GOSISDBHSA-N 1 3 278.484 3.907 20 0 CHADHO CC/C=C\CC[N@@H+]1CCCC[C@H]1C[C@@H]1CCCN1C ZINC001208730251 1133937250 /nfs/dbraw/zinc/93/72/50/1133937250.db2.gz SAJWNVXOPNNXDE-FEFZKZJHSA-N 1 3 264.457 3.682 20 0 CHADHO CC/C=C\CC[N@H+]1CCCC[C@H]1C[C@@H]1CCCN1C ZINC001208730251 1133937252 /nfs/dbraw/zinc/93/72/52/1133937252.db2.gz SAJWNVXOPNNXDE-FEFZKZJHSA-N 1 3 264.457 3.682 20 0 CHADHO c1ccc(CN2CCC[C@H](C[NH+]3CCC4(CC4)CC3)C2)cc1 ZINC001208934340 1133968047 /nfs/dbraw/zinc/96/80/47/1133968047.db2.gz ZZSZLCQPGKKOMA-LJQANCHMSA-N 1 3 298.474 3.775 20 0 CHADHO c1ccc(C[N@H+]2CCC[C@H](CN3CCC4(CC4)CC3)C2)cc1 ZINC001208934340 1133968051 /nfs/dbraw/zinc/96/80/51/1133968051.db2.gz ZZSZLCQPGKKOMA-LJQANCHMSA-N 1 3 298.474 3.775 20 0 CHADHO c1ccc(C[N@@H+]2CCC[C@H](CN3CCC4(CC4)CC3)C2)cc1 ZINC001208934340 1133968056 /nfs/dbraw/zinc/96/80/56/1133968056.db2.gz ZZSZLCQPGKKOMA-LJQANCHMSA-N 1 3 298.474 3.775 20 0 CHADHO CN(C)c1cc(Nc2ccnc(C(C)(C)C)c2)cc[nH+]1 ZINC001213163959 1134433457 /nfs/dbraw/zinc/43/34/57/1134433457.db2.gz DPNUXJBKWJLSRY-UHFFFAOYSA-N 1 3 270.380 3.584 20 0 CHADHO C[NH2+]Cc1cccc(Nc2ccnc(C(C)(C)C)c2)c1F ZINC001216220229 1134810051 /nfs/dbraw/zinc/81/00/51/1134810051.db2.gz KZFYRGOTLAKIJR-UHFFFAOYSA-N 1 3 287.382 3.981 20 0 CHADHO C[C@@H](c1cccc(O[C@@H]2CNCc3ccccc32)c1)[NH+](C)C ZINC001218487965 1135115733 /nfs/dbraw/zinc/11/57/33/1135115733.db2.gz LECCXGKNGLPTRE-IFXJQAMLSA-N 1 3 296.414 3.533 20 0 CHADHO Cc1ccsc1CN1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222161863 1135203333 /nfs/dbraw/zinc/20/33/33/1135203333.db2.gz RTYDLRUXYQYOLL-QGZVFWFLSA-N 1 3 292.492 3.802 20 0 CHADHO CCc1cccc(C)c1CN1CCC[C@@]2(CCC[NH2+]C2)C1 ZINC001222277688 1135217784 /nfs/dbraw/zinc/21/77/84/1135217784.db2.gz QMAFQGGBAHXKHI-LJQANCHMSA-N 1 3 286.463 3.523 20 0 CHADHO c1cc(C2CCCCC2)ccc1CN1CC[C@H]2C[NH2+]CC[C@H]21 ZINC001222624357 1135256035 /nfs/dbraw/zinc/25/60/35/1135256035.db2.gz YQCNUDMIBLWHHI-VQTJNVASSA-N 1 3 298.474 3.918 20 0 CHADHO CC[C@H](NC1CC[NH+](CC2CC2)CC1)c1cccc(C)c1 ZINC000353454280 529584910 /nfs/dbraw/zinc/58/49/10/529584910.db2.gz JMHONMHUNVQOFW-IBGZPJMESA-N 1 3 286.463 3.910 20 0 CHADHO Cc1oc2ccccc2c1C[N@H+]1CCCC12CCN(C)CC2 ZINC000355058067 227355460 /nfs/dbraw/zinc/35/54/60/227355460.db2.gz NNVZLNMETNHHME-UHFFFAOYSA-N 1 3 298.430 3.801 20 0 CHADHO Cc1oc2ccccc2c1C[N@@H+]1CCCC12CCN(C)CC2 ZINC000355058067 227355464 /nfs/dbraw/zinc/35/54/64/227355464.db2.gz NNVZLNMETNHHME-UHFFFAOYSA-N 1 3 298.430 3.801 20 0 CHADHO CCCC[C@H](C)[C@@H](C)[NH2+]C[C@@H]1CCN(CCC)C1 ZINC000574601031 335032620 /nfs/dbraw/zinc/03/26/20/335032620.db2.gz QIKFRSWDGWUANX-XHSDSOJGSA-N 1 3 254.462 3.523 20 0 CHADHO COc1ccc([C@H](C)NCc2ccc(C[NH+](C)C)cc2)cc1 ZINC000171133132 335056369 /nfs/dbraw/zinc/05/63/69/335056369.db2.gz MUCQJEPCEVXVRY-HNNXBMFYSA-N 1 3 298.430 3.608 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]CCCN2CCCC[C@@H]2C)s1 ZINC000019913192 262206161 /nfs/dbraw/zinc/20/61/61/262206161.db2.gz NZAXWRHAJZKZCT-ZFWWWQNUSA-N 1 3 280.481 3.972 20 0 CHADHO CCC[C@@H]([NH2+]CCCN(C)C(C)C)c1ccccc1 ZINC000221908265 262322745 /nfs/dbraw/zinc/32/27/45/262322745.db2.gz BKVDUIKLBZVDFM-QGZVFWFLSA-N 1 3 262.441 3.848 20 0 CHADHO CC[C@H](NCC(C)(C)C[NH+](C)C)c1cccc(C)c1 ZINC000311529315 262338157 /nfs/dbraw/zinc/33/81/57/262338157.db2.gz VRPVJZLHIBBOBB-INIZCTEOSA-N 1 3 262.441 3.624 20 0 CHADHO C[C@@H](c1cccc(F)c1)N1CCC(CCC[NH+](C)C)CC1 ZINC000179698737 260064326 /nfs/dbraw/zinc/06/43/26/260064326.db2.gz IMZUPFXLDYVHBG-HNNXBMFYSA-N 1 3 292.442 3.941 20 0 CHADHO CC[C@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(C)cc1 ZINC000037048146 260065725 /nfs/dbraw/zinc/06/57/25/260065725.db2.gz PTUGUJFWLZWPPQ-FBVQUNGASA-N 1 3 272.436 3.661 20 0 CHADHO CC[C@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(C)cc1 ZINC000037048146 260065727 /nfs/dbraw/zinc/06/57/27/260065727.db2.gz PTUGUJFWLZWPPQ-FBVQUNGASA-N 1 3 272.436 3.661 20 0 CHADHO CC1CCN(CCC[NH2+]C2CCCCCCC2)CC1 ZINC000020022809 170972013 /nfs/dbraw/zinc/97/20/13/170972013.db2.gz MZJXAHVVUFFTNE-UHFFFAOYSA-N 1 3 266.473 3.811 20 0 CHADHO CCCCC[C@H](C)[NH2+]CCCN1CCCC[C@@H]1C ZINC000020553056 171248349 /nfs/dbraw/zinc/24/83/49/171248349.db2.gz KRHOFVWLKKLGMJ-HOTGVXAUSA-N 1 3 254.462 3.809 20 0 CHADHO CCCCCN1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000078776039 177385691 /nfs/dbraw/zinc/38/56/91/177385691.db2.gz TVZUXKBSGSXYMV-KRWDZBQOSA-N 1 3 266.473 3.765 20 0 CHADHO CC(C)C1CCC(C[NH2+][C@@H]2CCN3CCC[C@H]3C2)CC1 ZINC000312455832 260034106 /nfs/dbraw/zinc/03/41/06/260034106.db2.gz PDGJRKSINBDOLA-HIEASXQVSA-N 1 3 278.484 3.665 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+]C[C@H](C)c2cccc(Cl)c2)C1 ZINC000516815502 260132497 /nfs/dbraw/zinc/13/24/97/260132497.db2.gz UGDVLMUQSIOQTL-GJZGRUSLSA-N 1 3 294.870 3.763 20 0 CHADHO C1CCC2(C1)CCCC[C@H]2[NH2+][C@@H]1CCN2CCC[C@@H]2C1 ZINC000312510712 260136050 /nfs/dbraw/zinc/13/60/50/260136050.db2.gz GQUPAMMYNXXQBC-BRWVUGGUSA-N 1 3 276.468 3.706 20 0 CHADHO C[NH2+]CCC1CCN([C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000070188781 260153853 /nfs/dbraw/zinc/15/38/53/260153853.db2.gz LYQPPXPPAXYSHY-ZDUSSCGKSA-N 1 3 280.843 3.723 20 0 CHADHO C[NH2+]CCC1CCN([C@H](C)c2ccccc2Cl)CC1 ZINC000070188991 260153956 /nfs/dbraw/zinc/15/39/56/260153956.db2.gz RVWZOIZCRBRJOX-CYBMUJFWSA-N 1 3 280.843 3.723 20 0 CHADHO CCN(CC)CCC[N@@H+]1CC[C@@H](c2ccccc2C)C1 ZINC000513893363 260185565 /nfs/dbraw/zinc/18/55/65/260185565.db2.gz RUOSILSGLHQGSJ-QGZVFWFLSA-N 1 3 274.452 3.516 20 0 CHADHO CCN(CC)CCC[N@H+]1CC[C@@H](c2ccccc2C)C1 ZINC000513893363 260185567 /nfs/dbraw/zinc/18/55/67/260185567.db2.gz RUOSILSGLHQGSJ-QGZVFWFLSA-N 1 3 274.452 3.516 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1cccc(C(F)(F)F)c1 ZINC000093213057 260273043 /nfs/dbraw/zinc/27/30/43/260273043.db2.gz MKFOVKFKLLIALN-LEWSCRJBSA-N 1 3 286.341 3.626 20 0 CHADHO Cc1cc(C)c(CNC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1C ZINC000088164204 260280646 /nfs/dbraw/zinc/28/06/46/260280646.db2.gz GTFJNJUUMBPYAM-YQQQUEKLSA-N 1 3 286.463 3.717 20 0 CHADHO Cc1cc(C)c(CNC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1C ZINC000088164204 260280648 /nfs/dbraw/zinc/28/06/48/260280648.db2.gz GTFJNJUUMBPYAM-YQQQUEKLSA-N 1 3 286.463 3.717 20 0 CHADHO CC(C)(C)[C@@H](NC[C@@H]1CCC[NH2+]C1)c1ccc(F)cc1 ZINC000130951852 260399683 /nfs/dbraw/zinc/39/96/83/260399683.db2.gz UQQAYABQKXOSPA-CJNGLKHVSA-N 1 3 278.415 3.502 20 0 CHADHO C[C@H](N[C@H]1CCC[NH2+]CC1)c1ccc(C(C)(C)C)cc1 ZINC000133627666 260523679 /nfs/dbraw/zinc/52/36/79/260523679.db2.gz QHQKWHUOPINZNR-YOEHRIQHSA-N 1 3 274.452 3.777 20 0 CHADHO CN1CCCC[C@H]1CC[N@H+](C)CC1(c2ccccc2)CC1 ZINC000444686191 261065785 /nfs/dbraw/zinc/06/57/85/261065785.db2.gz BUPSZLNDUVGHLB-SFHVURJKSA-N 1 3 286.463 3.524 20 0 CHADHO CN1CCCC[C@H]1CC[N@@H+](C)CC1(c2ccccc2)CC1 ZINC000444686191 261065786 /nfs/dbraw/zinc/06/57/86/261065786.db2.gz BUPSZLNDUVGHLB-SFHVURJKSA-N 1 3 286.463 3.524 20 0 CHADHO CC(C)[N@H+](C)Cc1cccc(CN[C@@H](C)c2ccncc2)c1 ZINC000156516879 261124751 /nfs/dbraw/zinc/12/47/51/261124751.db2.gz ACHAWBHZNQSNFU-INIZCTEOSA-N 1 3 297.446 3.773 20 0 CHADHO CC(C)[N@@H+](C)Cc1cccc(CN[C@@H](C)c2ccncc2)c1 ZINC000156516879 261124752 /nfs/dbraw/zinc/12/47/52/261124752.db2.gz ACHAWBHZNQSNFU-INIZCTEOSA-N 1 3 297.446 3.773 20 0 CHADHO C[C@@H](CCCC[NH3+])N[C@@H](C)c1ccccc1Cl ZINC000310566615 262167066 /nfs/dbraw/zinc/16/70/66/262167066.db2.gz XUQCODZHCSMJRC-RYUDHWBXSA-N 1 3 254.805 3.508 20 0 CHADHO COc1cccc([C@H](C)[NH2+]CCCN2CCCC[C@@H]2C)c1 ZINC000019913096 262178001 /nfs/dbraw/zinc/17/80/01/262178001.db2.gz FDXRLHVYSHFSOA-HOTGVXAUSA-N 1 3 290.451 3.610 20 0 CHADHO C[C@H](C[NH2+]C[C@@H]1C[C@@H]1c1ccccc1)CN1CCCCC1 ZINC000503031154 262236748 /nfs/dbraw/zinc/23/67/48/262236748.db2.gz CIOZUEFZNYRGBT-NZSAHSFTSA-N 1 3 286.463 3.502 20 0 CHADHO CC(C)[C@H]1C[C@@H](NCCC[NH+](C(C)C)C(C)C)CS1 ZINC000488454842 262325705 /nfs/dbraw/zinc/32/57/05/262325705.db2.gz ZTEYUEMCTFVBIM-HZPDHXFCSA-N 1 3 286.529 3.615 20 0 CHADHO Cc1nc(C)c([C@@H](C)[NH2+]C2CCN(CC(C)C)CC2)s1 ZINC000221943349 262332842 /nfs/dbraw/zinc/33/28/42/262332842.db2.gz HNFAFKUXQQWYQC-CYBMUJFWSA-N 1 3 295.496 3.531 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+][C@@H]1CCCc2sccc21 ZINC000061324531 262394098 /nfs/dbraw/zinc/39/40/98/262394098.db2.gz YFBSIWLQXVZCIZ-GDBMZVCRSA-N 1 3 292.492 3.980 20 0 CHADHO CC[C@@H](NCC1=CC[N@H+](C)CC1)c1cccc(Cl)c1F ZINC000274049766 263021191 /nfs/dbraw/zinc/02/11/91/263021191.db2.gz LALHSBYMNDZSAX-OAHLLOKOSA-N 1 3 296.817 3.782 20 0 CHADHO CC[C@@H](NCC1=CC[N@@H+](C)CC1)c1cccc(Cl)c1F ZINC000274049766 263021192 /nfs/dbraw/zinc/02/11/92/263021192.db2.gz LALHSBYMNDZSAX-OAHLLOKOSA-N 1 3 296.817 3.782 20 0 CHADHO C[C@H]1C[C@H](CN)C[N@@H+]1CC1CCC(c2ccccc2)CC1 ZINC000414661609 263023790 /nfs/dbraw/zinc/02/37/90/263023790.db2.gz OXVFWZMKFASTBX-SDDULXJBSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@H]1C[C@H](CN)C[N@H+]1CC1CCC(c2ccccc2)CC1 ZINC000414661609 263023791 /nfs/dbraw/zinc/02/37/91/263023791.db2.gz OXVFWZMKFASTBX-SDDULXJBSA-N 1 3 286.463 3.630 20 0 CHADHO CCSc1cccc(CN(CC)[C@@H]2CCC[NH2+]CC2)c1 ZINC000414713381 263033967 /nfs/dbraw/zinc/03/39/67/263033967.db2.gz KGACNIIGWLWBRV-MRXNPFEDSA-N 1 3 292.492 3.763 20 0 CHADHO C[C@@H](CCC(F)(F)F)[NH2+]CCNC1CCCCCC1 ZINC000414798963 263050407 /nfs/dbraw/zinc/05/04/07/263050407.db2.gz CURSCDJIQHIDSO-LBPRGKRZSA-N 1 3 280.378 3.619 20 0 CHADHO CC1(c2ccccc2)CCC([NH2+][C@@H]2CCC[C@@H]2CN)CC1 ZINC000414807072 263052233 /nfs/dbraw/zinc/05/22/33/263052233.db2.gz QRJLICGQVIIAEB-ZTRSQXPZSA-N 1 3 286.463 3.604 20 0 CHADHO COc1ccccc1/C=C\CNCc1ccc([C@@H](C)[NH3+])cc1 ZINC000414808137 263052580 /nfs/dbraw/zinc/05/25/80/263052580.db2.gz KIIKUTSTNHLZGB-ZQMJAJRESA-N 1 3 296.414 3.518 20 0 CHADHO CCC([NH3+])(CC)CN[C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC000414810414 263052788 /nfs/dbraw/zinc/05/27/88/263052788.db2.gz NVCRQLOFOBSCDS-SJORKVTESA-N 1 3 274.452 3.604 20 0 CHADHO C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@@H](C)[C@@H]1CCCNC1 ZINC000414827682 263055775 /nfs/dbraw/zinc/05/57/75/263055775.db2.gz YDOOGPVZEJMZRA-IXDOHACOSA-N 1 3 288.479 3.721 20 0 CHADHO C[C@@H]([NH2+]C1CCC(C(C)(C)C)CC1)[C@H]1CCCNC1 ZINC000414844898 263059410 /nfs/dbraw/zinc/05/94/10/263059410.db2.gz DFJWESYDCHYPCG-QVOMUQBLSA-N 1 3 266.473 3.569 20 0 CHADHO C[C@@H]([NH2+]C1CCC(c2ccccc2)CC1)[C@H]1CCCNC1 ZINC000414855001 263071512 /nfs/dbraw/zinc/07/15/12/263071512.db2.gz MOYKHYXMNYDPAX-IZIZEDOESA-N 1 3 286.463 3.691 20 0 CHADHO C[C@@H](CCc1ccccc1)NCC1([NH3+])CCCCCC1 ZINC000414856871 263073333 /nfs/dbraw/zinc/07/33/33/263073333.db2.gz BCXAUBVMAXJIIH-INIZCTEOSA-N 1 3 274.452 3.649 20 0 CHADHO C[C@@H](CCc1ccsc1)NCC1([NH3+])CCCCCC1 ZINC000414858458 263074609 /nfs/dbraw/zinc/07/46/09/263074609.db2.gz JLSTZMJDPNKEAW-AWEZNQCLSA-N 1 3 280.481 3.711 20 0 CHADHO NC1(C[NH2+]Cc2ccc(F)c(-c3cccs3)c2)CCC1 ZINC000414879770 263095100 /nfs/dbraw/zinc/09/51/00/263095100.db2.gz IVJWOOUYEZBGIC-UHFFFAOYSA-N 1 3 290.407 3.525 20 0 CHADHO c1ccc(C2CCC(C[NH2+][C@@H]3CCCNCC3)CC2)cc1 ZINC000414916845 263120853 /nfs/dbraw/zinc/12/08/53/263120853.db2.gz PFDNHKKFFALEFE-NKELODKYSA-N 1 3 286.463 3.692 20 0 CHADHO C[C@@H](NCCCCC[NH+]1CCCC1)c1ccc(Cl)nc1 ZINC000293827725 263150613 /nfs/dbraw/zinc/15/06/13/263150613.db2.gz WVBOARVHISPHHI-CQSZACIVSA-N 1 3 295.858 3.652 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]1c1ccccc1Cl ZINC000414948127 263155885 /nfs/dbraw/zinc/15/58/85/263155885.db2.gz XQXOOYUTORPPCO-QIJZBDPFSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@H]1CNCC[C@H]1[NH2+]Cc1cc(-c2ccccc2)cs1 ZINC000414966349 263169484 /nfs/dbraw/zinc/16/94/84/263169484.db2.gz WLUCLMUIEYHYKI-SUMWQHHRSA-N 1 3 286.444 3.503 20 0 CHADHO C[C@H](CCC[NH3+])NCc1ccc(-c2ccccc2)cc1F ZINC000415026414 263256303 /nfs/dbraw/zinc/25/63/03/263256303.db2.gz UHBBSGCMZBYDQQ-CQSZACIVSA-N 1 3 286.394 3.710 20 0 CHADHO Cc1ccc(CN[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)s1 ZINC000415086961 263271626 /nfs/dbraw/zinc/27/16/26/263271626.db2.gz SILJKQGHXCRXNP-NVXWUHKLSA-N 1 3 286.444 3.639 20 0 CHADHO Cc1ccccc1C1(CN[C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)CC1 ZINC000415098976 263273468 /nfs/dbraw/zinc/27/34/68/263273468.db2.gz GHEUQXRWFDXJHW-QXAKKESOSA-N 1 3 298.474 3.537 20 0 CHADHO CCc1cc(NC2CC[NH+](C3CC3)CC2)c2ccccc2n1 ZINC000123385739 263812958 /nfs/dbraw/zinc/81/29/58/263812958.db2.gz LQBAKZLGHWHBRG-UHFFFAOYSA-N 1 3 295.430 3.836 20 0 CHADHO CCSc1ccccc1[C@H](C)[NH2+]C[C@@H](C)CN(C)C ZINC000425952055 264070882 /nfs/dbraw/zinc/07/08/82/264070882.db2.gz RPGSMIPQGUTECH-KGLIPLIRSA-N 1 3 280.481 3.647 20 0 CHADHO C[C@H](CC[N@@H+]1CCC[C@@H]2CN(C)CC[C@@H]21)c1ccccc1 ZINC000519129548 265328495 /nfs/dbraw/zinc/32/84/95/265328495.db2.gz BEAUVYDUYNOUIN-QRQLOZEOSA-N 1 3 286.463 3.596 20 0 CHADHO C[C@H](CC[N@H+]1CCC[C@@H]2CN(C)CC[C@@H]21)c1ccccc1 ZINC000519129548 265328497 /nfs/dbraw/zinc/32/84/97/265328497.db2.gz BEAUVYDUYNOUIN-QRQLOZEOSA-N 1 3 286.463 3.596 20 0 CHADHO C[N@@H+]1CCCC[C@H]1CCN1CCC[C@@H]1c1cccs1 ZINC000356853079 266191699 /nfs/dbraw/zinc/19/16/99/266191699.db2.gz NSTPVJFXHFBDBV-LSDHHAIUSA-N 1 3 278.465 3.759 20 0 CHADHO C[N@H+]1CCCC[C@H]1CCN1CCC[C@@H]1c1cccs1 ZINC000356853079 266191702 /nfs/dbraw/zinc/19/17/02/266191702.db2.gz NSTPVJFXHFBDBV-LSDHHAIUSA-N 1 3 278.465 3.759 20 0 CHADHO CN1CCCC[C@@H]1CC[NH+]1CCC(c2ccsc2)CC1 ZINC000362604938 267020132 /nfs/dbraw/zinc/02/01/32/267020132.db2.gz YJCGXHWIOMLRNF-QGZVFWFLSA-N 1 3 292.492 3.802 20 0 CHADHO CN1CCCC[C@H]1CC[NH+]1CCC(c2ccsc2)CC1 ZINC000362604937 267020733 /nfs/dbraw/zinc/02/07/33/267020733.db2.gz YJCGXHWIOMLRNF-KRWDZBQOSA-N 1 3 292.492 3.802 20 0 CHADHO C([NH2+]C1CCN(C2CCCCC2)CC1)[C@H]1CCCSC1 ZINC000376817462 268020434 /nfs/dbraw/zinc/02/04/34/268020434.db2.gz BTHQSISJXBWJFI-OAHLLOKOSA-N 1 3 296.524 3.516 20 0 CHADHO Cc1cc(NCC[NH+]2CCCCCC2)c2ccccc2n1 ZINC000040433112 327906847 /nfs/dbraw/zinc/90/68/47/327906847.db2.gz FOYDMRCSEUVHGB-UHFFFAOYSA-N 1 3 283.419 3.831 20 0 CHADHO c1ccc([C@H](NCCC[NH+]2CCCCC2)C2CC2)cc1 ZINC000041075329 328026724 /nfs/dbraw/zinc/02/67/24/328026724.db2.gz NMQBCBHFDIEVKG-SFHVURJKSA-N 1 3 272.436 3.603 20 0 CHADHO CC[NH+]1CCC(N[C@@H]2CCCc3ccc(Cl)cc32)CC1 ZINC000534236535 328039434 /nfs/dbraw/zinc/03/94/34/328039434.db2.gz XBNLCZSJHNNEEI-QGZVFWFLSA-N 1 3 292.854 3.791 20 0 CHADHO CCN(Cc1cc2ccccc2s1)[C@H]1CCC[NH2+]CC1 ZINC000414717350 328216379 /nfs/dbraw/zinc/21/63/79/328216379.db2.gz PUASMHDXWDBHTK-HNNXBMFYSA-N 1 3 288.460 3.865 20 0 CHADHO C[N@H+]([C@H]1CC[C@](C)(c2ccccc2)C1)[C@@H]1CCCNCC1 ZINC000414754751 328220340 /nfs/dbraw/zinc/22/03/40/328220340.db2.gz SCZHGSWZSQHRDX-QYZOEREBSA-N 1 3 286.463 3.571 20 0 CHADHO C[N@@H+]([C@H]1CC[C@](C)(c2ccccc2)C1)[C@@H]1CCCNCC1 ZINC000414754751 328220342 /nfs/dbraw/zinc/22/03/42/328220342.db2.gz SCZHGSWZSQHRDX-QYZOEREBSA-N 1 3 286.463 3.571 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[C@H](Cc2ccccc2)C1 ZINC000414794246 328229147 /nfs/dbraw/zinc/22/91/47/328229147.db2.gz FMZNOHHLRNATFA-HCXYKTFWSA-N 1 3 286.463 3.505 20 0 CHADHO CC1(C)Cc2occc2[C@H](NCc2ccc(C[NH3+])cc2)C1 ZINC000575803895 328234969 /nfs/dbraw/zinc/23/49/69/328234969.db2.gz SNLBEXLSRPMWPC-MRXNPFEDSA-N 1 3 284.403 3.542 20 0 CHADHO Cc1ccc(-c2ccc(C[NH2+]C[C@H](N)C3CC3)s2)cc1 ZINC000414892969 328252109 /nfs/dbraw/zinc/25/21/09/328252109.db2.gz JXDXLUCVGFWKEU-INIZCTEOSA-N 1 3 286.444 3.550 20 0 CHADHO [NH3+][C@H]1CCC[C@@H](NCc2ccc(-c3ccccc3)s2)C1 ZINC000414934581 328274918 /nfs/dbraw/zinc/27/49/18/328274918.db2.gz XWINRXNXEVCOGL-LSDHHAIUSA-N 1 3 286.444 3.775 20 0 CHADHO Cc1cccc2c1[C@@H](C)C[C@@H]2NC1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000296064919 328288803 /nfs/dbraw/zinc/28/88/03/328288803.db2.gz WESDGZPMESYEEW-DOEQRONASA-N 1 3 284.447 3.758 20 0 CHADHO Cc1cccc2c1[C@@H](C)C[C@@H]2NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000296064919 328288804 /nfs/dbraw/zinc/28/88/04/328288804.db2.gz WESDGZPMESYEEW-DOEQRONASA-N 1 3 284.447 3.758 20 0 CHADHO c1ccc([C@H](CC2CC2)NC[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000531937755 328319687 /nfs/dbraw/zinc/31/96/87/328319687.db2.gz UDHUOACEFPSEIX-APWZRJJASA-N 1 3 284.447 3.602 20 0 CHADHO c1ccc([C@H](CC2CC2)NC[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000531937755 328319689 /nfs/dbraw/zinc/31/96/89/328319689.db2.gz UDHUOACEFPSEIX-APWZRJJASA-N 1 3 284.447 3.602 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCc3c2cccc3Cl)C1 ZINC000531995139 328387567 /nfs/dbraw/zinc/38/75/67/328387567.db2.gz APZTVSYVVXSZQS-AHIWAGSCSA-N 1 3 292.854 3.790 20 0 CHADHO C[C@@H](c1ccc2ccccc2c1)[N@@H+]1CC[C@@](C)(CN)C1 ZINC000261719421 327028032 /nfs/dbraw/zinc/02/80/32/327028032.db2.gz KBBHSVLPYREGSH-KSSFIOAISA-N 1 3 268.404 3.572 20 0 CHADHO C[C@@H](c1ccc2ccccc2c1)[N@H+]1CC[C@@](C)(CN)C1 ZINC000261719421 327028034 /nfs/dbraw/zinc/02/80/34/327028034.db2.gz KBBHSVLPYREGSH-KSSFIOAISA-N 1 3 268.404 3.572 20 0 CHADHO C[C@@H](c1ccc2ccccc2c1)N1CC[C@@](C)(C[NH3+])C1 ZINC000261719421 327028035 /nfs/dbraw/zinc/02/80/35/327028035.db2.gz KBBHSVLPYREGSH-KSSFIOAISA-N 1 3 268.404 3.572 20 0 CHADHO COc1ccccc1[C@H](CC(C)C)N[C@H]1CCC[C@@H]([NH3+])C1 ZINC000565843271 327035473 /nfs/dbraw/zinc/03/54/73/327035473.db2.gz LWSLUZGUCUWSEO-VYDXJSESSA-N 1 3 290.451 3.642 20 0 CHADHO CCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000558419119 327092464 /nfs/dbraw/zinc/09/24/64/327092464.db2.gz IAYGWNXIBULGGZ-ZACQAIPSSA-N 1 3 266.473 3.665 20 0 CHADHO CCN(C[C@@H]1CCC[NH2+]C1)[C@H](C)c1cc2ccccc2o1 ZINC000261594992 327141181 /nfs/dbraw/zinc/14/11/81/327141181.db2.gz CBARAJXPEPIUGS-HUUCEWRRSA-N 1 3 286.419 3.815 20 0 CHADHO CC(C)C[C@H](C)C[N@@H+]1CCC[C@H](N2CCCC2)CC1 ZINC000410378048 327188749 /nfs/dbraw/zinc/18/87/49/327188749.db2.gz KASZIEKUFYVOLV-IRXDYDNUSA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)C[C@H](C)C[N@H+]1CCC[C@H](N2CCCC2)CC1 ZINC000410378048 327188750 /nfs/dbraw/zinc/18/87/50/327188750.db2.gz KASZIEKUFYVOLV-IRXDYDNUSA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)C[C@H](C)CN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000410378048 327188751 /nfs/dbraw/zinc/18/87/51/327188751.db2.gz KASZIEKUFYVOLV-IRXDYDNUSA-N 1 3 266.473 3.619 20 0 CHADHO CCN(CC)C[C@H]1CC[N@H+](CC(C(C)C)C(C)C)C1 ZINC000560258261 327294697 /nfs/dbraw/zinc/29/46/97/327294697.db2.gz VFFVHLXFUPRPNX-MRXNPFEDSA-N 1 3 268.489 3.578 20 0 CHADHO CCN(CC)C[C@H]1CC[N@@H+](CC(C(C)C)C(C)C)C1 ZINC000560258261 327294698 /nfs/dbraw/zinc/29/46/98/327294698.db2.gz VFFVHLXFUPRPNX-MRXNPFEDSA-N 1 3 268.489 3.578 20 0 CHADHO CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000560550157 327323808 /nfs/dbraw/zinc/32/38/08/327323808.db2.gz VAXHAPCYSUGSNW-MVJTYMMSSA-N 1 3 278.484 3.664 20 0 CHADHO CN(C)Cc1ccc(C[NH2+][C@@H]2CC[C@H]2C(C)(C)C)cc1 ZINC000570505081 327596534 /nfs/dbraw/zinc/59/65/34/327596534.db2.gz YKNLUJUFBWXLRJ-IAGOWNOFSA-N 1 3 274.452 3.663 20 0 CHADHO CCC(CC)(CC)CN1CCC([NH2+]CC2CC2)CC1 ZINC000395192479 328633293 /nfs/dbraw/zinc/63/32/93/328633293.db2.gz QSQZDROUOHKMLU-UHFFFAOYSA-N 1 3 266.473 3.667 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN(CC[C@@H](C)c2ccccc2)C1 ZINC000194021898 329064976 /nfs/dbraw/zinc/06/49/76/329064976.db2.gz LGAADYDXDSBSLC-MSOLQXFVSA-N 1 3 288.479 3.844 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN(CC[C@@H](C)c2ccccc2)C1 ZINC000194021898 329064977 /nfs/dbraw/zinc/06/49/77/329064977.db2.gz LGAADYDXDSBSLC-MSOLQXFVSA-N 1 3 288.479 3.844 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+](CC[C@@H](C)c2ccccc2)C1 ZINC000194021898 329064978 /nfs/dbraw/zinc/06/49/78/329064978.db2.gz LGAADYDXDSBSLC-MSOLQXFVSA-N 1 3 288.479 3.844 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+](CC[C@@H](C)c2ccccc2)C1 ZINC000194021898 329064979 /nfs/dbraw/zinc/06/49/79/329064979.db2.gz LGAADYDXDSBSLC-MSOLQXFVSA-N 1 3 288.479 3.844 20 0 CHADHO Cc1nc(C)c([C@H](C)[NH2+]C[C@H]2CCCN(C(C)C)C2)s1 ZINC000178750441 329200383 /nfs/dbraw/zinc/20/03/83/329200383.db2.gz ANDOYULKJARJPH-SWLSCSKDSA-N 1 3 295.496 3.531 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000583131557 329319010 /nfs/dbraw/zinc/31/90/10/329319010.db2.gz SWQGEOYVNMMIDD-GBBGEASQSA-N 1 3 286.463 3.641 20 0 CHADHO Clc1ccc(C2(NC[C@H]3CCC[NH2+]C3)CCCC2)cc1 ZINC000469983312 329327055 /nfs/dbraw/zinc/32/70/55/329327055.db2.gz QOSVKVZQWHSIFA-AWEZNQCLSA-N 1 3 292.854 3.699 20 0 CHADHO Clc1ccc(C2([NH2+]C[C@H]3CCCNC3)CCCC2)cc1 ZINC000469983312 329327057 /nfs/dbraw/zinc/32/70/57/329327057.db2.gz QOSVKVZQWHSIFA-AWEZNQCLSA-N 1 3 292.854 3.699 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H](C)CN1CCCCC1)c1cccs1 ZINC000038041903 329354990 /nfs/dbraw/zinc/35/49/90/329354990.db2.gz FUZITBBRBCARQU-HUUCEWRRSA-N 1 3 280.481 3.911 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N[C@H](C)c1ccncc1Cl ZINC000421805877 330081437 /nfs/dbraw/zinc/08/14/37/330081437.db2.gz YBDHBCLMFMUJQA-UONOGXRCSA-N 1 3 297.874 3.896 20 0 CHADHO CC[C@@H](C[NH2+][C@@H](C)c1ccc(CN)nc1C)c1ccccc1 ZINC000422707543 330151493 /nfs/dbraw/zinc/15/14/93/330151493.db2.gz AIJYGMAVGHETOS-HOCLYGCPSA-N 1 3 297.446 3.693 20 0 CHADHO CC(C)Sc1ccc([C@@H](C)[NH2+]C2CCNCC2)cc1 ZINC000422711659 330151503 /nfs/dbraw/zinc/15/15/03/330151503.db2.gz HIAYPMYAXTWUNC-CYBMUJFWSA-N 1 3 278.465 3.590 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+]CCCCCOC1CCCCC1 ZINC000422710149 330151559 /nfs/dbraw/zinc/15/15/59/330151559.db2.gz LAICYMDDYLZTPN-WMZOPIPTSA-N 1 3 296.499 3.613 20 0 CHADHO CC(C)Sc1ccc([C@H](C)N[C@H](C)C[C@H](C)[NH3+])cc1 ZINC000422715438 330151775 /nfs/dbraw/zinc/15/17/75/330151775.db2.gz MDBKRHZRSNOMOA-MJBXVCDLSA-N 1 3 280.481 3.964 20 0 CHADHO Cc1ccccc1[C@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)C(C)C ZINC000422718932 330152017 /nfs/dbraw/zinc/15/20/17/330152017.db2.gz YCNYQTLYVCFQHN-IXEWLPCDSA-N 1 3 272.436 3.565 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CCCCC(C)(C)C ZINC000422718210 330152133 /nfs/dbraw/zinc/15/21/33/330152133.db2.gz PIXPAMRXTQUYLF-ZDUSSCGKSA-N 1 3 277.456 3.716 20 0 CHADHO Cc1[nH]c2ccc(C[NH2+][C@H]3CCCCC[C@@H]3N)cc2c1C ZINC000422724782 330152565 /nfs/dbraw/zinc/15/25/65/330152565.db2.gz WOIPYZHCVJLRAH-WMZOPIPTSA-N 1 3 285.435 3.534 20 0 CHADHO C[C@H]([NH2+][C@@H](CC1CCCCC1)C(C)(C)C)C1CNC1 ZINC000422748445 330153186 /nfs/dbraw/zinc/15/31/86/330153186.db2.gz UQQBFADPKWSVBZ-BBRMVZONSA-N 1 3 266.473 3.569 20 0 CHADHO C[C@@H](N)C[C@H](C)[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000422752921 330153314 /nfs/dbraw/zinc/15/33/14/330153314.db2.gz HWXNFPQQHZRGLA-CVEARBPZSA-N 1 3 282.431 3.534 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCC(c1ccccc1)c1ccccc1 ZINC000422752921 330153316 /nfs/dbraw/zinc/15/33/16/330153316.db2.gz HWXNFPQQHZRGLA-CVEARBPZSA-N 1 3 282.431 3.534 20 0 CHADHO CCCC1CCC([NH2+][C@H](C)c2ccc(CN)nc2C)CC1 ZINC000422751930 330153489 /nfs/dbraw/zinc/15/34/89/330153489.db2.gz DHRLLDFFCMAOFQ-IUDNXUCKSA-N 1 3 289.467 3.858 20 0 CHADHO NC[C@H]1CCC[C@@H]1[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000422756555 330153759 /nfs/dbraw/zinc/15/37/59/330153759.db2.gz LSKOTMUOBXJVRW-QUCCMNQESA-N 1 3 294.442 3.536 20 0 CHADHO C[C@@H](N[C@@H](C)C[C@H](C)[NH3+])c1cccc2ccccc21 ZINC000422773211 330154272 /nfs/dbraw/zinc/15/42/72/330154272.db2.gz ZLVZVVPNXHAEAV-MELADBBJSA-N 1 3 256.393 3.616 20 0 CHADHO Fc1ccc([C@H](N[C@@H]2CCC[NH2+]CC2)C2CCCC2)cc1 ZINC000422775391 330154584 /nfs/dbraw/zinc/15/45/84/330154584.db2.gz BMFPKOCKNXDYBM-QZTJIDSGSA-N 1 3 290.426 3.789 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+][C@@H](C)C[C@H](C)N ZINC000422776239 330154704 /nfs/dbraw/zinc/15/47/04/330154704.db2.gz CJABMMVFURGADC-YQQAZPJKSA-N 1 3 262.441 3.503 20 0 CHADHO CCCC[C@H](CC)C[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000422743680 330155265 /nfs/dbraw/zinc/15/52/65/330155265.db2.gz IYHKMYKRWKVWQI-HIFRSBDPSA-N 1 3 277.456 3.716 20 0 CHADHO CC(C)[C@H](N[C@@H](C)C1C[NH2+]C1)c1ccc(C(C)(C)C)cc1 ZINC000422793641 330155495 /nfs/dbraw/zinc/15/54/95/330155495.db2.gz XFXJQRIMCIEFID-KSSFIOAISA-N 1 3 288.479 3.879 20 0 CHADHO CC(C)[C@H]([NH2+][C@@H](C)C1CNC1)c1ccc(C(C)(C)C)cc1 ZINC000422793641 330155497 /nfs/dbraw/zinc/15/54/97/330155497.db2.gz XFXJQRIMCIEFID-KSSFIOAISA-N 1 3 288.479 3.879 20 0 CHADHO CC(C)[C@H](N[C@H](C)C1C[NH2+]C1)c1ccc(C(C)(C)C)cc1 ZINC000422793640 330155538 /nfs/dbraw/zinc/15/55/38/330155538.db2.gz XFXJQRIMCIEFID-KDOFPFPSSA-N 1 3 288.479 3.879 20 0 CHADHO CC(C)[C@H]([NH2+][C@H](C)C1CNC1)c1ccc(C(C)(C)C)cc1 ZINC000422793640 330155539 /nfs/dbraw/zinc/15/55/39/330155539.db2.gz XFXJQRIMCIEFID-KDOFPFPSSA-N 1 3 288.479 3.879 20 0 CHADHO C1C[C@@H]2C[C@H]([NH2+][C@H]3CCC[C@H]3[C@H]3CCCCN3)CC[C@@H]2C1 ZINC000422792627 330155579 /nfs/dbraw/zinc/15/55/79/330155579.db2.gz RCOIGXUTGQJEQE-OXKKCRRXSA-N 1 3 290.495 3.856 20 0 CHADHO C1C[C@@H]2CC[C@@H]([NH2+][C@H]3CCC[C@H]3[C@H]3CCCCN3)C[C@H]2C1 ZINC000422792626 330155590 /nfs/dbraw/zinc/15/55/90/330155590.db2.gz RCOIGXUTGQJEQE-KSCVBYKOSA-N 1 3 290.495 3.856 20 0 CHADHO C[C@H]1CCNCC[C@@H]1[NH2+]C1CCC(c2ccccc2)CC1 ZINC000422801256 330155637 /nfs/dbraw/zinc/15/56/37/330155637.db2.gz BOBKAKIKHPNCLC-RXQRSOPUSA-N 1 3 286.463 3.691 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H](C)[C@@H](C)c1ccccc1 ZINC000422817709 330156290 /nfs/dbraw/zinc/15/62/90/330156290.db2.gz DUTJQQCPEDKKSW-ILXRZTDVSA-N 1 3 297.446 3.692 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CCCC1CCCCC1 ZINC000422851540 330157393 /nfs/dbraw/zinc/15/73/93/330157393.db2.gz XBEXCABVZHDVLK-AWEZNQCLSA-N 1 3 289.467 3.860 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC[C@H](C)c1ccccc1 ZINC000422849920 330157424 /nfs/dbraw/zinc/15/74/24/330157424.db2.gz MOEFYJJCDGDCJT-GJZGRUSLSA-N 1 3 297.446 3.693 20 0 CHADHO CC[C@H](N[C@H](C)C[C@H](C)[NH3+])c1cccc(Cl)c1 ZINC000422853786 330157441 /nfs/dbraw/zinc/15/74/41/330157441.db2.gz CGSRYKIIPPFYLQ-WDMOLILDSA-N 1 3 254.805 3.507 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](C)Cc1ccc(Cl)cc1Cl ZINC000422864866 330158107 /nfs/dbraw/zinc/15/81/07/330158107.db2.gz WPHWWYONDHPRPY-AXFHLTTASA-N 1 3 289.250 3.640 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+][C@@H](C)Cc1ccc(Cl)cc1Cl ZINC000422864866 330158109 /nfs/dbraw/zinc/15/81/09/330158109.db2.gz WPHWWYONDHPRPY-AXFHLTTASA-N 1 3 289.250 3.640 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NC[C@@H](C)c1c(Cl)cccc1Cl ZINC000422882743 330158926 /nfs/dbraw/zinc/15/89/26/330158926.db2.gz TTXVCWYEGISGCA-OUAUKWLOSA-N 1 3 289.250 3.812 20 0 CHADHO CC[C@@H](N[C@H](C)CCC[NH3+])c1ccccc1Br ZINC000422892162 330159107 /nfs/dbraw/zinc/15/91/07/330159107.db2.gz MKGDNRKUTBXFGI-BXUZGUMPSA-N 1 3 299.256 3.617 20 0 CHADHO [NH3+][C@H]1CCCCC[C@H]1NCC1(Sc2ccccc2)CC1 ZINC000422901731 330162187 /nfs/dbraw/zinc/16/21/87/330162187.db2.gz CARHZGPQJHIFTM-JKSUJKDBSA-N 1 3 290.476 3.561 20 0 CHADHO c1ccc([C@H]2C[C@H](N[C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)C2)cc1 ZINC000422968668 330164706 /nfs/dbraw/zinc/16/47/06/330164706.db2.gz RTRBKUSCIKASKP-VYJAJWGXSA-N 1 3 298.474 3.833 20 0 CHADHO Cc1cccc([C@H](N[C@@H](C)CCCC[NH3+])c2ccccn2)c1 ZINC000423030778 330166230 /nfs/dbraw/zinc/16/62/30/330166230.db2.gz WHJKOLLKKVDUDX-LPHOPBHVSA-N 1 3 297.446 3.587 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](CC1CCC1)c1ccccc1 ZINC000423043249 330166702 /nfs/dbraw/zinc/16/67/02/330166702.db2.gz OAENPAOWVDRSOK-ZQIUZPCESA-N 1 3 260.425 3.633 20 0 CHADHO CC(C)[C@@H]1CCc2ccccc2[C@@H]1N[C@H](C)[C@H]1CC[NH2+]C1 ZINC000423049265 330167209 /nfs/dbraw/zinc/16/72/09/330167209.db2.gz JSUHHASWYQRQFO-QSOKESPWSA-N 1 3 286.463 3.534 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)C[C@H](C)N)c1ccc(C(F)(F)F)cc1 ZINC000423056472 330167490 /nfs/dbraw/zinc/16/74/90/330167490.db2.gz FXRYKYNNUUDWDY-SRVKXCTJSA-N 1 3 288.357 3.524 20 0 CHADHO C[C@@H](CN[C@@H](C)C[C@H](C)[NH3+])c1ccc(C(F)(F)F)cc1 ZINC000423056472 330167492 /nfs/dbraw/zinc/16/74/92/330167492.db2.gz FXRYKYNNUUDWDY-SRVKXCTJSA-N 1 3 288.357 3.524 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@H]1N[C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423099764 330170175 /nfs/dbraw/zinc/17/01/75/330170175.db2.gz UGOJGIJWPHJIHL-MWQQHZPXSA-N 1 3 292.854 3.836 20 0 CHADHO C[C@@]1(CN[C@H]2C[C@H]([NH3+])c3ccccc32)C[C@H]1c1ccccc1 ZINC000423132980 330171903 /nfs/dbraw/zinc/17/19/03/330171903.db2.gz JTUKESQKTGUGOK-MUGJNUQGSA-N 1 3 292.426 3.915 20 0 CHADHO c1ccc([C@@H]2C[C@H]2C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCCN2)cc1 ZINC000423138453 330172313 /nfs/dbraw/zinc/17/23/13/330172313.db2.gz STYZJRVKVNKCIL-PXTPFGJHSA-N 1 3 298.474 3.691 20 0 CHADHO Cc1csc(CN[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC000423146388 330172562 /nfs/dbraw/zinc/17/25/62/330172562.db2.gz AMBNJBKTVVJMPK-NVXWUHKLSA-N 1 3 286.444 3.639 20 0 CHADHO C[C@@H]1CCNCC[C@@H]1[NH2+]C[C@@H]1CCC[C@H]1c1ccccc1 ZINC000423159374 330173615 /nfs/dbraw/zinc/17/36/15/330173615.db2.gz OYIDKJAXJVIXFE-BVBHFADKSA-N 1 3 286.463 3.548 20 0 CHADHO [NH3+][C@@H]1C[C@H](NC[C@H]2CCC[C@@H]2C2CC2)c2ccccc21 ZINC000423169660 330174276 /nfs/dbraw/zinc/17/42/76/330174276.db2.gz JYTJKUPNPFUKMK-DTDBQYNISA-N 1 3 270.420 3.547 20 0 CHADHO N[C@H]1CCCCC[C@H]1[NH2+][C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000423172173 330174466 /nfs/dbraw/zinc/17/44/66/330174466.db2.gz RREDUPNXZUJVLI-AQNFWKISSA-N 1 3 296.817 3.585 20 0 CHADHO [NH3+]CCCN[C@@H](Cc1ccc(Cl)cc1)c1ccccc1 ZINC000423177154 330175036 /nfs/dbraw/zinc/17/50/36/330175036.db2.gz AMBISKJKZOPMRD-KRWDZBQOSA-N 1 3 288.822 3.562 20 0 CHADHO CCc1ccc([C@@H](C)[NH2+]CC2(N)CCCCC2)s1 ZINC000423184491 330175642 /nfs/dbraw/zinc/17/56/42/330175642.db2.gz UBBLVOXYANSRIY-GFCCVEGCSA-N 1 3 266.454 3.623 20 0 CHADHO C[C@H](N[C@@H](C)[C@@H]1CCC[NH2+]C1)c1cc2c(s1)CCCC2 ZINC000423212631 330177971 /nfs/dbraw/zinc/17/79/71/330177971.db2.gz ISTMZNPDKRJUAD-KCQAQPDRSA-N 1 3 292.492 3.666 20 0 CHADHO C[C@H]([NH2+][C@@H](C)[C@@H]1CCCNC1)c1cc2c(s1)CCCC2 ZINC000423212631 330177972 /nfs/dbraw/zinc/17/79/72/330177972.db2.gz ISTMZNPDKRJUAD-KCQAQPDRSA-N 1 3 292.492 3.666 20 0 CHADHO C[C@H](N[C@H]1CCCc2c(Cl)cccc21)[C@@H]1CCC[NH2+]C1 ZINC000423215671 330178791 /nfs/dbraw/zinc/17/87/91/330178791.db2.gz NJNHLWDHNSBFBE-AHIWAGSCSA-N 1 3 292.854 3.695 20 0 CHADHO CCc1ccc([C@H](CC)N[C@H](C)[C@@H]2CCC[NH2+]C2)cc1 ZINC000423221916 330179705 /nfs/dbraw/zinc/17/97/05/330179705.db2.gz YRQZVBQNPKEVNM-OLMNPRSZSA-N 1 3 274.452 3.678 20 0 CHADHO CCc1ccc([C@H](CC)[NH2+][C@H](C)[C@@H]2CCCNC2)cc1 ZINC000423221916 330179706 /nfs/dbraw/zinc/17/97/06/330179706.db2.gz YRQZVBQNPKEVNM-OLMNPRSZSA-N 1 3 274.452 3.678 20 0 CHADHO CC(C)[C@H](NCC[C@H](C)[NH3+])c1ccc(C(F)(F)F)cc1 ZINC000423224625 330180125 /nfs/dbraw/zinc/18/01/25/330180125.db2.gz JQADXVQDUSKCPY-FZMZJTMJSA-N 1 3 288.357 3.729 20 0 CHADHO Cc1nc(-c2ccccc2)sc1[C@@H](C)NCC[C@H](C)[NH3+] ZINC000423228387 330180267 /nfs/dbraw/zinc/18/02/67/330180267.db2.gz ZKVQABRPKVLMBQ-NWDGAFQWSA-N 1 3 289.448 3.506 20 0 CHADHO C[C@@H](NCC[C@H](C)[NH3+])c1ccc(-c2ccccc2F)s1 ZINC000423228323 330180399 /nfs/dbraw/zinc/18/03/99/330180399.db2.gz ZDNJUEWINMKCJA-NWDGAFQWSA-N 1 3 292.423 3.942 20 0 CHADHO C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CC[C@H](C)N ZINC000423228241 330180461 /nfs/dbraw/zinc/18/04/61/330180461.db2.gz YWLGRZZLQOMYOQ-UONOGXRCSA-N 1 3 287.451 3.551 20 0 CHADHO C[C@H](CC(C)(C)c1c[nH]c2ccccc21)NCC[C@H](C)[NH3+] ZINC000423228241 330180462 /nfs/dbraw/zinc/18/04/62/330180462.db2.gz YWLGRZZLQOMYOQ-UONOGXRCSA-N 1 3 287.451 3.551 20 0 CHADHO Fc1ccc([C@H](NCC[C@H]2CC[NH2+]C2)c2ccccc2)cc1 ZINC000423243017 330181934 /nfs/dbraw/zinc/18/19/34/330181934.db2.gz GBDLMWUVMAFVJI-DNVCBOLYSA-N 1 3 298.405 3.504 20 0 CHADHO C[C@@H](NCC[C@@H]1CC[NH2+]C1)c1cc(Cl)ccc1Cl ZINC000423249616 330182562 /nfs/dbraw/zinc/18/25/62/330182562.db2.gz PAIVBGVLWKEHBB-MNOVXSKESA-N 1 3 287.234 3.644 20 0 CHADHO CC(C)[C@H](N)C[NH2+][C@H](C)c1cc2ccccc2s1 ZINC000423262975 330183741 /nfs/dbraw/zinc/18/37/41/330183741.db2.gz ACUMTLDWJZLPRI-DGCLKSJQSA-N 1 3 262.422 3.535 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+][C@H]2CCCC[C@@H]2CN)c2sccc21 ZINC000423267246 330184532 /nfs/dbraw/zinc/18/45/32/330184532.db2.gz CPJJAPDLRFEWLZ-UXOAXIEHSA-N 1 3 278.465 3.794 20 0 CHADHO C[C@@H]1CC[C@H](N[C@H]2CCCC[C@@H]2C[NH3+])c2sccc21 ZINC000423267246 330184533 /nfs/dbraw/zinc/18/45/33/330184533.db2.gz CPJJAPDLRFEWLZ-UXOAXIEHSA-N 1 3 278.465 3.794 20 0 CHADHO CC(C)C[C@H](CN)[NH2+][C@H]1C[C@H](C)Sc2sccc21 ZINC000423271489 330184698 /nfs/dbraw/zinc/18/46/98/330184698.db2.gz XUBAEWPGFOGRMA-LOWVWBTDSA-N 1 3 284.494 3.637 20 0 CHADHO CC(C)[C@@H](N)C[NH2+][C@H](C)c1ccc(F)c2ccccc21 ZINC000423275434 330185089 /nfs/dbraw/zinc/18/50/89/330185089.db2.gz NFTCPJVIGCUNIT-PXAZEXFGSA-N 1 3 274.383 3.613 20 0 CHADHO C[C@@H]([NH2+]CC(C)(C)N)c1cccc(-c2ccccc2)c1 ZINC000423288467 330186625 /nfs/dbraw/zinc/18/66/25/330186625.db2.gz SFOJHYDNOOIVAP-CQSZACIVSA-N 1 3 268.404 3.742 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2ccccc2N(C)C)cc1 ZINC000423290078 330186661 /nfs/dbraw/zinc/18/66/61/330186661.db2.gz CHYFIWZBLVBVQS-CABCVRRESA-N 1 3 297.446 3.623 20 0 CHADHO Cc1cccc2c1CC[C@@H]2NCc1ccc([C@H](C)[NH3+])cc1 ZINC000423290105 330186932 /nfs/dbraw/zinc/18/69/32/330186932.db2.gz CKGHPSOATYRGDY-LIRRHRJNSA-N 1 3 280.415 3.792 20 0 CHADHO Cc1ccsc1[C@H](C)NCc1ccc([C@@H](C)[NH3+])cc1 ZINC000423290561 330186945 /nfs/dbraw/zinc/18/69/45/330186945.db2.gz DNOUNEJKAJTHIC-OLZOCXBDSA-N 1 3 274.433 3.927 20 0 CHADHO Cc1ccccc1[C@H](C)NCc1ccc([C@H](C)[NH3+])cc1 ZINC000423292507 330187714 /nfs/dbraw/zinc/18/77/14/330187714.db2.gz NFMJUDUXRNXIII-GJZGRUSLSA-N 1 3 268.404 3.866 20 0 CHADHO Cc1ccc2c(c1)[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)CC2 ZINC000423292860 330187794 /nfs/dbraw/zinc/18/77/94/330187794.db2.gz ORVGPTWPWBWQSB-AUUYWEPGSA-N 1 3 280.415 3.792 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2ccc(F)cc2)cc1 ZINC000423294503 330187937 /nfs/dbraw/zinc/18/79/37/330187937.db2.gz UNEGSEVDRXJRTH-CHWSQXEVSA-N 1 3 272.367 3.696 20 0 CHADHO CCC([NH3+])(CC)CN[C@H](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000423293699 330187973 /nfs/dbraw/zinc/18/79/73/330187973.db2.gz RZAKOJDFGAUVJK-CHWSQXEVSA-N 1 3 282.859 3.939 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@H]2CCCOc3ccccc32)cc1 ZINC000423295179 330188210 /nfs/dbraw/zinc/18/82/10/330188210.db2.gz WINKCJLCAQSGFI-KSSFIOAISA-N 1 3 296.414 3.710 20 0 CHADHO C[C@H](CN)C[NH2+][C@@H]1CCC[C@@H](c2ccc(Cl)cc2)C1 ZINC000423306552 330189285 /nfs/dbraw/zinc/18/92/85/330189285.db2.gz LTPODZDPOAKKRX-XNRPHZJLSA-N 1 3 280.843 3.551 20 0 CHADHO C[C@H](C[NH3+])CN[C@@H](C)c1ccc(-c2cccs2)cc1 ZINC000423304393 330189297 /nfs/dbraw/zinc/18/92/97/330189297.db2.gz YPZFAIQQMCMXDE-OLZOCXBDSA-N 1 3 274.433 3.661 20 0 CHADHO C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)NC[C@@H]([NH3+])C1CC1 ZINC000423322197 330190344 /nfs/dbraw/zinc/19/03/44/330190344.db2.gz NVDVOAQMLGCRRF-SUMWQHHRSA-N 1 3 299.462 3.551 20 0 CHADHO C[C@@H]([NH2+]C[C@H](N)C1CC1)c1ccc(-c2cccs2)cc1 ZINC000423323182 330190681 /nfs/dbraw/zinc/19/06/81/330190681.db2.gz ONKXWJVQQZDCRY-WBMJQRKESA-N 1 3 286.444 3.803 20 0 CHADHO CC(C)CC[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)C(C)(C)C ZINC000423374694 330190848 /nfs/dbraw/zinc/19/08/48/330190848.db2.gz IABFEPPXDPLTKB-KFWWJZLASA-N 1 3 254.462 3.567 20 0 CHADHO Cc1cc(C)c([C@@H](C)NC[C@]2(C)CCC[NH2+]C2)cc1C ZINC000423344319 330192210 /nfs/dbraw/zinc/19/22/10/330192210.db2.gz XQACXLYFPYOWSW-SJLPKXTDSA-N 1 3 274.452 3.652 20 0 CHADHO Cc1cc(C)c([C@@H](C)[NH2+]C[C@]2(C)CCCNC2)cc1C ZINC000423344319 330192211 /nfs/dbraw/zinc/19/22/11/330192211.db2.gz XQACXLYFPYOWSW-SJLPKXTDSA-N 1 3 274.452 3.652 20 0 CHADHO Fc1ccccc1[C@H](NCC1=CC[NH2+]CC1)C1CCCC1 ZINC000423348391 330192633 /nfs/dbraw/zinc/19/26/33/330192633.db2.gz SVUKMRZVJAHNCF-GOSISDBHSA-N 1 3 288.410 3.566 20 0 CHADHO Cc1ccc([C@H](NCC2=CC[NH2+]CC2)c2ccccc2)cc1 ZINC000423348169 330192652 /nfs/dbraw/zinc/19/26/52/330192652.db2.gz RYXQPASYUOJKPP-HXUWFJFHSA-N 1 3 292.426 3.594 20 0 CHADHO Clc1cccc([C@@H]2CCC[C@H](NC[C@H]3CC[NH2+]C3)C2)c1 ZINC000423351868 330192899 /nfs/dbraw/zinc/19/28/99/330192899.db2.gz ZSLITBMRCFPXSN-LXZKKBNFSA-N 1 3 292.854 3.565 20 0 CHADHO C[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccc(Cl)cc1 ZINC000423356150 330193367 /nfs/dbraw/zinc/19/33/67/330193367.db2.gz JEOMKWQJHQEGIK-LBPRGKRZSA-N 1 3 286.806 3.794 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)C1 ZINC000423364898 330194400 /nfs/dbraw/zinc/19/44/00/330194400.db2.gz KBXDTZXRZKRABX-PQEBFOHHSA-N 1 3 292.854 3.836 20 0 CHADHO C[C@@H](NCC[C@H]1CCC[NH2+]1)[C@H](C)c1ccc(Cl)cc1 ZINC000423365920 330194573 /nfs/dbraw/zinc/19/45/73/330194573.db2.gz WXCJYTCXPLILFH-WOSRLPQWSA-N 1 3 280.843 3.564 20 0 CHADHO CC[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1cccc(OC)c1 ZINC000423366165 330194731 /nfs/dbraw/zinc/19/47/31/330194731.db2.gz BPYRJMRACSCBRZ-IBGZPJMESA-N 1 3 296.414 3.539 20 0 CHADHO C[C@@H]([NH2+][C@H]1CCN[C@H](C)C1)c1ccc2ccccc2c1 ZINC000423372763 330195386 /nfs/dbraw/zinc/19/53/86/330195386.db2.gz ITGJSFDGAYFCKR-LBTNJELSSA-N 1 3 268.404 3.631 20 0 CHADHO Cc1cc(C)cc([C@H](C)NCc2ccc3c(c2)C[NH2+]C3)c1 ZINC000423396822 330195655 /nfs/dbraw/zinc/19/56/55/330195655.db2.gz SSUGVTFJVNTPNF-HNNXBMFYSA-N 1 3 280.415 3.757 20 0 CHADHO CC(C)Cc1ccc([C@H](C)[NH2+][C@@H]2CCN[C@H](C)C2)cc1 ZINC000423399350 330195927 /nfs/dbraw/zinc/19/59/27/330195927.db2.gz VTNVWUOSJKTIML-RVKKMQEKSA-N 1 3 274.452 3.676 20 0 CHADHO COc1ccc([C@H](C)[NH2+][C@H]2CCN[C@H](C)C2)c2ccccc12 ZINC000423401235 330196194 /nfs/dbraw/zinc/19/61/94/330196194.db2.gz XAYGVSNLIANUAE-ILXRZTDVSA-N 1 3 298.430 3.640 20 0 CHADHO CC(C)[C@@H]([NH2+]Cc1ccc2c(c1)CNC2)c1ccccc1 ZINC000423403904 330196308 /nfs/dbraw/zinc/19/63/08/330196308.db2.gz XKDODHPOIQTENO-LJQANCHMSA-N 1 3 280.415 3.777 20 0 CHADHO Cc1ccc([C@H](N[C@H]2CCC[C@@H]([NH3+])C2)C2CCCC2)o1 ZINC000423404681 330196850 /nfs/dbraw/zinc/19/68/50/330196850.db2.gz XOOYUNITADJUGF-HLLBOEOZSA-N 1 3 276.424 3.679 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+][C@@H]1CCC[C@H](N)C1 ZINC000423374271 330198577 /nfs/dbraw/zinc/19/85/77/330198577.db2.gz SOIRHTLUZNZCAI-GVAFMPQTSA-N 1 3 280.843 3.692 20 0 CHADHO CC(C)[C@H](Cc1ccccc1)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423381958 330199428 /nfs/dbraw/zinc/19/94/28/330199428.db2.gz JQHZJWYITDMJCU-FQEVSTJZSA-N 1 3 294.442 3.647 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)N[C@@H]1CC[NH2+][C@H](C)C1 ZINC000423387374 330199932 /nfs/dbraw/zinc/19/99/32/330199932.db2.gz SBSBFOOAMSLIAH-NUJGCVRESA-N 1 3 274.452 3.812 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)[NH2+][C@@H]1CCN[C@H](C)C1 ZINC000423387374 330199934 /nfs/dbraw/zinc/19/99/34/330199934.db2.gz SBSBFOOAMSLIAH-NUJGCVRESA-N 1 3 274.452 3.812 20 0 CHADHO C[C@@H](CN)[NH2+][C@H](Cc1ccccc1Cl)c1ccsc1 ZINC000423388322 330200125 /nfs/dbraw/zinc/20/01/25/330200125.db2.gz IOAWLYYXRGAHNK-XHDPSFHLSA-N 1 3 294.851 3.622 20 0 CHADHO CCCCOc1ccc([C@H](C)[NH2+][C@H]2CCNC[C@H]2C)cc1 ZINC000423392705 330200672 /nfs/dbraw/zinc/20/06/72/330200672.db2.gz LTMVCKVZZBXQKR-VKJFTORMSA-N 1 3 290.451 3.514 20 0 CHADHO C[C@@H](CCC[NH3+])N[C@@H](C)c1ccc(Oc2ccccc2)cn1 ZINC000423445079 330202047 /nfs/dbraw/zinc/20/20/47/330202047.db2.gz BOYSUMRUDFPUET-GJZGRUSLSA-N 1 3 299.418 3.652 20 0 CHADHO C[C@@H](N)[C@H](C)[NH2+][C@@H](C)c1ccc(OCc2ccccc2)cc1 ZINC000423450197 330202921 /nfs/dbraw/zinc/20/29/21/330202921.db2.gz SQNUXXPOMRWULY-PMPSAXMXSA-N 1 3 298.430 3.652 20 0 CHADHO C[C@@H](N)[C@@H](C)[NH2+][C@@H](C)c1ccc(-c2ccc(F)cc2)s1 ZINC000423449788 330202941 /nfs/dbraw/zinc/20/29/41/330202941.db2.gz SDELTIGUQTVCPK-UTUOFQBUSA-N 1 3 292.423 3.941 20 0 CHADHO CCC[C@H]([NH2+][C@H](C)[C@H](C)N)c1ccc(Cl)cc1 ZINC000423454142 330203455 /nfs/dbraw/zinc/20/34/55/330203455.db2.gz YQSKOLCZQHUZHW-WDMOLILDSA-N 1 3 254.805 3.507 20 0 CHADHO CC(C)Oc1ccc([C@H](C)[NH2+][C@@H](C)[C@H](C)N)cc1Cl ZINC000423466332 330204554 /nfs/dbraw/zinc/20/45/54/330204554.db2.gz NKSRGEKWOJSCEU-SRVKXCTJSA-N 1 3 284.831 3.514 20 0 CHADHO CC[C@@H](C)[C@@H](C)[NH2+]C[C@@H]1CNCC[C@@H]1c1ccc(F)cc1 ZINC000423476796 330205651 /nfs/dbraw/zinc/20/56/51/330205651.db2.gz RNJVPBKKWDWSLW-AHEZYBDSSA-N 1 3 292.442 3.543 20 0 CHADHO [NH3+]C[C@@H]1CC[C@@H](N[C@@H]2CCc3cc(Cl)cc(Cl)c32)C1 ZINC000423485685 330206929 /nfs/dbraw/zinc/20/69/29/330206929.db2.gz BDGIKLQBNXLGGX-GAJTVXKRSA-N 1 3 299.245 3.698 20 0 CHADHO C[C@H](N[C@H]1CC[C@H](C[NH3+])C1)c1ccc(Cl)cc1Cl ZINC000423485289 330206964 /nfs/dbraw/zinc/20/69/64/330206964.db2.gz AZJXGJWJPLALGN-NHCYSSNCSA-N 1 3 287.234 3.771 20 0 CHADHO COc1ccc([C@H](C)N[C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423494259 330207506 /nfs/dbraw/zinc/20/75/06/330207506.db2.gz AJZURGZOWWWEHA-KXBFYZLASA-N 1 3 298.430 3.826 20 0 CHADHO C[C@@H](N[C@H](CCC[NH3+])c1ccccc1)c1cccc(F)c1 ZINC000423496400 330207855 /nfs/dbraw/zinc/20/78/55/330207855.db2.gz DPRXIKGKGQETTK-RDTXWAMCSA-N 1 3 286.394 3.957 20 0 CHADHO [NH3+]CCC[C@@H](N[C@H]1CCc2c1cccc2F)c1ccccc1 ZINC000423495782 330207968 /nfs/dbraw/zinc/20/79/68/330207968.db2.gz CQJKQVDTWBMKBH-MOPGFXCFSA-N 1 3 298.405 3.883 20 0 CHADHO C[C@@H](NCCC1=CC[NH2+]CC1)c1ccc(Cl)cc1Cl ZINC000423544352 330211407 /nfs/dbraw/zinc/21/14/07/330211407.db2.gz CPNQSFAKTIHFNO-LLVKDONJSA-N 1 3 299.245 3.954 20 0 CHADHO C[C@H]([NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1)[C@@H]1C[C@H]1C1CC1 ZINC000527691046 330279301 /nfs/dbraw/zinc/27/93/01/330279301.db2.gz KRPASNXYEMJJRW-NCTLDZBQSA-N 1 3 290.495 3.664 20 0 CHADHO CCC[C@H](C[NH2+]C1CCN(C2CCCCC2)CC1)OCC ZINC000527744989 330280257 /nfs/dbraw/zinc/28/02/57/330280257.db2.gz MNIWNOHWYXKXEA-GOSISDBHSA-N 1 3 296.499 3.578 20 0 CHADHO CC[C@H](N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cc(C)ccc1C ZINC000527817355 330282788 /nfs/dbraw/zinc/28/27/88/330282788.db2.gz CMXISNXUNAQDHN-LMMKCTJWSA-N 1 3 286.463 3.971 20 0 CHADHO CC[C@H](N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(C)ccc1C ZINC000527817355 330282789 /nfs/dbraw/zinc/28/27/89/330282789.db2.gz CMXISNXUNAQDHN-LMMKCTJWSA-N 1 3 286.463 3.971 20 0 CHADHO CC(C)c1cccc([C@H](C)N[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC000527864593 330285452 /nfs/dbraw/zinc/28/54/52/330285452.db2.gz JLSOBHCONSWPNG-MPGHIAIKSA-N 1 3 274.452 3.943 20 0 CHADHO CC(C)c1cccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC000527864593 330285453 /nfs/dbraw/zinc/28/54/53/330285453.db2.gz JLSOBHCONSWPNG-MPGHIAIKSA-N 1 3 274.452 3.943 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](C)c2cccc(C(C)C)c2)C1 ZINC000527844243 330287424 /nfs/dbraw/zinc/28/74/24/330287424.db2.gz AJMWGYPYGPFQOF-CVEARBPZSA-N 1 3 274.452 3.802 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](C)c2cccc(C(C)C)c2)C1 ZINC000527844243 330287425 /nfs/dbraw/zinc/28/74/25/330287425.db2.gz AJMWGYPYGPFQOF-CVEARBPZSA-N 1 3 274.452 3.802 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](C)c2cccc(C(C)C)c2)C1 ZINC000527844243 330287426 /nfs/dbraw/zinc/28/74/26/330287426.db2.gz AJMWGYPYGPFQOF-CVEARBPZSA-N 1 3 274.452 3.802 20 0 CHADHO CC[C@H](C)[C@H](C)[NH2+][C@@H](C)c1ccc(OCCN(C)C)cc1 ZINC000536878744 330313342 /nfs/dbraw/zinc/31/33/42/330313342.db2.gz STKSPPQOTGZJLN-JYJNAYRXSA-N 1 3 292.467 3.712 20 0 CHADHO CC(C)[NH+]1CCC(N[C@@H](c2cccs2)C2CC2)CC1 ZINC000044298155 330327233 /nfs/dbraw/zinc/32/72/33/330327233.db2.gz NOMVOLLYQJNCEU-MRXNPFEDSA-N 1 3 278.465 3.662 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCCC[C@H]1N)c1ccc(Cl)cc1 ZINC000424289218 330334271 /nfs/dbraw/zinc/33/42/71/330334271.db2.gz BQKLZBNIZNWLKQ-QLFBSQMISA-N 1 3 266.816 3.651 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CCCC[C@H]1N)c1cccc(C(F)(F)F)c1 ZINC000424378183 330348916 /nfs/dbraw/zinc/34/89/16/330348916.db2.gz SPTIISXWVPRKRB-LERXQTSPSA-N 1 3 286.341 3.626 20 0 CHADHO Cc1cc([C@H](C)NC2CC[NH+](C3CC3)CC2)cc(C)c1F ZINC000119732789 330377764 /nfs/dbraw/zinc/37/77/64/330377764.db2.gz DXTNYYPYWNBSBL-AWEZNQCLSA-N 1 3 290.426 3.720 20 0 CHADHO C[C@H](N[C@H]1CCCC[C@@H]1C[NH3+])c1cccc(Cl)c1 ZINC000089140004 330380799 /nfs/dbraw/zinc/38/07/99/330380799.db2.gz MUZQWDAOIPKCBH-LNSITVRQSA-N 1 3 266.816 3.508 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]C2CCN([C@@H]3CCCC[C@H]3C)CC2)C1 ZINC000437063036 330692165 /nfs/dbraw/zinc/69/21/65/330692165.db2.gz DSJVOUVAOHXSCG-XYVMCAHJSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1cc(F)cc(F)c1 ZINC000449177468 330903884 /nfs/dbraw/zinc/90/38/84/330903884.db2.gz VTCSNAQJLAYUJD-OAUYIBNBSA-N 1 3 296.405 3.531 20 0 CHADHO C1CC2(C1)CCC[C@@H]2[NH2+]C1CCN(C2CCCC2)CC1 ZINC000449189872 330904939 /nfs/dbraw/zinc/90/49/39/330904939.db2.gz VHDDPFCYAVJDEZ-KRWDZBQOSA-N 1 3 276.468 3.706 20 0 CHADHO C[C@@H]1CC[C@H](N[C@@H]2CC[N@@H+]3CCCC[C@H]23)c2sccc21 ZINC000453070131 331086333 /nfs/dbraw/zinc/08/63/33/331086333.db2.gz ZZEMZJHAGNGXOS-DMRZNYOFSA-N 1 3 290.476 3.903 20 0 CHADHO C[C@@H]1CC[C@H](N[C@@H]2CC[N@H+]3CCCC[C@H]23)c2sccc21 ZINC000453070131 331086334 /nfs/dbraw/zinc/08/63/34/331086334.db2.gz ZZEMZJHAGNGXOS-DMRZNYOFSA-N 1 3 290.476 3.903 20 0 CHADHO C1CC1[C@@H]([NH2+]C1CCN(C2CCCC2)CC1)C1CCC1 ZINC000453140642 331093423 /nfs/dbraw/zinc/09/34/23/331093423.db2.gz SAGMBFVZHVVOQU-SFHVURJKSA-N 1 3 276.468 3.562 20 0 CHADHO CCC1([NH2+]C2CCN([C@@H]3CCCC[C@H]3C)CC2)CC1 ZINC000453290024 331111656 /nfs/dbraw/zinc/11/16/56/331111656.db2.gz NAQOLSHILFLDIR-GDBMZVCRSA-N 1 3 264.457 3.562 20 0 CHADHO CCC1(NC2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)CC1 ZINC000453290024 331111657 /nfs/dbraw/zinc/11/16/57/331111657.db2.gz NAQOLSHILFLDIR-GDBMZVCRSA-N 1 3 264.457 3.562 20 0 CHADHO CC1(c2ccccc2)CC(NC2CC([NH+]3CCCCC3)C2)C1 ZINC000459523427 331285919 /nfs/dbraw/zinc/28/59/19/331285919.db2.gz JCNXUOYKQCBLEA-UHFFFAOYSA-N 1 3 298.474 3.713 20 0 CHADHO CC[C@H](NCC[C@H]1CCC[N@H+](C)C1)c1ccccc1F ZINC000459724237 331295863 /nfs/dbraw/zinc/29/58/63/331295863.db2.gz AKIMHFIXFLXIJE-PBHICJAKSA-N 1 3 278.415 3.598 20 0 CHADHO CC[C@H](NCC[C@H]1CCC[N@@H+](C)C1)c1ccccc1F ZINC000459724237 331295864 /nfs/dbraw/zinc/29/58/64/331295864.db2.gz AKIMHFIXFLXIJE-PBHICJAKSA-N 1 3 278.415 3.598 20 0 CHADHO CC[NH+]1CCC(NCc2ccc(C3CCCC3)cc2)CC1 ZINC000462778867 331328529 /nfs/dbraw/zinc/32/85/29/331328529.db2.gz LGVPPZBPRVDWKG-UHFFFAOYSA-N 1 3 286.463 3.918 20 0 CHADHO Cc1cc(N(C)CC[C@@H]2CCCC[N@@H+]2C)c2ccccc2n1 ZINC000463077326 331339703 /nfs/dbraw/zinc/33/97/03/331339703.db2.gz KMRXQGDXWBYEHT-INIZCTEOSA-N 1 3 297.446 3.854 20 0 CHADHO Cc1cc(N(C)CC[C@@H]2CCCC[N@H+]2C)c2ccccc2n1 ZINC000463077326 331339704 /nfs/dbraw/zinc/33/97/04/331339704.db2.gz KMRXQGDXWBYEHT-INIZCTEOSA-N 1 3 297.446 3.854 20 0 CHADHO CC1CCN(CCC[NH2+][C@H]2CS[C@@H](C(C)(C)C)C2)CC1 ZINC000488445279 332009429 /nfs/dbraw/zinc/00/94/29/332009429.db2.gz DXIRGLCLBZTTOX-HZPDHXFCSA-N 1 3 298.540 3.618 20 0 CHADHO CC1CC[NH+](CCCN[C@H]2CS[C@@H](C(C)(C)C)C2)CC1 ZINC000488445279 332009431 /nfs/dbraw/zinc/00/94/31/332009431.db2.gz DXIRGLCLBZTTOX-HZPDHXFCSA-N 1 3 298.540 3.618 20 0 CHADHO CC(C)[C@H]1CCCN1CCC[N@@H+]1CCC[C@@H]1C(C)C ZINC000488722392 332022639 /nfs/dbraw/zinc/02/26/39/332022639.db2.gz GSJNYQBQBQQZBG-IAGOWNOFSA-N 1 3 266.473 3.617 20 0 CHADHO CC(C)[C@H]1CCCN1CCC[N@H+]1CCC[C@@H]1C(C)C ZINC000488722392 332022640 /nfs/dbraw/zinc/02/26/40/332022640.db2.gz GSJNYQBQBQQZBG-IAGOWNOFSA-N 1 3 266.473 3.617 20 0 CHADHO CN(C[C@H]1CCC[N@H+](C)C1)[C@@H]1CCc2c1cccc2Cl ZINC000489839741 332069952 /nfs/dbraw/zinc/06/99/52/332069952.db2.gz UWZBWUQRUGSDPK-SUMWQHHRSA-N 1 3 292.854 3.601 20 0 CHADHO CN(C[C@H]1CCC[N@@H+](C)C1)[C@@H]1CCc2c1cccc2Cl ZINC000489839741 332069953 /nfs/dbraw/zinc/06/99/53/332069953.db2.gz UWZBWUQRUGSDPK-SUMWQHHRSA-N 1 3 292.854 3.601 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H]2c3cc(C)ccc3C[C@@H]2C)C1 ZINC000490172054 332083566 /nfs/dbraw/zinc/08/35/66/332083566.db2.gz JYJGEVBSOGESMN-FRQCXROJSA-N 1 3 286.463 3.550 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H]2c3cc(C)ccc3C[C@@H]2C)C1 ZINC000490172054 332083567 /nfs/dbraw/zinc/08/35/67/332083567.db2.gz JYJGEVBSOGESMN-FRQCXROJSA-N 1 3 286.463 3.550 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H]2c3cc(C)ccc3C[C@@H]2C)C1 ZINC000490172054 332083569 /nfs/dbraw/zinc/08/35/69/332083569.db2.gz JYJGEVBSOGESMN-FRQCXROJSA-N 1 3 286.463 3.550 20 0 CHADHO C1=CC[C@@H](CN2CCC[C@@H](C[NH+]3CCCCCC3)C2)CC1 ZINC000513411450 333017893 /nfs/dbraw/zinc/01/78/93/333017893.db2.gz MWUHPMQRYQESRL-MOPGFXCFSA-N 1 3 290.495 3.931 20 0 CHADHO C1=CC[C@@H](C[N@H+]2CCC[C@@H](CN3CCCCCC3)C2)CC1 ZINC000513411450 333017895 /nfs/dbraw/zinc/01/78/95/333017895.db2.gz MWUHPMQRYQESRL-MOPGFXCFSA-N 1 3 290.495 3.931 20 0 CHADHO C1=CC[C@@H](C[N@@H+]2CCC[C@@H](CN3CCCCCC3)C2)CC1 ZINC000513411450 333017897 /nfs/dbraw/zinc/01/78/97/333017897.db2.gz MWUHPMQRYQESRL-MOPGFXCFSA-N 1 3 290.495 3.931 20 0 CHADHO C1=CC[C@H](CN2CCC[C@H](C[NH+]3CCCCCC3)C2)CC1 ZINC000513411452 333017942 /nfs/dbraw/zinc/01/79/42/333017942.db2.gz MWUHPMQRYQESRL-RBUKOAKNSA-N 1 3 290.495 3.931 20 0 CHADHO C1=CC[C@H](C[N@H+]2CCC[C@H](CN3CCCCCC3)C2)CC1 ZINC000513411452 333017943 /nfs/dbraw/zinc/01/79/43/333017943.db2.gz MWUHPMQRYQESRL-RBUKOAKNSA-N 1 3 290.495 3.931 20 0 CHADHO C1=CC[C@H](C[N@@H+]2CCC[C@H](CN3CCCCCC3)C2)CC1 ZINC000513411452 333017944 /nfs/dbraw/zinc/01/79/44/333017944.db2.gz MWUHPMQRYQESRL-RBUKOAKNSA-N 1 3 290.495 3.931 20 0 CHADHO C[C@@H](CN[C@H](c1cccs1)C1CCCC1)C[NH+](C)C ZINC000311825347 333073033 /nfs/dbraw/zinc/07/30/33/333073033.db2.gz ODHJAEPKCHOCOT-BBRMVZONSA-N 1 3 280.481 3.767 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+](C[C@@H]2CC(C)=C[C@H](C)C2)C1 ZINC000520904364 333107603 /nfs/dbraw/zinc/10/76/03/333107603.db2.gz IFKGARGEQJPPAS-SZMVWBNQSA-N 1 3 278.484 3.643 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+](C[C@@H]2CC(C)=C[C@H](C)C2)C1 ZINC000520904364 333107605 /nfs/dbraw/zinc/10/76/05/333107605.db2.gz IFKGARGEQJPPAS-SZMVWBNQSA-N 1 3 278.484 3.643 20 0 CHADHO CC[N@H+](C)C[C@@H]1CCN(c2c(C)cnc3c(C)cccc32)C1 ZINC000185330878 333138622 /nfs/dbraw/zinc/13/86/22/333138622.db2.gz ZQBMTJPFSDVJDV-INIZCTEOSA-N 1 3 297.446 3.630 20 0 CHADHO CC[N@@H+](C)C[C@@H]1CCN(c2c(C)cnc3c(C)cccc32)C1 ZINC000185330878 333138623 /nfs/dbraw/zinc/13/86/23/333138623.db2.gz ZQBMTJPFSDVJDV-INIZCTEOSA-N 1 3 297.446 3.630 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@@H]1CC[C@@H](C)c2ccccc21 ZINC000222912267 333201899 /nfs/dbraw/zinc/20/18/99/333201899.db2.gz CGADDBONSWXZFN-CKEIUWERSA-N 1 3 260.425 3.555 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@@H]([NH3+])C1)c1cccc(C(F)(F)F)c1 ZINC000222947851 333202779 /nfs/dbraw/zinc/20/27/79/333202779.db2.gz MKFOVKFKLLIALN-ZLKJLUDKSA-N 1 3 286.341 3.626 20 0 CHADHO CC(C)[N@H+](C)CCCNC1CC(c2ccccc2Cl)C1 ZINC000226336075 333257244 /nfs/dbraw/zinc/25/72/44/333257244.db2.gz LOTZSMZBNFGNKJ-UHFFFAOYSA-N 1 3 294.870 3.906 20 0 CHADHO CC(C)[N@@H+](C)CCCNC1CC(c2ccccc2Cl)C1 ZINC000226336075 333257245 /nfs/dbraw/zinc/25/72/45/333257245.db2.gz LOTZSMZBNFGNKJ-UHFFFAOYSA-N 1 3 294.870 3.906 20 0 CHADHO CC(C)N(C)CCC[NH2+]C1CC(c2ccccc2Cl)C1 ZINC000226336075 333257246 /nfs/dbraw/zinc/25/72/46/333257246.db2.gz LOTZSMZBNFGNKJ-UHFFFAOYSA-N 1 3 294.870 3.906 20 0 CHADHO C[C@H](c1ccc(F)cc1)[N@H+](C)CCCN1CCCCC1 ZINC000195632300 333258147 /nfs/dbraw/zinc/25/81/47/333258147.db2.gz ZIHNLYSEIGOQRV-OAHLLOKOSA-N 1 3 278.415 3.695 20 0 CHADHO C[C@H](c1ccc(F)cc1)[N@@H+](C)CCCN1CCCCC1 ZINC000195632300 333258149 /nfs/dbraw/zinc/25/81/49/333258149.db2.gz ZIHNLYSEIGOQRV-OAHLLOKOSA-N 1 3 278.415 3.695 20 0 CHADHO C[C@H]([NH3+])[C@@H]1CCN([C@@H](C)c2ccc3ccccc3c2)C1 ZINC000226540131 333264546 /nfs/dbraw/zinc/26/45/46/333264546.db2.gz NVGDUAJFFPGGBT-SUNYJGFJSA-N 1 3 268.404 3.570 20 0 CHADHO C[C@@H](N[C@@H](CC[NH+](C)C)C(C)(C)C)c1ccccc1 ZINC000522545227 333289591 /nfs/dbraw/zinc/28/95/91/333289591.db2.gz IBSFFYKUQICELI-ZBFHGGJFSA-N 1 3 262.441 3.704 20 0 CHADHO C[C@H](N[C@@H](CC[NH+](C)C)C(C)(C)C)c1ccccc1 ZINC000522545225 333289622 /nfs/dbraw/zinc/28/96/22/333289622.db2.gz IBSFFYKUQICELI-HOCLYGCPSA-N 1 3 262.441 3.704 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H]2C[C@H](C)Sc3sccc32)C1 ZINC000250341662 333304491 /nfs/dbraw/zinc/30/44/91/333304491.db2.gz PXDPUMRDVMYDQR-OBJOEFQTSA-N 1 3 296.505 3.605 20 0 CHADHO CC1CCN(C[C@H]2CCC[N@H+](CC3CCCC3)C2)CC1 ZINC000523656993 333335291 /nfs/dbraw/zinc/33/52/91/333335291.db2.gz NEKAMAWRMFHZSC-GOSISDBHSA-N 1 3 278.484 3.621 20 0 CHADHO CC1CCN(C[C@H]2CCC[N@@H+](CC3CCCC3)C2)CC1 ZINC000523656993 333335293 /nfs/dbraw/zinc/33/52/93/333335293.db2.gz NEKAMAWRMFHZSC-GOSISDBHSA-N 1 3 278.484 3.621 20 0 CHADHO C/C(=C\c1ccccc1)C[NH2+]Cc1ccc(CN(C)C)cc1 ZINC000237052672 333377377 /nfs/dbraw/zinc/37/73/77/333377377.db2.gz TYSDQMGLVUPUIB-GHRIWEEISA-N 1 3 294.442 3.941 20 0 CHADHO Cc1cccc([C@H](N[C@H]2CCC[C@@H]([NH3+])C2)C(C)C)c1 ZINC000530227519 333529215 /nfs/dbraw/zinc/52/92/15/333529215.db2.gz YNRRACLRZYHMQW-IXDOHACOSA-N 1 3 260.425 3.552 20 0 CHADHO CC[C@@H]1CCC[C@H]([NH2+]C2CC(C)(C)NC(C)(C)C2)C1 ZINC000071106998 333843466 /nfs/dbraw/zinc/84/34/66/333843466.db2.gz ZUHFDUWMYDYERL-KGLIPLIRSA-N 1 3 266.473 3.854 20 0 CHADHO C[C@@H](N[C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000546166155 334017840 /nfs/dbraw/zinc/01/78/40/334017840.db2.gz HMAVMKMHARSIKG-SPYBWZPUSA-N 1 3 286.463 3.699 20 0 CHADHO C[C@@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000546166155 334017841 /nfs/dbraw/zinc/01/78/41/334017841.db2.gz HMAVMKMHARSIKG-SPYBWZPUSA-N 1 3 286.463 3.699 20 0 CHADHO C[C@]1(NC2CC[NH+](CC3CC3)CC2)CCCc2ccccc21 ZINC000546579189 334038668 /nfs/dbraw/zinc/03/86/68/334038668.db2.gz JVNRRSMWBJPSKM-FQEVSTJZSA-N 1 3 298.474 3.702 20 0 CHADHO CCc1ccc(CNCCCCC[NH+]2CCCCC2)o1 ZINC000133762188 334054673 /nfs/dbraw/zinc/05/46/73/334054673.db2.gz DCZFCDKSHQGTHB-UHFFFAOYSA-N 1 3 278.440 3.588 20 0 CHADHO CC(C)CC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000564318907 334083933 /nfs/dbraw/zinc/08/39/33/334083933.db2.gz LRSUCJQEEYJEIQ-FGTMMUONSA-N 1 3 280.500 3.911 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H]2CCc3cc(F)ccc32)C1 ZINC000246929731 334272011 /nfs/dbraw/zinc/27/20/11/334272011.db2.gz GYWNOWXZVBSEIZ-KDOFPFPSSA-N 1 3 290.426 3.523 20 0 CHADHO CCC[N@H+](CCCN(CC)CC)Cc1ccccc1 ZINC000551358884 334247586 /nfs/dbraw/zinc/24/75/86/334247586.db2.gz SZNXVNRLVCZEFW-UHFFFAOYSA-N 1 3 262.441 3.631 20 0 CHADHO CCC[N@@H+](CCCN(CC)CC)Cc1ccccc1 ZINC000551358884 334247587 /nfs/dbraw/zinc/24/75/87/334247587.db2.gz SZNXVNRLVCZEFW-UHFFFAOYSA-N 1 3 262.441 3.631 20 0 CHADHO Cc1cccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)c1 ZINC000247089772 334275596 /nfs/dbraw/zinc/27/55/96/334275596.db2.gz NXCPMRSAAZUBKN-USXIJHARSA-N 1 3 260.425 3.518 20 0 CHADHO C[C@@H]1C[C@@H](N[C@H](c2ccc(F)cc2)C2CCC2)CC[N@@H+]1C ZINC000247129744 334276301 /nfs/dbraw/zinc/27/63/01/334276301.db2.gz VJGSYXYIDXRCRA-BVGQSLNGSA-N 1 3 290.426 3.739 20 0 CHADHO C[C@@H]1C[C@@H](N[C@H](c2ccc(F)cc2)C2CCC2)CC[N@H+]1C ZINC000247129744 334276303 /nfs/dbraw/zinc/27/63/03/334276303.db2.gz VJGSYXYIDXRCRA-BVGQSLNGSA-N 1 3 290.426 3.739 20 0 CHADHO CC[N@@H+]1CC[C@@H](NCc2cccc3ccccc32)[C@@H](C)C1 ZINC000246825781 334270101 /nfs/dbraw/zinc/27/01/01/334270101.db2.gz AFIUOJWIYIHLPQ-HNAYVOBHSA-N 1 3 282.431 3.660 20 0 CHADHO CC[N@H+]1CC[C@@H](NCc2cccc3ccccc32)[C@@H](C)C1 ZINC000246825781 334270103 /nfs/dbraw/zinc/27/01/03/334270103.db2.gz AFIUOJWIYIHLPQ-HNAYVOBHSA-N 1 3 282.431 3.660 20 0 CHADHO C(CN1CCCCC1)C[N@@H+]1CCC[C@@H]2CCCC[C@H]21 ZINC000249319603 334331989 /nfs/dbraw/zinc/33/19/89/334331989.db2.gz FYGJSYCMNMOEAN-DLBZAZTESA-N 1 3 264.457 3.517 20 0 CHADHO C(CN1CCCCC1)C[N@H+]1CCC[C@@H]2CCCC[C@H]21 ZINC000249319603 334331990 /nfs/dbraw/zinc/33/19/90/334331990.db2.gz FYGJSYCMNMOEAN-DLBZAZTESA-N 1 3 264.457 3.517 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@@H](c2ccc(F)cc2)C2CC2)C1 ZINC000552745272 334343830 /nfs/dbraw/zinc/34/38/30/334343830.db2.gz MNDBJGGHXWOSMR-KBXCAEBGSA-N 1 3 290.426 3.598 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@@H](c2ccc(F)cc2)C2CC2)C1 ZINC000552745272 334343831 /nfs/dbraw/zinc/34/38/31/334343831.db2.gz MNDBJGGHXWOSMR-KBXCAEBGSA-N 1 3 290.426 3.598 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H](c2ccc(F)cc2)C2CC2)C1 ZINC000552745272 334343832 /nfs/dbraw/zinc/34/38/32/334343832.db2.gz MNDBJGGHXWOSMR-KBXCAEBGSA-N 1 3 290.426 3.598 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H](c2ccc(F)cc2)C2CC2)C1 ZINC000552745275 334343838 /nfs/dbraw/zinc/34/38/38/334343838.db2.gz MNDBJGGHXWOSMR-RDTXWAMCSA-N 1 3 290.426 3.598 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H](c2ccc(F)cc2)C2CC2)C1 ZINC000552745275 334343839 /nfs/dbraw/zinc/34/38/39/334343839.db2.gz MNDBJGGHXWOSMR-RDTXWAMCSA-N 1 3 290.426 3.598 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H](c2ccc(F)cc2)C2CC2)C1 ZINC000552745275 334343840 /nfs/dbraw/zinc/34/38/40/334343840.db2.gz MNDBJGGHXWOSMR-RDTXWAMCSA-N 1 3 290.426 3.598 20 0 CHADHO Cc1cccc(CC[C@H](C)N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000251205166 334358166 /nfs/dbraw/zinc/35/81/66/334358166.db2.gz WGPFRQYEUVPRHV-UHOSZYNNSA-N 1 3 286.463 3.533 20 0 CHADHO Cc1cccc(CC[C@H](C)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c1 ZINC000251205166 334358167 /nfs/dbraw/zinc/35/81/67/334358167.db2.gz WGPFRQYEUVPRHV-UHOSZYNNSA-N 1 3 286.463 3.533 20 0 CHADHO Cc1cccc(CC[C@H](C)[NH2+][C@@H]2CCN3CCC[C@H]3C2)c1 ZINC000251205166 334358168 /nfs/dbraw/zinc/35/81/68/334358168.db2.gz WGPFRQYEUVPRHV-UHOSZYNNSA-N 1 3 286.463 3.533 20 0 CHADHO Cc1ccc([C@H](N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)C2CC2)cc1 ZINC000251509588 334362506 /nfs/dbraw/zinc/36/25/06/334362506.db2.gz ZIGFLVWAWFEWRG-QYZOEREBSA-N 1 3 284.447 3.663 20 0 CHADHO Cc1ccc([C@H](N[C@@H]2CC[N@H+]3CCC[C@H]3C2)C2CC2)cc1 ZINC000251509588 334362508 /nfs/dbraw/zinc/36/25/08/334362508.db2.gz ZIGFLVWAWFEWRG-QYZOEREBSA-N 1 3 284.447 3.663 20 0 CHADHO CC[C@@H]1CCC[C@@H]([NH2+]CCCN2CCCC[C@H]2C)C1 ZINC000251631845 334365836 /nfs/dbraw/zinc/36/58/36/334365836.db2.gz FMXDZQUFTILFQK-BRWVUGGUSA-N 1 3 266.473 3.809 20 0 CHADHO C[NH+](C)[C@@H]1CCC[C@@H](N[C@@H](c2ccccc2)C2CC2)C1 ZINC000091367798 334377396 /nfs/dbraw/zinc/37/73/96/334377396.db2.gz VBVOAJBPUYKOGA-KURKYZTESA-N 1 3 272.436 3.600 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@@H](c2ccccc2)C2CC2)C1 ZINC000091367798 334377397 /nfs/dbraw/zinc/37/73/97/334377397.db2.gz VBVOAJBPUYKOGA-KURKYZTESA-N 1 3 272.436 3.600 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](C)c2ccc(CC(C)C)cc2)C1 ZINC000252439587 334380121 /nfs/dbraw/zinc/38/01/21/334380121.db2.gz QIKIPVNJQLYJAN-SJLPKXTDSA-N 1 3 288.479 3.878 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](C)c2ccc(CC(C)C)cc2)C1 ZINC000252439587 334380123 /nfs/dbraw/zinc/38/01/23/334380123.db2.gz QIKIPVNJQLYJAN-SJLPKXTDSA-N 1 3 288.479 3.878 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](C)c2ccc(CC(C)C)cc2)C1 ZINC000252439587 334380125 /nfs/dbraw/zinc/38/01/25/334380125.db2.gz QIKIPVNJQLYJAN-SJLPKXTDSA-N 1 3 288.479 3.878 20 0 CHADHO C[C@H](c1ccc(C(C)(C)C)cc1)[N@@H+]1C[C@H](CN)C[C@H]1C ZINC000252699558 334385796 /nfs/dbraw/zinc/38/57/96/334385796.db2.gz UUGHBUDXMHIMDE-KFWWJZLASA-N 1 3 274.452 3.714 20 0 CHADHO C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1C[C@H](CN)C[C@H]1C ZINC000252699558 334385797 /nfs/dbraw/zinc/38/57/97/334385797.db2.gz UUGHBUDXMHIMDE-KFWWJZLASA-N 1 3 274.452 3.714 20 0 CHADHO C[C@H](c1ccc(C(C)(C)C)cc1)N1C[C@H](C[NH3+])C[C@H]1C ZINC000252699558 334385799 /nfs/dbraw/zinc/38/57/99/334385799.db2.gz UUGHBUDXMHIMDE-KFWWJZLASA-N 1 3 274.452 3.714 20 0 CHADHO CC(C)[NH2+]CCCN[C@H](c1cccs1)C1CCCC1 ZINC000566614427 334657498 /nfs/dbraw/zinc/65/74/98/334657498.db2.gz SOIZTHKPPLMOMG-INIZCTEOSA-N 1 3 280.481 3.957 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000568412971 334823916 /nfs/dbraw/zinc/82/39/16/334823916.db2.gz OXPCHHFDLSGHEB-SQNIBIBYSA-N 1 3 288.410 3.621 20 0 CHADHO CC(C)CN1CCC([NH2+]C[C@@H]2C[C@H]2c2ccccc2)CC1 ZINC000163440931 334868327 /nfs/dbraw/zinc/86/83/27/334868327.db2.gz BDXLQSAWMUYXSG-HKUYNNGSSA-N 1 3 286.463 3.500 20 0 CHADHO C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000576536941 335216972 /nfs/dbraw/zinc/21/69/72/335216972.db2.gz JLQPOGAGWINSQL-MTEHYEEQSA-N 1 3 298.474 3.675 20 0 CHADHO CC(C)CN1CCC[C@@H](C[NH2+]C(C2CCC2)C2CCC2)C1 ZINC000580585773 335292350 /nfs/dbraw/zinc/29/23/50/335292350.db2.gz WBISEUZFOXLKDT-INIZCTEOSA-N 1 3 292.511 3.913 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+]C2(Cc3ccc(Cl)cc3)CCC2)C1 ZINC000577232255 335327796 /nfs/dbraw/zinc/32/77/96/335327796.db2.gz YCMSTZVPJQPFKW-CVEARBPZSA-N 1 3 292.854 3.665 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](NC2(Cc3ccc(Cl)cc3)CCC2)C1 ZINC000577232255 335327797 /nfs/dbraw/zinc/32/77/97/335327797.db2.gz YCMSTZVPJQPFKW-CVEARBPZSA-N 1 3 292.854 3.665 20 0 CHADHO CN(C)C[C@@H]1CC[N@H+](Cc2ccc(C3CCCC3)cc2)C1 ZINC000577676395 335387807 /nfs/dbraw/zinc/38/78/07/335387807.db2.gz CPCBZQARKPLPKP-KRWDZBQOSA-N 1 3 286.463 3.728 20 0 CHADHO CN(C)C[C@@H]1CC[N@@H+](Cc2ccc(C3CCCC3)cc2)C1 ZINC000577676395 335387809 /nfs/dbraw/zinc/38/78/09/335387809.db2.gz CPCBZQARKPLPKP-KRWDZBQOSA-N 1 3 286.463 3.728 20 0 CHADHO CCCCC[C@@H](C)[NH2+]C1CCN(c2ccncc2)CC1 ZINC000036792060 520286115 /nfs/dbraw/zinc/28/61/15/520286115.db2.gz DJAPEBGSBOBODY-OAHLLOKOSA-N 1 3 275.440 3.609 20 0 CHADHO C[C@H](NC1CC[NH+](C2CC2)CC1)c1cccc(Cl)c1 ZINC000037140882 525292427 /nfs/dbraw/zinc/29/24/27/525292427.db2.gz YVKAAXWNHBRWHO-LBPRGKRZSA-N 1 3 278.827 3.617 20 0 CHADHO C[C@@H]([NH2+]CC1=CCN(C)CC1)[C@@H](C)c1ccc(Cl)cc1 ZINC000280310616 525423820 /nfs/dbraw/zinc/42/38/20/525423820.db2.gz ORONSHGJNBYESD-ZIAGYGMSSA-N 1 3 292.854 3.684 20 0 CHADHO C[C@@H]([NH2+]CC1=CCN(C)CC1)[C@H](C)c1ccc(Cl)cc1 ZINC000280310615 525424548 /nfs/dbraw/zinc/42/45/48/525424548.db2.gz ORONSHGJNBYESD-UONOGXRCSA-N 1 3 292.854 3.684 20 0 CHADHO Cc1ccc([C@@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)s1 ZINC000088164248 525721866 /nfs/dbraw/zinc/72/18/66/525721866.db2.gz VJIRZRITLXGLGP-FFHGMXDLSA-N 1 3 278.465 3.722 20 0 CHADHO Cc1ccc([C@@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)s1 ZINC000088164248 525721873 /nfs/dbraw/zinc/72/18/73/525721873.db2.gz VJIRZRITLXGLGP-FFHGMXDLSA-N 1 3 278.465 3.722 20 0 CHADHO C[C@@H](c1ccccc1F)N1CCC(CC[NH+](C)C)CC1 ZINC000056521739 526107974 /nfs/dbraw/zinc/10/79/74/526107974.db2.gz QLGALDGSHQIAAY-AWEZNQCLSA-N 1 3 278.415 3.550 20 0 CHADHO c1cc(N2CCC([NH2+]CCC3=CCCCC3)CC2)ccn1 ZINC000037374225 526432172 /nfs/dbraw/zinc/43/21/72/526432172.db2.gz DDINTAMBZWYGJD-UHFFFAOYSA-N 1 3 285.435 3.531 20 0 CHADHO Clc1ccc(C[NH2+]C[C@H]2CCN(C3CC3)C2)cc1Cl ZINC000037408191 526947612 /nfs/dbraw/zinc/94/76/12/526947612.db2.gz ZDNIGEUVBALAAV-GFCCVEGCSA-N 1 3 299.245 3.567 20 0 CHADHO C(C1CCC1)N1CCCC2(CCC[N@H+](CC3CCC3)C2)C1 ZINC000352029890 527475290 /nfs/dbraw/zinc/47/52/90/527475290.db2.gz XVDFEWBNTJPUTK-UHFFFAOYSA-N 1 3 290.495 3.765 20 0 CHADHO C(C1CCC1)N1CCCC2(CCC[N@@H+](CC3CCC3)C2)C1 ZINC000352029890 527475294 /nfs/dbraw/zinc/47/52/94/527475294.db2.gz XVDFEWBNTJPUTK-UHFFFAOYSA-N 1 3 290.495 3.765 20 0 CHADHO CCCN(Cc1ccc(Cl)cc1C)C1CC[NH2+]CC1 ZINC000347173449 528135088 /nfs/dbraw/zinc/13/50/88/528135088.db2.gz OSAMTEAVMWQVIG-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO CCC[N@H+](Cc1ccc(Cl)cc1C)C1CCNCC1 ZINC000347173449 528135092 /nfs/dbraw/zinc/13/50/92/528135092.db2.gz OSAMTEAVMWQVIG-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO CCC[N@@H+](Cc1ccc(Cl)cc1C)C1CCNCC1 ZINC000347173449 528135097 /nfs/dbraw/zinc/13/50/97/528135097.db2.gz OSAMTEAVMWQVIG-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO CCC[NH+]1CCC(CN[C@@H](CC)c2ccccc2F)CC1 ZINC000352682866 528188384 /nfs/dbraw/zinc/18/83/84/528188384.db2.gz IABWBMQJDMGOJO-SFHVURJKSA-N 1 3 292.442 3.988 20 0 CHADHO CCCCc1oc2ccccc2c1CN1CC[C@H](C[NH3+])C1 ZINC000347137617 529066323 /nfs/dbraw/zinc/06/63/23/529066323.db2.gz UWHGRJQTSQIELN-CQSZACIVSA-N 1 3 286.419 3.556 20 0 CHADHO CC[C@H](NC[C@H]1CCCC[N@H+](C)C1)c1cccs1 ZINC000624120260 1117984704 /nfs/dbraw/zinc/98/47/04/1117984704.db2.gz VACWZPVSPSLYFC-KGLIPLIRSA-N 1 3 266.454 3.521 20 0 CHADHO CC[C@H](NC[C@H]1CCCC[N@@H+](C)C1)c1cccs1 ZINC000624120260 1117984708 /nfs/dbraw/zinc/98/47/08/1117984708.db2.gz VACWZPVSPSLYFC-KGLIPLIRSA-N 1 3 266.454 3.521 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CCc2ccc(Cl)cc2)CC1 ZINC000764506306 1118096148 /nfs/dbraw/zinc/09/61/48/1118096148.db2.gz XAMABYPSOIOJED-UHFFFAOYSA-N 1 3 294.870 3.735 20 0 CHADHO CCN(C)C[C@H]1CC[N@H+](CCC2CCCCCC2)C1 ZINC000580839341 1118512387 /nfs/dbraw/zinc/51/23/87/1118512387.db2.gz PXOYMNQNGCREIG-QGZVFWFLSA-N 1 3 266.473 3.621 20 0 CHADHO CCN(C)C[C@H]1CC[N@@H+](CCC2CCCCCC2)C1 ZINC000580839341 1118512391 /nfs/dbraw/zinc/51/23/91/1118512391.db2.gz PXOYMNQNGCREIG-QGZVFWFLSA-N 1 3 266.473 3.621 20 0 CHADHO CC[C@]1(C)CCC[C@@H]1[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000651705937 1120716817 /nfs/dbraw/zinc/71/68/17/1120716817.db2.gz NGARFHVRZSPZMU-YESZJQIVSA-N 1 3 266.473 3.665 20 0 CHADHO CC[C@H](CC(F)F)C[N@H+](CCCN)CC1CCCC1 ZINC000662271892 1120915945 /nfs/dbraw/zinc/91/59/45/1120915945.db2.gz AYXOAPRFWKRZQM-CYBMUJFWSA-N 1 3 276.415 3.509 20 0 CHADHO CC[C@H](CC(F)F)C[N@@H+](CCCN)CC1CCCC1 ZINC000662271892 1120915948 /nfs/dbraw/zinc/91/59/48/1120915948.db2.gz AYXOAPRFWKRZQM-CYBMUJFWSA-N 1 3 276.415 3.509 20 0 CHADHO CCN(CC)CCC[N@H+](CC)C[C@@H]1CCCC[C@H]1C ZINC001181506322 1122059663 /nfs/dbraw/zinc/05/96/63/1122059663.db2.gz PYRGYUURUDAMIP-SJORKVTESA-N 1 3 268.489 3.867 20 0 CHADHO CCN(CC)CCC[N@@H+](CC)C[C@@H]1CCCC[C@H]1C ZINC001181506322 1122059670 /nfs/dbraw/zinc/05/96/70/1122059670.db2.gz PYRGYUURUDAMIP-SJORKVTESA-N 1 3 268.489 3.867 20 0 CHADHO CCN(CC)CCC[N@H+](CC)C[C@H]1CCCC[C@@H]1C ZINC001181506319 1122060718 /nfs/dbraw/zinc/06/07/18/1122060718.db2.gz PYRGYUURUDAMIP-DLBZAZTESA-N 1 3 268.489 3.867 20 0 CHADHO CCN(CC)CCC[N@@H+](CC)C[C@H]1CCCC[C@@H]1C ZINC001181506319 1122060725 /nfs/dbraw/zinc/06/07/25/1122060725.db2.gz PYRGYUURUDAMIP-DLBZAZTESA-N 1 3 268.489 3.867 20 0 CHADHO CC[C@@H](F)CN1CCC(CC[N@H+](CC)CC2CC2)CC1 ZINC000440799575 1123039726 /nfs/dbraw/zinc/03/97/26/1123039726.db2.gz UICSWLSMLNODJT-QGZVFWFLSA-N 1 3 284.463 3.569 20 0 CHADHO CC[C@@H](F)CN1CCC(CC[N@@H+](CC)CC2CC2)CC1 ZINC000440799575 1123039731 /nfs/dbraw/zinc/03/97/31/1123039731.db2.gz UICSWLSMLNODJT-QGZVFWFLSA-N 1 3 284.463 3.569 20 0 CHADHO CC(C)[NH+]1CCC(N(C)C[C@@H]2CCCCC2(F)F)CC1 ZINC000450338011 1124986006 /nfs/dbraw/zinc/98/60/06/1124986006.db2.gz IPKGIUAYTROPHE-AWEZNQCLSA-N 1 3 288.426 3.617 20 0 CHADHO CCCCCC[C@@H](C)[NH2+][C@@H]1CCNC2(CCC2)C1 ZINC000841090203 1132326589 /nfs/dbraw/zinc/32/65/89/1132326589.db2.gz MODVEYCUZPZZRM-HUUCEWRRSA-N 1 3 252.446 3.610 20 0 CHADHO CC(C)[N@H+](CCCN)C1CCC2(CCCCC2)CC1 ZINC001173115402 1132395780 /nfs/dbraw/zinc/39/57/80/1132395780.db2.gz YRJUMWGYJXTYNK-UHFFFAOYSA-N 1 3 266.473 3.939 20 0 CHADHO CC(C)[N@@H+](CCCN)C1CCC2(CCCCC2)CC1 ZINC001173115402 1132395784 /nfs/dbraw/zinc/39/57/84/1132395784.db2.gz YRJUMWGYJXTYNK-UHFFFAOYSA-N 1 3 266.473 3.939 20 0 CHADHO CC(C)[N@@H+](Cc1cc(F)cc(CN(C)C)c1)CC1CC1 ZINC001232148067 1132427157 /nfs/dbraw/zinc/42/71/57/1132427157.db2.gz VUISOKIZVDOVQQ-UHFFFAOYSA-N 1 3 278.415 3.508 20 0 CHADHO CC(C)[N@H+](Cc1cc(F)cc(CN(C)C)c1)CC1CC1 ZINC001232148067 1132427159 /nfs/dbraw/zinc/42/71/59/1132427159.db2.gz VUISOKIZVDOVQQ-UHFFFAOYSA-N 1 3 278.415 3.508 20 0 CHADHO CCCCc1ccc(CN2CCC[C@H](C[NH3+])[C@@H]2C)s1 ZINC001205901011 1133629181 /nfs/dbraw/zinc/62/91/81/1133629181.db2.gz AMGLBUKCEKCVGL-UONOGXRCSA-N 1 3 280.481 3.650 20 0 CHADHO CC/C=C\CCCCCN1CCC([NH+]2CCC2)CC1 ZINC001208195768 1133904543 /nfs/dbraw/zinc/90/45/43/1133904543.db2.gz FFEWRLGNCQHIQD-ARJAWSKDSA-N 1 3 264.457 3.683 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H](C)c2ccccc2C(C)(C)C)C1 ZINC000533638724 1125620468 /nfs/dbraw/zinc/62/04/68/1125620468.db2.gz MOPDLRMCLFBBSW-JKSUJKDBSA-N 1 3 288.479 3.977 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H](C)c2ccccc2C(C)(C)C)C1 ZINC000533638724 1125620472 /nfs/dbraw/zinc/62/04/72/1125620472.db2.gz MOPDLRMCLFBBSW-JKSUJKDBSA-N 1 3 288.479 3.977 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)c2ccccc2C(C)(C)C)C1 ZINC000533638724 1125620476 /nfs/dbraw/zinc/62/04/76/1125620476.db2.gz MOPDLRMCLFBBSW-JKSUJKDBSA-N 1 3 288.479 3.977 20 0 CHADHO Cc1cc([C@H](C)[NH2+][C@H]2CCC[C@@H](N(C)C)C2)c(C)s1 ZINC000246820824 1125648427 /nfs/dbraw/zinc/64/84/27/1125648427.db2.gz APIFQQKUERLCLG-AEGPPILISA-N 1 3 280.481 3.888 20 0 CHADHO CCC[N@@H+](CCCN)[C@@H](Cc1ccccc1)CC(C)C ZINC001169050199 1129692010 /nfs/dbraw/zinc/69/20/10/1129692010.db2.gz NDYRCEVYOWWVOW-GOSISDBHSA-N 1 3 276.468 3.705 20 0 CHADHO CCCc1cccc(CN(C)[C@@H]2CC[N@H+](CC)C[C@@H]2C)c1 ZINC000481999836 1126737589 /nfs/dbraw/zinc/73/75/89/1126737589.db2.gz HVWKXTCYOTUHEK-QFBILLFUSA-N 1 3 288.479 3.801 20 0 CHADHO CCCc1cccc(CN(C)[C@@H]2CC[N@@H+](CC)C[C@@H]2C)c1 ZINC000481999836 1126737590 /nfs/dbraw/zinc/73/75/90/1126737590.db2.gz HVWKXTCYOTUHEK-QFBILLFUSA-N 1 3 288.479 3.801 20 0 CHADHO CC(C)[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000482353520 1126752537 /nfs/dbraw/zinc/75/25/37/1126752537.db2.gz QMUMSUFWNFFEKN-BZSNNMDCSA-N 1 3 280.500 3.911 20 0 CHADHO COc1cccc([C@@H](C)N[C@H](CC[NH+](C)C)C(C)(C)C)c1 ZINC000483183763 1126772594 /nfs/dbraw/zinc/77/25/94/1126772594.db2.gz JXQZXJBQVYHOSJ-RHSMWYFYSA-N 1 3 292.467 3.712 20 0 CHADHO Cc1cccc([C@H](C)[NH2+][C@H]2CCC[C@H](N(C)C)C2)c1C ZINC000484482069 1126820981 /nfs/dbraw/zinc/82/09/81/1126820981.db2.gz BJHZATBGENROBM-ULQDDVLXSA-N 1 3 274.452 3.827 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CC(C)(C)c3ccccc32)C1 ZINC000484463589 1126817901 /nfs/dbraw/zinc/81/79/01/1126817901.db2.gz ADRGNEDOSVGTKW-RKVPGOIHSA-N 1 3 286.463 3.871 20 0 CHADHO CSCc1cccc(C[NH2+]C2CCN(C(C)C)CC2)c1 ZINC000188722963 1126925597 /nfs/dbraw/zinc/92/55/97/1126925597.db2.gz XEYMHKFWGCEOCP-UHFFFAOYSA-N 1 3 292.492 3.512 20 0 CHADHO CC[C@H](NC[C@H]1CCC[N@H+](CC)C1)c1cccs1 ZINC001319754030 1126983972 /nfs/dbraw/zinc/98/39/72/1126983972.db2.gz IXLLSTPDILHRDS-KGLIPLIRSA-N 1 3 266.454 3.521 20 0 CHADHO CC[C@H](NC[C@H]1CCC[N@@H+](CC)C1)c1cccs1 ZINC001319754030 1126983973 /nfs/dbraw/zinc/98/39/73/1126983973.db2.gz IXLLSTPDILHRDS-KGLIPLIRSA-N 1 3 266.454 3.521 20 0 CHADHO Cc1cc2cc(C[NH2+]C3CCN(C(C)(C)C)CC3)ccc2[nH]1 ZINC000572851040 1127229432 /nfs/dbraw/zinc/22/94/32/1127229432.db2.gz IKFVJYLCZSBTOT-UHFFFAOYSA-N 1 3 299.462 3.829 20 0 CHADHO CC(C)(C)N1CCC([NH2+]Cc2ccc3cccnc3c2)CC1 ZINC000589642908 1127232635 /nfs/dbraw/zinc/23/26/35/1127232635.db2.gz QEALZZOUTWJBMU-UHFFFAOYSA-N 1 3 297.446 3.587 20 0 CHADHO C[C@@H](NC[C@@H](C)C[NH3+])c1ccccc1SC(C)(C)C ZINC000817962406 1131192997 /nfs/dbraw/zinc/19/29/97/1131192997.db2.gz LERTWCPZCWZQGA-QWHCGFSZSA-N 1 3 280.481 3.823 20 0 CHADHO Cc1oc2ccccc2c1CN1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000355215371 1127326059 /nfs/dbraw/zinc/32/60/59/1127326059.db2.gz ZDTYUMDFQTWFLG-MAUKXSAKSA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1CN1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000355215371 1127326062 /nfs/dbraw/zinc/32/60/62/1127326062.db2.gz ZDTYUMDFQTWFLG-MAUKXSAKSA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1C[N@@H+]1CC[C@@H]2[C@@H](CCCN2C)C1 ZINC000355215371 1127326068 /nfs/dbraw/zinc/32/60/68/1127326068.db2.gz ZDTYUMDFQTWFLG-MAUKXSAKSA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1C[N@H+]1CC[C@@H]2[C@@H](CCCN2C)C1 ZINC000355215371 1127326073 /nfs/dbraw/zinc/32/60/73/1127326073.db2.gz ZDTYUMDFQTWFLG-MAUKXSAKSA-N 1 3 298.430 3.657 20 0 CHADHO CC[C@H](NCC(C)(C)C[NH+]1CCCC1)c1ccccc1 ZINC000357853525 1127395201 /nfs/dbraw/zinc/39/52/01/1127395201.db2.gz PDZFAUNAAKXYRH-KRWDZBQOSA-N 1 3 274.452 3.849 20 0 CHADHO CC[C@H]([NH2+]CC(C)(C)CN1CCCC1)c1ccccc1 ZINC000357853525 1127395205 /nfs/dbraw/zinc/39/52/05/1127395205.db2.gz PDZFAUNAAKXYRH-KRWDZBQOSA-N 1 3 274.452 3.849 20 0 CHADHO CSc1ccccc1C[N@H+](C)C1CCN(C(C)C)CC1 ZINC000358050960 1127399543 /nfs/dbraw/zinc/39/95/43/1127399543.db2.gz XRBHDECKNSHHPF-UHFFFAOYSA-N 1 3 292.492 3.713 20 0 CHADHO CSc1ccccc1C[N@@H+](C)C1CCN(C(C)C)CC1 ZINC000358050960 1127399547 /nfs/dbraw/zinc/39/95/47/1127399547.db2.gz XRBHDECKNSHHPF-UHFFFAOYSA-N 1 3 292.492 3.713 20 0 CHADHO COc1ccccc1-c1ccc(CN[C@@H](C)C[C@H](C)[NH3+])cc1 ZINC000575181195 1127467531 /nfs/dbraw/zinc/46/75/31/1127467531.db2.gz UDJSCKVMPYNGCZ-GJZGRUSLSA-N 1 3 298.430 3.578 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H]2CC[C@@H](C)c3ccccc32)C1 ZINC000360235277 1127493686 /nfs/dbraw/zinc/49/36/86/1127493686.db2.gz TXDYPMKRGJCQSE-GPMSIDNRSA-N 1 3 286.463 3.947 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H]2CC[C@@H](C)c3ccccc32)C1 ZINC000360235277 1127493687 /nfs/dbraw/zinc/49/36/87/1127493687.db2.gz TXDYPMKRGJCQSE-GPMSIDNRSA-N 1 3 286.463 3.947 20 0 CHADHO CC[C@@H]1CCC[C@H](CN2CCC([NH2+]C3CCC3)CC2)C1 ZINC001308970071 1127623724 /nfs/dbraw/zinc/62/37/24/1127623724.db2.gz BJAKSGODTNEOIN-CVEARBPZSA-N 1 3 278.484 3.809 20 0 CHADHO CSCc1cccc(C[NH2+][C@H]2CCN(C)C(C)(C)C2)c1 ZINC000598977877 1127649176 /nfs/dbraw/zinc/64/91/76/1127649176.db2.gz PGGMQDOCDXFHMC-INIZCTEOSA-N 1 3 292.492 3.512 20 0 CHADHO CC[C@@H]([NH2+]C1CCN(CC(C)C)CC1)c1ccsc1 ZINC000295814314 1127653700 /nfs/dbraw/zinc/65/37/00/1127653700.db2.gz CWYAVAKLZZOBPC-MRXNPFEDSA-N 1 3 280.481 3.909 20 0 CHADHO C[C@@H](c1ccccc1Cl)N(C)CCCCCC[NH3+] ZINC000062018697 1127730924 /nfs/dbraw/zinc/73/09/24/1127730924.db2.gz UOQJOIGJURPPAD-ZDUSSCGKSA-N 1 3 268.832 3.852 20 0 CHADHO c1ccc(C2CC(NC3CC([NH+]4CCCCC4)C3)C2)cc1 ZINC000366285343 1127745172 /nfs/dbraw/zinc/74/51/72/1127745172.db2.gz QAVRALLYSYXQFU-UHFFFAOYSA-N 1 3 284.447 3.539 20 0 CHADHO CSC1(C[NH2+]C2CCN(CC3CCCC3)CC2)CCC1 ZINC000368109798 1127756719 /nfs/dbraw/zinc/75/67/19/1127756719.db2.gz CCEAKBXUIBJAJN-UHFFFAOYSA-N 1 3 296.524 3.516 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1NCc1csc2ccccc12 ZINC000540119431 1127961832 /nfs/dbraw/zinc/96/18/32/1127961832.db2.gz ZCRVNPWAKUADFG-WWGRRREGSA-N 1 3 288.460 3.720 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1NCc1csc2ccccc12 ZINC000540119431 1127961838 /nfs/dbraw/zinc/96/18/38/1127961838.db2.gz ZCRVNPWAKUADFG-WWGRRREGSA-N 1 3 288.460 3.720 20 0 CHADHO CC(C)[C@@H]([NH2+]CC1=CCN(C)CC1)c1cc2ccccc2o1 ZINC000540656456 1127988735 /nfs/dbraw/zinc/98/87/35/1127988735.db2.gz NZJPPQMFARSXCB-LJQANCHMSA-N 1 3 298.430 3.981 20 0 CHADHO CCc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H](N(C)C)C2)cc1 ZINC000468072229 1127990545 /nfs/dbraw/zinc/99/05/45/1127990545.db2.gz XFQBABASRPGLAR-JCGIZDLHSA-N 1 3 274.452 3.772 20 0 CHADHO C[C@H]1C[C@H](C[NH3+])CN1Cc1ccc(-c2ccccc2)s1 ZINC000469850689 1128056204 /nfs/dbraw/zinc/05/62/04/1128056204.db2.gz WNONLEOTHLBTMS-UONOGXRCSA-N 1 3 286.444 3.584 20 0 CHADHO CCCC[C@@H](CC)CC[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000557097222 1128091248 /nfs/dbraw/zinc/09/12/48/1128091248.db2.gz JERUDVZUEWCMNY-SJORKVTESA-N 1 3 268.489 3.913 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2csc3ccccc23)C1 ZINC000924707954 1128110845 /nfs/dbraw/zinc/11/08/45/1128110845.db2.gz WJJYADZWNDWKRL-KBPBESRZSA-N 1 3 288.460 3.894 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@@H](C)c2csc3ccccc23)C1 ZINC000924707954 1128110846 /nfs/dbraw/zinc/11/08/46/1128110846.db2.gz WJJYADZWNDWKRL-KBPBESRZSA-N 1 3 288.460 3.894 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@@H](C)c2csc3ccccc23)C1 ZINC000924707954 1128110848 /nfs/dbraw/zinc/11/08/48/1128110848.db2.gz WJJYADZWNDWKRL-KBPBESRZSA-N 1 3 288.460 3.894 20 0 CHADHO [NH3+]CCC[C@H](N[C@H]1CCOc2ccccc21)c1ccccc1 ZINC000925510186 1128130764 /nfs/dbraw/zinc/13/07/64/1128130764.db2.gz UDDZTVAXESSBMF-ROUUACIJSA-N 1 3 296.414 3.580 20 0 CHADHO Cc1cccc(F)c1CN[C@H](CCC[NH3+])c1ccccc1 ZINC000925524431 1128131024 /nfs/dbraw/zinc/13/10/24/1128131024.db2.gz TVUPXGKWYHKFCI-GOSISDBHSA-N 1 3 286.394 3.704 20 0 CHADHO CSc1ccc([C@@H](C)N[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000219233881 1128163615 /nfs/dbraw/zinc/16/36/15/1128163615.db2.gz LJMYAGNKCUUPPZ-GZBFAFLISA-N 1 3 278.465 3.542 20 0 CHADHO CSc1ccc([C@@H](C)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000219233881 1128163616 /nfs/dbraw/zinc/16/36/16/1128163616.db2.gz LJMYAGNKCUUPPZ-GZBFAFLISA-N 1 3 278.465 3.542 20 0 CHADHO CCC(CC)[N@@H+]1CC[C@H](N[C@@H](C)Cc2cccc(F)c2)C1 ZINC001168470229 1128198304 /nfs/dbraw/zinc/19/83/04/1128198304.db2.gz XPAKDKGWOWSSEW-YOEHRIQHSA-N 1 3 292.442 3.609 20 0 CHADHO CCC(CC)[N@H+]1CC[C@H](N[C@@H](C)Cc2cccc(F)c2)C1 ZINC001168470229 1128198306 /nfs/dbraw/zinc/19/83/06/1128198306.db2.gz XPAKDKGWOWSSEW-YOEHRIQHSA-N 1 3 292.442 3.609 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1coc2ccccc12 ZINC000926753216 1128192294 /nfs/dbraw/zinc/19/22/94/1128192294.db2.gz LUYRHVYDJOSSHX-HUUCEWRRSA-N 1 3 286.419 3.815 20 0 CHADHO CCCCCC[C@H](C)[NH2+][C@H]1CC[C@H](N2CCOCC2)CC1 ZINC001257358167 1128266350 /nfs/dbraw/zinc/26/63/50/1128266350.db2.gz CRZUTPHDICQPOF-BZSNNMDCSA-N 1 3 296.499 3.578 20 0 CHADHO CN(C[C@H]1CCC[N@H+](C)C1)[C@H]1CCc2cc(Cl)ccc21 ZINC000777783645 1128274515 /nfs/dbraw/zinc/27/45/15/1128274515.db2.gz CUHYLOYFMZSWRV-GUYCJALGSA-N 1 3 292.854 3.601 20 0 CHADHO CN(C[C@H]1CCC[N@@H+](C)C1)[C@H]1CCc2cc(Cl)ccc21 ZINC000777783645 1128274517 /nfs/dbraw/zinc/27/45/17/1128274517.db2.gz CUHYLOYFMZSWRV-GUYCJALGSA-N 1 3 292.854 3.601 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](C[N@H+](C)CCCN)CC1 ZINC001235435291 1128331151 /nfs/dbraw/zinc/33/11/51/1128331151.db2.gz HLEMNFNEBIGXLR-QGZVFWFLSA-N 1 3 264.457 3.740 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](C[N@@H+](C)CCCN)CC1 ZINC001235435291 1128331154 /nfs/dbraw/zinc/33/11/54/1128331154.db2.gz HLEMNFNEBIGXLR-QGZVFWFLSA-N 1 3 264.457 3.740 20 0 CHADHO C[C@H](Cc1ccccc1Cl)[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000715278260 1128360503 /nfs/dbraw/zinc/36/05/03/1128360503.db2.gz PTBADRMSGITFFY-FVQBIDKESA-N 1 3 294.870 3.733 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1)C(C)(C)C ZINC000670268949 1128379679 /nfs/dbraw/zinc/37/96/79/1128379679.db2.gz UKUGTSWUCKNPKG-PMPSAXMXSA-N 1 3 280.500 3.911 20 0 CHADHO CCCC[C@@H]([NH2+]C[C@@H]1CCN(CC)C1)c1ccccc1 ZINC000037644530 1128433518 /nfs/dbraw/zinc/43/35/18/1128433518.db2.gz SPHLVLSVLSPXGS-FUHWJXTLSA-N 1 3 274.452 3.849 20 0 CHADHO CCCC[C@@H](NC[C@@H]1CC[N@H+](CC)C1)c1ccccc1 ZINC000037644530 1128433520 /nfs/dbraw/zinc/43/35/20/1128433520.db2.gz SPHLVLSVLSPXGS-FUHWJXTLSA-N 1 3 274.452 3.849 20 0 CHADHO CCCC[C@@H](NC[C@@H]1CC[N@@H+](CC)C1)c1ccccc1 ZINC000037644530 1128433523 /nfs/dbraw/zinc/43/35/23/1128433523.db2.gz SPHLVLSVLSPXGS-FUHWJXTLSA-N 1 3 274.452 3.849 20 0 CHADHO CCCc1ccc([C@@H](C)NC[C@@H]2CC[N@H+](CC)C2)cc1 ZINC000037643995 1128433682 /nfs/dbraw/zinc/43/36/82/1128433682.db2.gz HGGLQSQSYCLCSM-WBVHZDCISA-N 1 3 274.452 3.632 20 0 CHADHO CCCc1ccc([C@@H](C)NC[C@@H]2CC[N@@H+](CC)C2)cc1 ZINC000037643995 1128433683 /nfs/dbraw/zinc/43/36/83/1128433683.db2.gz HGGLQSQSYCLCSM-WBVHZDCISA-N 1 3 274.452 3.632 20 0 CHADHO CCCc1ccc([C@@H](C)[NH2+]C[C@@H]2CCN(CC)C2)cc1 ZINC000037643995 1128433686 /nfs/dbraw/zinc/43/36/86/1128433686.db2.gz HGGLQSQSYCLCSM-WBVHZDCISA-N 1 3 274.452 3.632 20 0 CHADHO CCCc1ccc([C@@H](C)NC[C@H]2CC[N@H+](CC)C2)cc1 ZINC000037643997 1128433714 /nfs/dbraw/zinc/43/37/14/1128433714.db2.gz HGGLQSQSYCLCSM-NVXWUHKLSA-N 1 3 274.452 3.632 20 0 CHADHO CCCc1ccc([C@@H](C)NC[C@H]2CC[N@@H+](CC)C2)cc1 ZINC000037643997 1128433715 /nfs/dbraw/zinc/43/37/15/1128433715.db2.gz HGGLQSQSYCLCSM-NVXWUHKLSA-N 1 3 274.452 3.632 20 0 CHADHO CCCc1ccc([C@@H](C)[NH2+]C[C@H]2CCN(CC)C2)cc1 ZINC000037643997 1128433717 /nfs/dbraw/zinc/43/37/17/1128433717.db2.gz HGGLQSQSYCLCSM-NVXWUHKLSA-N 1 3 274.452 3.632 20 0 CHADHO c1ccc([C@@H]2CCCCN2CC[C@@H]2CCCC[NH2+]2)cc1 ZINC001205171641 1128433827 /nfs/dbraw/zinc/43/38/27/1128433827.db2.gz VDBQPVWKEUPYLU-ROUUACIJSA-N 1 3 272.436 3.746 20 0 CHADHO CC(C)c1ccc([C@@H](C)NC[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000037649524 1128434491 /nfs/dbraw/zinc/43/44/91/1128434491.db2.gz PSYXUHPSSFFXPK-HZPDHXFCSA-N 1 3 286.463 3.945 20 0 CHADHO CC(C)c1ccc([C@@H](C)NC[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000037649524 1128434493 /nfs/dbraw/zinc/43/44/93/1128434493.db2.gz PSYXUHPSSFFXPK-HZPDHXFCSA-N 1 3 286.463 3.945 20 0 CHADHO CCN1CC[C@H](C[NH2+]C2CC(C)(C)CC(C)(C)C2)C1 ZINC000124768039 1128445524 /nfs/dbraw/zinc/44/55/24/1128445524.db2.gz RTANVGUPVZLGFO-CQSZACIVSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)=CCC[C@H](C)[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000125797448 1128454101 /nfs/dbraw/zinc/45/41/01/1128454101.db2.gz LYGMBDLOXJPNDT-IRXDYDNUSA-N 1 3 266.473 3.831 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+]C2CCC(C)CC2)C1 ZINC000563800765 1128479580 /nfs/dbraw/zinc/47/95/80/1128479580.db2.gz JBIZSMSOZWDGRN-AQFXKWCLSA-N 1 3 266.473 3.523 20 0 CHADHO CCC[C@@H](C)CC[C@H](C)N1CCC([NH+](C)C)CC1 ZINC001257476518 1128480895 /nfs/dbraw/zinc/48/08/95/1128480895.db2.gz LPAWZLUKRSVGLY-CABCVRRESA-N 1 3 254.462 3.617 20 0 CHADHO CCCCC[C@H](C)N1CCC(C)([NH+]2CCCC2)CC1 ZINC001257520706 1128540765 /nfs/dbraw/zinc/54/07/65/1128540765.db2.gz VRPCPYNPUFZICZ-INIZCTEOSA-N 1 3 266.473 3.906 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@@H]([N@@H+]2CC[C@@]3(C2)CCCNC3)C1 ZINC000566230375 1128540807 /nfs/dbraw/zinc/54/08/07/1128540807.db2.gz KMJCHXRFFNPZHQ-AABGKKOBSA-N 1 3 298.474 3.572 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@@H]([N@H+]2CC[C@@]3(C2)CCCNC3)C1 ZINC000566230375 1128540810 /nfs/dbraw/zinc/54/08/10/1128540810.db2.gz KMJCHXRFFNPZHQ-AABGKKOBSA-N 1 3 298.474 3.572 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000129435514 1128541165 /nfs/dbraw/zinc/54/11/65/1128541165.db2.gz IFNYFGRWWCXWPU-RVKKMQEKSA-N 1 3 274.452 3.943 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000129435514 1128541169 /nfs/dbraw/zinc/54/11/69/1128541169.db2.gz IFNYFGRWWCXWPU-RVKKMQEKSA-N 1 3 274.452 3.943 20 0 CHADHO C[C@H](N[C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000129775615 1128556467 /nfs/dbraw/zinc/55/64/67/1128556467.db2.gz HMAVMKMHARSIKG-VCBZYWHSSA-N 1 3 286.463 3.699 20 0 CHADHO C[C@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000129775615 1128556470 /nfs/dbraw/zinc/55/64/70/1128556470.db2.gz HMAVMKMHARSIKG-VCBZYWHSSA-N 1 3 286.463 3.699 20 0 CHADHO CN(C)[C@H]1CCC[N@H+](CCC2CCCCCC2)CC1 ZINC000567312516 1128562164 /nfs/dbraw/zinc/56/21/64/1128562164.db2.gz WYANCOKQNZLNBU-KRWDZBQOSA-N 1 3 266.473 3.763 20 0 CHADHO CN(C)[C@H]1CCC[N@@H+](CCC2CCCCCC2)CC1 ZINC000567312516 1128562165 /nfs/dbraw/zinc/56/21/65/1128562165.db2.gz WYANCOKQNZLNBU-KRWDZBQOSA-N 1 3 266.473 3.763 20 0 CHADHO CC[C@@H]1CCC[C@H]([NH2+]CCCN2CCCC[C@@H]2C)C1 ZINC000071105380 1128583490 /nfs/dbraw/zinc/58/34/90/1128583490.db2.gz FMXDZQUFTILFQK-BBWFWOEESA-N 1 3 266.473 3.809 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)C1 ZINC000130727521 1128593109 /nfs/dbraw/zinc/59/31/09/1128593109.db2.gz PVZDDYRWWAQGSV-NZSAHSFTSA-N 1 3 286.463 3.644 20 0 CHADHO Cc1cc(Cl)cc(C[NH2+]C2CCN(CC3CC3)CC2)c1 ZINC000569125279 1128599255 /nfs/dbraw/zinc/59/92/55/1128599255.db2.gz KKUFFVLZYRQGLI-UHFFFAOYSA-N 1 3 292.854 3.612 20 0 CHADHO C[C@@H](CCC(C)(C)C)[NH2+]CCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000556583402 1128605524 /nfs/dbraw/zinc/60/55/24/1128605524.db2.gz IKKFKXACVQGVGK-YESZJQIVSA-N 1 3 298.515 3.680 20 0 CHADHO C[C@H](CCC(C)(C)C)[NH2+]CCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000556583403 1128605605 /nfs/dbraw/zinc/60/56/05/1128605605.db2.gz IKKFKXACVQGVGK-ZACQAIPSSA-N 1 3 298.515 3.680 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](C[C@@H]2CC(C)=C[C@H](C)C2)C1 ZINC000577945714 1128700237 /nfs/dbraw/zinc/70/02/37/1128700237.db2.gz VIUOUIDQQSPSOW-SZMVWBNQSA-N 1 3 278.484 3.643 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](C[C@@H]2CC(C)=C[C@H](C)C2)C1 ZINC000577945714 1128700242 /nfs/dbraw/zinc/70/02/42/1128700242.db2.gz VIUOUIDQQSPSOW-SZMVWBNQSA-N 1 3 278.484 3.643 20 0 CHADHO CC(C)[C@H]1CC[C@@H](C)C[C@H]1[NH2+][C@H]1CCNC2(CCC2)C1 ZINC000643546237 1117792971 /nfs/dbraw/zinc/79/29/71/1117792971.db2.gz KSAAYOISRASYLG-YYIAUSFCSA-N 1 3 278.484 3.712 20 0 CHADHO C[N@@H+]1CC[C@H](NCc2cc3ccccc3s2)CC1(C)C ZINC000623376934 1117844382 /nfs/dbraw/zinc/84/43/82/1117844382.db2.gz IJJCTZIMGUUQNS-AWEZNQCLSA-N 1 3 288.460 3.864 20 0 CHADHO C[N@H+]1CC[C@H](NCc2cc3ccccc3s2)CC1(C)C ZINC000623376934 1117844391 /nfs/dbraw/zinc/84/43/91/1117844391.db2.gz IJJCTZIMGUUQNS-AWEZNQCLSA-N 1 3 288.460 3.864 20 0 CHADHO C[N@@H+]1CC[C@@H](NCc2cccc3ccccc32)CC1(C)C ZINC000623385039 1117847979 /nfs/dbraw/zinc/84/79/79/1117847979.db2.gz ZCRGILHZQYAOOT-QGZVFWFLSA-N 1 3 282.431 3.802 20 0 CHADHO C[N@H+]1CC[C@@H](NCc2cccc3ccccc32)CC1(C)C ZINC000623385039 1117847988 /nfs/dbraw/zinc/84/79/88/1117847988.db2.gz ZCRGILHZQYAOOT-QGZVFWFLSA-N 1 3 282.431 3.802 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCc1ccc(-c2cccc(F)c2)s1 ZINC000579121821 1128738442 /nfs/dbraw/zinc/73/84/42/1128738442.db2.gz FQNNEAFJUBZGOK-NEPJUHHUSA-N 1 3 292.423 3.770 20 0 CHADHO C[C@H](CC[NH2+]C[C@H](C)C(C)(C)C)N1CCCCC1 ZINC000670269054 1117848688 /nfs/dbraw/zinc/84/86/88/1117848688.db2.gz LDXARHGUSLQCHE-LSDHHAIUSA-N 1 3 254.462 3.523 20 0 CHADHO Cc1cc(C)cc([C@H](C)N[C@@H]2CC[N@H+](C)C(C)(C)C2)c1 ZINC000623409219 1117851111 /nfs/dbraw/zinc/85/11/11/1117851111.db2.gz URLZWCJNMVKTOJ-DOTOQJQBSA-N 1 3 274.452 3.827 20 0 CHADHO Cc1cc(C)cc([C@H](C)N[C@@H]2CC[N@@H+](C)C(C)(C)C2)c1 ZINC000623409219 1117851117 /nfs/dbraw/zinc/85/11/17/1117851117.db2.gz URLZWCJNMVKTOJ-DOTOQJQBSA-N 1 3 274.452 3.827 20 0 CHADHO CCCCCC[NH2+][C@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000185725282 1117879042 /nfs/dbraw/zinc/87/90/42/1117879042.db2.gz UOFUTKNBNHUFID-CVEARBPZSA-N 1 3 266.473 3.809 20 0 CHADHO CC[C@H](C[NH2+]C[C@H]1CCCCN(C)C1)c1ccccc1 ZINC000623657490 1117885695 /nfs/dbraw/zinc/88/56/95/1117885695.db2.gz RPXGQSHOKDHOQI-IAGOWNOFSA-N 1 3 274.452 3.502 20 0 CHADHO CC[C@H]([NH2+]C[C@H]1CCN(CC)C1)c1cc(C)ccc1C ZINC000623867009 1117948040 /nfs/dbraw/zinc/94/80/40/1117948040.db2.gz NGDSZVUDBBOWDQ-AEFFLSMTSA-N 1 3 274.452 3.686 20 0 CHADHO CCCC[C@H](C)[C@H](C)[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000579877966 1117979553 /nfs/dbraw/zinc/97/95/53/1117979553.db2.gz YMOACVAIBDUHCM-YESZJQIVSA-N 1 3 268.489 3.911 20 0 CHADHO Cc1ccc([C@@H](C)NC[C@H]2CCCC[N@H+](C)C2)c(C)c1 ZINC000624119549 1117985033 /nfs/dbraw/zinc/98/50/33/1117985033.db2.gz DXJMZTXMBHHISL-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc([C@@H](C)NC[C@H]2CCCC[N@@H+](C)C2)c(C)c1 ZINC000624119549 1117985036 /nfs/dbraw/zinc/98/50/36/1117985036.db2.gz DXJMZTXMBHHISL-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCCCN(C)C2)c(C)c1 ZINC000624119549 1117985038 /nfs/dbraw/zinc/98/50/38/1117985038.db2.gz DXJMZTXMBHHISL-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO CN1CCCC[C@@H](C[NH2+][C@@H](c2ccc(F)cc2)C2CC2)C1 ZINC000624121732 1117985146 /nfs/dbraw/zinc/98/51/46/1117985146.db2.gz CCCZGZBHLWIZEQ-KBXCAEBGSA-N 1 3 290.426 3.598 20 0 CHADHO CCCC[C@H](C)[C@H](C)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000624123501 1117987699 /nfs/dbraw/zinc/98/76/99/1117987699.db2.gz NFQJPMOUDYVKSA-JYJNAYRXSA-N 1 3 254.462 3.523 20 0 CHADHO CC(C)[C@H](C[NH2+]C[C@H]1CCN(C(C)C)C1)c1ccccc1 ZINC000232756175 1117988440 /nfs/dbraw/zinc/98/84/40/1117988440.db2.gz ULQLUEHZVOXXFG-MJGOQNOKSA-N 1 3 288.479 3.746 20 0 CHADHO Cc1ccc([C@H](NCc2ccc(C[NH3+])cc2)C2CCC2)o1 ZINC000579474238 1128749149 /nfs/dbraw/zinc/74/91/49/1128749149.db2.gz MSCOTOAOYWKEES-GOSISDBHSA-N 1 3 284.403 3.678 20 0 CHADHO CCN1CC[C@@H](C[NH2+]C2CC(c3cccc(Cl)c3)C2)C1 ZINC000037644386 1118032735 /nfs/dbraw/zinc/03/27/35/1118032735.db2.gz QJZWUJXVZKNPHF-KTAKPFMOSA-N 1 3 292.854 3.517 20 0 CHADHO CCC[C@H](NCc1ccc(C[NH+](C)C)cc1)c1cccnc1 ZINC000184895273 1118058128 /nfs/dbraw/zinc/05/81/28/1118058128.db2.gz NZRJWFOANGOQLO-IBGZPJMESA-N 1 3 297.446 3.774 20 0 CHADHO Cc1cccc2c1ncc(C)c2N1CC[C@@H]([NH+]2CCCC2)C1 ZINC000185293468 1118061812 /nfs/dbraw/zinc/06/18/12/1118061812.db2.gz LFOPAOGIIOSQFN-MRXNPFEDSA-N 1 3 295.430 3.526 20 0 CHADHO CCN(CC)CCC[NH2+]Cc1cccc2ccccc21 ZINC000057942420 1118065479 /nfs/dbraw/zinc/06/54/79/1118065479.db2.gz FYOYWKXFLSBGRH-UHFFFAOYSA-N 1 3 270.420 3.661 20 0 CHADHO [NH3+]CC[C@H]1CN(c2ccnc(C3CC3)c2)c2ccccc21 ZINC001168548964 1118183134 /nfs/dbraw/zinc/18/31/34/1118183134.db2.gz QQMVJRIFINCWGK-AWEZNQCLSA-N 1 3 279.387 3.543 20 0 CHADHO CC[C@H](C)C[C@H](CC)[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000715510947 1118308209 /nfs/dbraw/zinc/30/82/09/1118308209.db2.gz RLNJXOBEGRUFAW-CAOSSQGBSA-N 1 3 254.462 3.664 20 0 CHADHO C[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)c1ccc(-c2ccncc2)cc1 ZINC000580062713 1118371187 /nfs/dbraw/zinc/37/11/87/1118371187.db2.gz WNBIXMOMDNSLQL-KYNGSXCRSA-N 1 3 295.430 3.669 20 0 CHADHO CC[C@@H](C)[C@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000580226042 1118405776 /nfs/dbraw/zinc/40/57/76/1118405776.db2.gz MCHFVVOWTRKWCL-CABCVRRESA-N 1 3 266.473 3.808 20 0 CHADHO CC[C@@H]([NH2+]CC[C@H]1CCCN1C)c1cccc(Cl)c1 ZINC000341106599 1118603019 /nfs/dbraw/zinc/60/30/19/1118603019.db2.gz QUUPOAOXWFRTAI-HZPDHXFCSA-N 1 3 280.843 3.865 20 0 CHADHO C[C@H](NCCC[NH3+])c1ccc(O[C@@H](C)c2ccccc2)cc1 ZINC000656786900 1118659048 /nfs/dbraw/zinc/65/90/48/1118659048.db2.gz DIZWRXNEPIFMTA-HOTGVXAUSA-N 1 3 298.430 3.826 20 0 CHADHO c1c(CN(Cc2ccccc2)C2CC2)sc2c1C[NH2+]CC2 ZINC000687962759 1128794457 /nfs/dbraw/zinc/79/44/57/1128794457.db2.gz WTYOQSBAVZBEIR-UHFFFAOYSA-N 1 3 298.455 3.558 20 0 CHADHO [NH3+][C@H]1C[C@@H](NCCC2=CCCCC2)c2ccccc21 ZINC000131923573 1118775600 /nfs/dbraw/zinc/77/56/00/1118775600.db2.gz NLRBHMPCXBCFHA-DLBZAZTESA-N 1 3 256.393 3.611 20 0 CHADHO C[C@@H]([NH2+]CC1=CCCC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000401090818 1118778903 /nfs/dbraw/zinc/77/89/03/1118778903.db2.gz VLRPRKUJBQPAAI-APWZRJJASA-N 1 3 284.447 3.597 20 0 CHADHO Cc1cccc(-c2ccc(CNC3CC[NH+](C)CC3)cc2)c1 ZINC000129323670 1118789298 /nfs/dbraw/zinc/78/92/98/1118789298.db2.gz WJXAECDCHHPCPB-UHFFFAOYSA-N 1 3 294.442 3.846 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+][C@H]2CCC[C@@H]2CCCF)C1 ZINC000510752890 1118806849 /nfs/dbraw/zinc/80/68/49/1118806849.db2.gz OCHDAKLUSZLKDA-KURKYZTESA-N 1 3 298.490 3.862 20 0 CHADHO C[C@@H](C[NH2+]C1CC(C)(C)CC(C)(C)C1)CN1CCCC1 ZINC000129719546 1118884735 /nfs/dbraw/zinc/88/47/35/1118884735.db2.gz XLZHAAAPSFHHNX-HNNXBMFYSA-N 1 3 280.500 3.913 20 0 CHADHO CC[NH+](CC)C[C@@H]1CCN(CCCc2cccc(C)c2)C1 ZINC000181125235 1118903338 /nfs/dbraw/zinc/90/33/38/1118903338.db2.gz MJUINZGMAFLJJK-IBGZPJMESA-N 1 3 288.479 3.591 20 0 CHADHO Cc1cc(CNC2CC[NH+](C)CC2)ccc1-c1ccccc1 ZINC000187750305 1118975438 /nfs/dbraw/zinc/97/54/38/1118975438.db2.gz ZNSALNBIOSCZKN-UHFFFAOYSA-N 1 3 294.442 3.846 20 0 CHADHO C([NH2+]C1CCN(C2CCCCC2)CC1)[C@@H]1CCC[C@H]2C[C@H]21 ZINC000657657088 1119229268 /nfs/dbraw/zinc/22/92/68/1119229268.db2.gz NWEDLUGBNPIDJN-TXPKVOOTSA-N 1 3 290.495 3.809 20 0 CHADHO CC1CCN(CCC[NH2+]C[C@H]2C[C@@H]2c2ccccc2)CC1 ZINC000343085052 1119304849 /nfs/dbraw/zinc/30/48/49/1119304849.db2.gz AIIJYEKFZHHCBG-RTBURBONSA-N 1 3 286.463 3.502 20 0 CHADHO C[NH2+]Cc1ccccc1CNCc1cccc(C2CC2)c1 ZINC000650720251 1119379696 /nfs/dbraw/zinc/37/96/96/1119379696.db2.gz JQBATAIYXCAMSU-UHFFFAOYSA-N 1 3 280.415 3.573 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+]C1(c2ccc(Cl)cc2)CCC1 ZINC000583646398 1119389621 /nfs/dbraw/zinc/38/96/21/1119389621.db2.gz YTHRDNZSMLEWSR-MRXNPFEDSA-N 1 3 292.854 3.793 20 0 CHADHO [NH3+]Cc1ccc(CN[C@H](CC2CC2)c2ccccc2)c(F)c1 ZINC000650753103 1119409389 /nfs/dbraw/zinc/40/93/89/1119409389.db2.gz GUVRBLOUQOJUGP-LJQANCHMSA-N 1 3 298.405 3.915 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H]2[C@@H]3CCC[C@@H]3C2(C)C)C1 ZINC000657872312 1119583654 /nfs/dbraw/zinc/58/36/54/1119583654.db2.gz MUEXPLDWPBIPHE-YVSFHVDLSA-N 1 3 278.484 3.521 20 0 CHADHO CC(C)N(CCC[NH3+])Cc1ccc(Cl)c(Cl)c1 ZINC000166598247 1119585690 /nfs/dbraw/zinc/58/56/90/1119585690.db2.gz SFHXNYBOMUURCI-UHFFFAOYSA-N 1 3 275.223 3.553 20 0 CHADHO CC(C)C[C@H](C)C[C@@H](C)[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000685455658 1119610589 /nfs/dbraw/zinc/61/05/89/1119610589.db2.gz DYEPLTZXKGRUAL-BBWFWOEESA-N 1 3 268.489 3.767 20 0 CHADHO C[C@H](Cc1cccs1)N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000658229263 1119706717 /nfs/dbraw/zinc/70/67/17/1119706717.db2.gz PYPGSUHNPDOHOH-HUUCEWRRSA-N 1 3 292.492 3.676 20 0 CHADHO C[C@H](Cc1cccs1)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000658229263 1119706719 /nfs/dbraw/zinc/70/67/19/1119706719.db2.gz PYPGSUHNPDOHOH-HUUCEWRRSA-N 1 3 292.492 3.676 20 0 CHADHO CC[C@H]([NH2+]C1CCN([C@@H]2CCC[C@@H](C)C2)CC1)C1CC1 ZINC000658236081 1119712241 /nfs/dbraw/zinc/71/22/41/1119712241.db2.gz SXXVEJKXUGQVIB-OLMNPRSZSA-N 1 3 278.484 3.808 20 0 CHADHO Cc1ccc([C@H](C)C[N@@H+]2CCC[C@@H]3CN(C)CC[C@H]32)cc1 ZINC000628281209 1119789594 /nfs/dbraw/zinc/78/95/94/1119789594.db2.gz HQSFURHVWTXQFJ-BHIYHBOVSA-N 1 3 286.463 3.515 20 0 CHADHO Cc1ccc([C@H](C)C[N@H+]2CCC[C@@H]3CN(C)CC[C@H]32)cc1 ZINC000628281209 1119789597 /nfs/dbraw/zinc/78/95/97/1119789597.db2.gz HQSFURHVWTXQFJ-BHIYHBOVSA-N 1 3 286.463 3.515 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2c(C)cc(C)cc2C)C[C@H]1C ZINC000531139901 1119793130 /nfs/dbraw/zinc/79/31/30/1119793130.db2.gz BQXAETJUODIXPL-MSOLQXFVSA-N 1 3 288.479 3.916 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2c(C)cc(C)cc2C)C[C@H]1C ZINC000531139901 1119793133 /nfs/dbraw/zinc/79/31/33/1119793133.db2.gz BQXAETJUODIXPL-MSOLQXFVSA-N 1 3 288.479 3.916 20 0 CHADHO CCC[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccccc1 ZINC000624119415 1120051868 /nfs/dbraw/zinc/05/18/68/1120051868.db2.gz AWTBKMGPSGUCIL-WMZOPIPTSA-N 1 3 274.452 3.849 20 0 CHADHO CCC[C@H](NC[C@@H]1CCCC[N@H+](C)C1)c1ccccc1 ZINC000624119415 1120051873 /nfs/dbraw/zinc/05/18/73/1120051873.db2.gz AWTBKMGPSGUCIL-WMZOPIPTSA-N 1 3 274.452 3.849 20 0 CHADHO CCC[C@H](NC[C@@H]1CCCC[N@@H+](C)C1)c1ccccc1 ZINC000624119415 1120051878 /nfs/dbraw/zinc/05/18/78/1120051878.db2.gz AWTBKMGPSGUCIL-WMZOPIPTSA-N 1 3 274.452 3.849 20 0 CHADHO CN(C)[C@H]1CCC[C@@H]([NH2+]CC2CCC(C)(C)CC2)C1 ZINC000715540338 1120082284 /nfs/dbraw/zinc/08/22/84/1120082284.db2.gz BXSGNFPZERMAIQ-CVEARBPZSA-N 1 3 266.473 3.665 20 0 CHADHO CCCC1CCC([NH2+][C@@H]2CCC[C@@H](N(C)C)C2)CC1 ZINC000715541003 1120110184 /nfs/dbraw/zinc/11/01/84/1120110184.db2.gz GUXRDCDCIKBPQN-BHUNQDJPSA-N 1 3 266.473 3.808 20 0 CHADHO C[C@H](CN(C)CC[C@H]1CCCC[N@@H+]1C)c1ccccc1 ZINC000472666159 1120137924 /nfs/dbraw/zinc/13/79/24/1120137924.db2.gz LAEHAJZGBHVBBQ-SJLPKXTDSA-N 1 3 274.452 3.596 20 0 CHADHO C[C@H](CN(C)CC[C@H]1CCCC[N@H+]1C)c1ccccc1 ZINC000472666159 1120137927 /nfs/dbraw/zinc/13/79/27/1120137927.db2.gz LAEHAJZGBHVBBQ-SJLPKXTDSA-N 1 3 274.452 3.596 20 0 CHADHO C[C@H](c1cccc(F)c1)[N@H+](C)CC[C@H]1CCCCN1C ZINC000472774023 1120171369 /nfs/dbraw/zinc/17/13/69/1120171369.db2.gz RKJABCCTQNBIJL-RHSMWYFYSA-N 1 3 278.415 3.693 20 0 CHADHO C[C@H](c1cccc(F)c1)[N@@H+](C)CC[C@H]1CCCCN1C ZINC000472774023 1120171370 /nfs/dbraw/zinc/17/13/70/1120171370.db2.gz RKJABCCTQNBIJL-RHSMWYFYSA-N 1 3 278.415 3.693 20 0 CHADHO C[C@@H](C[NH2+]Cc1ccc(-c2ccccc2)cc1)CN(C)C ZINC000314445607 1120206804 /nfs/dbraw/zinc/20/68/04/1120206804.db2.gz XSGWXJUPHOFHFZ-INIZCTEOSA-N 1 3 282.431 3.641 20 0 CHADHO CCC(F)(F)C(C)(C)CN[C@H](Cc1ccccc1)[C@H](C)[NH3+] ZINC000629531340 1128913700 /nfs/dbraw/zinc/91/37/00/1128913700.db2.gz HWPGDHITNWKFED-DZGCQCFKSA-N 1 3 298.421 3.606 20 0 CHADHO CC1CCN(CCC[NH2+][C@@H]2CCc3ccc(F)cc32)CC1 ZINC000479418114 1120478013 /nfs/dbraw/zinc/47/80/13/1120478013.db2.gz DFFPEFDFLABVRD-GOSISDBHSA-N 1 3 290.426 3.525 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]CCCN2CCCC[C@@H]2C)cc1 ZINC000019913022 1120549397 /nfs/dbraw/zinc/54/93/97/1120549397.db2.gz JHXWZMUYSKAAJG-IRXDYDNUSA-N 1 3 274.452 3.910 20 0 CHADHO c1ccc([C@@H]2C[C@H]2C[NH2+][C@H]2CCNC[C@@H]2C2CCCC2)cc1 ZINC000925677160 1120565114 /nfs/dbraw/zinc/56/51/14/1120565114.db2.gz OOIRIOUELURISR-HAGHYFMRSA-N 1 3 298.474 3.548 20 0 CHADHO CC(C)C[C@H]1CCC[C@H]([NH2+]CCCN(C)C(C)C)C1 ZINC000226334899 1120609779 /nfs/dbraw/zinc/60/97/79/1120609779.db2.gz PBGOESCDZTYCDD-SJORKVTESA-N 1 3 268.489 3.911 20 0 CHADHO c1ccc([C@H]2C[C@@H]2C[NH2+][C@@H]2CCNC[C@H]2C2CCCC2)cc1 ZINC000925712314 1120659895 /nfs/dbraw/zinc/65/98/95/1120659895.db2.gz OOIRIOUELURISR-YSTOQKLRSA-N 1 3 298.474 3.548 20 0 CHADHO CC(C)C1CCC([NH2+]C[C@H]2CCN(C(C)C)C2)CC1 ZINC000054556274 1120868408 /nfs/dbraw/zinc/86/84/08/1120868408.db2.gz MAPIALJFMLIOIN-KLAILNCOSA-N 1 3 266.473 3.521 20 0 CHADHO CC(C)CN1CCC([NH2+]C[C@H](C)c2ccccc2)CC1 ZINC000221810197 1120907297 /nfs/dbraw/zinc/90/72/97/1120907297.db2.gz ALMIDUCYOXSBTJ-INIZCTEOSA-N 1 3 274.452 3.500 20 0 CHADHO C[C@@H](N[C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000221818878 1120907989 /nfs/dbraw/zinc/90/79/89/1120907989.db2.gz HMAVMKMHARSIKG-QMTMVMCOSA-N 1 3 286.463 3.699 20 0 CHADHO C[C@@H](N[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000221818878 1120907994 /nfs/dbraw/zinc/90/79/94/1120907994.db2.gz HMAVMKMHARSIKG-QMTMVMCOSA-N 1 3 286.463 3.699 20 0 CHADHO C([NH2+]C(C1CCC1)C1CCC1)[C@@H]1CCCN(CC2CC2)C1 ZINC000663466236 1120981033 /nfs/dbraw/zinc/98/10/33/1120981033.db2.gz PVPLIUZADSFQNB-INIZCTEOSA-N 1 3 290.495 3.667 20 0 CHADHO CCCC[C@@H](CC)[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663467501 1120981784 /nfs/dbraw/zinc/98/17/84/1120981784.db2.gz GJJUJNFHQLQIPO-DLBZAZTESA-N 1 3 266.473 3.667 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H]1CCCN(CC2CC2)C1)C1CCCC1 ZINC000663466625 1120982926 /nfs/dbraw/zinc/98/29/26/1120982926.db2.gz WCTQJMLGVSYBPD-FUHWJXTLSA-N 1 3 278.484 3.667 20 0 CHADHO CC[C@H](NC[C@H]1CCC[N@H+](CC2CC2)C1)c1ccccc1 ZINC000663470181 1120985185 /nfs/dbraw/zinc/98/51/85/1120985185.db2.gz SSKHBUYHOKMJMM-MJGOQNOKSA-N 1 3 286.463 3.849 20 0 CHADHO CC[C@H](NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1 ZINC000663470181 1120985190 /nfs/dbraw/zinc/98/51/90/1120985190.db2.gz SSKHBUYHOKMJMM-MJGOQNOKSA-N 1 3 286.463 3.849 20 0 CHADHO CCCC(CCC)[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663472180 1120985546 /nfs/dbraw/zinc/98/55/46/1120985546.db2.gz ZHFGIUDMGUJKOX-MRXNPFEDSA-N 1 3 266.473 3.667 20 0 CHADHO CC(C)c1ccc([C@@H](C)[NH2+]CCCN2CCCC2)cc1 ZINC000021803164 1121217771 /nfs/dbraw/zinc/21/77/71/1121217771.db2.gz HIJVDQJDHNSFNQ-MRXNPFEDSA-N 1 3 274.452 3.947 20 0 CHADHO CCc1ccc([C@H](N[C@H]2CCC[NH2+]CC2)C(C)C)cc1 ZINC000261596734 1121241902 /nfs/dbraw/zinc/24/19/02/1121241902.db2.gz PJZDLDIAAPQJPL-ZWKOTPCHSA-N 1 3 274.452 3.678 20 0 CHADHO CC(C)[NH+]1CCC(N[C@@H]2C[C@H](C)c3ccccc32)CC1 ZINC000274223531 1121273826 /nfs/dbraw/zinc/27/38/26/1121273826.db2.gz OMQOOVNFFLAHNH-KBXCAEBGSA-N 1 3 272.436 3.697 20 0 CHADHO Fc1ccc(C[NH2+]C[C@H]2CCN(C3CC3)C2)c2ccccc12 ZINC000631039853 1128980092 /nfs/dbraw/zinc/98/00/92/1128980092.db2.gz NBHAUDNOQAZTIK-CQSZACIVSA-N 1 3 298.405 3.553 20 0 CHADHO Fc1ccc(CNC[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc12 ZINC000631039853 1128980096 /nfs/dbraw/zinc/98/00/96/1128980096.db2.gz NBHAUDNOQAZTIK-CQSZACIVSA-N 1 3 298.405 3.553 20 0 CHADHO CC(C)CC[N@@H+]1CCC[C@H]1CCN1CCC(C)CC1 ZINC001175350066 1121291517 /nfs/dbraw/zinc/29/15/17/1121291517.db2.gz HUWUDPNBFRTYGM-KRWDZBQOSA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)CC[N@H+]1CCC[C@H]1CCN1CCC(C)CC1 ZINC001175350066 1121291525 /nfs/dbraw/zinc/29/15/25/1121291525.db2.gz HUWUDPNBFRTYGM-KRWDZBQOSA-N 1 3 266.473 3.619 20 0 CHADHO Fc1ccc(CNC[C@H]2CC[N@H+](C3CC3)C2)c2ccccc12 ZINC000631039853 1128980099 /nfs/dbraw/zinc/98/00/99/1128980099.db2.gz NBHAUDNOQAZTIK-CQSZACIVSA-N 1 3 298.405 3.553 20 0 CHADHO CN1CC[C@@]2(C1)CCC[N@H+](Cc1ccc(C(F)F)cc1)C2 ZINC000660662381 1121368477 /nfs/dbraw/zinc/36/84/77/1121368477.db2.gz JKEQXEHIZKGZHF-QGZVFWFLSA-N 1 3 294.389 3.542 20 0 CHADHO CN1CC[C@@]2(C1)CCC[N@@H+](Cc1ccc(C(F)F)cc1)C2 ZINC000660662381 1121368488 /nfs/dbraw/zinc/36/84/88/1121368488.db2.gz JKEQXEHIZKGZHF-QGZVFWFLSA-N 1 3 294.389 3.542 20 0 CHADHO CC1(C[NH2+][C@@H]2CCC[C@H]3CN(Cc4ccccc4)C[C@H]32)CC1 ZINC000512632103 1121500764 /nfs/dbraw/zinc/50/07/64/1121500764.db2.gz WZFPPCMYKDZNHK-IPMKNSEASA-N 1 3 298.474 3.677 20 0 CHADHO C1[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)C12CCCC2 ZINC000429427085 1121576637 /nfs/dbraw/zinc/57/66/37/1121576637.db2.gz OCIIYARDDGNLPE-QGZVFWFLSA-N 1 3 276.468 3.706 20 0 CHADHO C1[C@@H](NC2CC[NH+](C3CCCCC3)CC2)C12CCCC2 ZINC000429427085 1121576642 /nfs/dbraw/zinc/57/66/42/1121576642.db2.gz OCIIYARDDGNLPE-QGZVFWFLSA-N 1 3 276.468 3.706 20 0 CHADHO NC[C@@H]1CCCC[N@@H+]1Cc1ccc(-c2cccs2)cc1 ZINC001204931767 1121715506 /nfs/dbraw/zinc/71/55/06/1121715506.db2.gz DWYJHRVCPBKTRV-INIZCTEOSA-N 1 3 286.444 3.728 20 0 CHADHO NC[C@@H]1CCCC[N@H+]1Cc1ccc(-c2cccs2)cc1 ZINC001204931767 1121715511 /nfs/dbraw/zinc/71/55/11/1121715511.db2.gz DWYJHRVCPBKTRV-INIZCTEOSA-N 1 3 286.444 3.728 20 0 CHADHO NC[C@H]1CCCC[N@@H+]1Cc1ccc(-c2cccs2)cc1 ZINC001204931770 1121717315 /nfs/dbraw/zinc/71/73/15/1121717315.db2.gz DWYJHRVCPBKTRV-MRXNPFEDSA-N 1 3 286.444 3.728 20 0 CHADHO NC[C@H]1CCCC[N@H+]1Cc1ccc(-c2cccs2)cc1 ZINC001204931770 1121717319 /nfs/dbraw/zinc/71/73/19/1121717319.db2.gz DWYJHRVCPBKTRV-MRXNPFEDSA-N 1 3 286.444 3.728 20 0 CHADHO CCC1CCC([NH2+]CCCN2C[C@H](C)C[C@@H](C)C2)CC1 ZINC001177295006 1121720824 /nfs/dbraw/zinc/72/08/24/1121720824.db2.gz WAGFALRNLAIJAH-MRLCAUJQSA-N 1 3 280.500 3.913 20 0 CHADHO Cc1c(F)ccc(CN2CCC[C@@](C)(C[NH3+])CC2)c1Cl ZINC001206325751 1121779544 /nfs/dbraw/zinc/77/95/44/1121779544.db2.gz IUFOBTPGALDWDF-MRXNPFEDSA-N 1 3 298.833 3.738 20 0 CHADHO CC1(C)CCC[C@@H]([NH2+]C[C@H]2CCCN(CC3CC3)C2)C1 ZINC001179259527 1121866618 /nfs/dbraw/zinc/86/66/18/1121866618.db2.gz UTKWSZGSUMOJAZ-IAGOWNOFSA-N 1 3 278.484 3.667 20 0 CHADHO Cc1cc(C)c(/C=C/CN[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@H]23)c(C)c1 ZINC001179817264 1121913115 /nfs/dbraw/zinc/91/31/15/1121913115.db2.gz PHTVTKIWLOQGPE-MWPBCCPNSA-N 1 3 298.474 3.555 20 0 CHADHO Cc1cc(C)c(/C=C/CN[C@@H]2CC[C@@H]3C[N@H+](C)C[C@H]23)c(C)c1 ZINC001179817264 1121913118 /nfs/dbraw/zinc/91/31/18/1121913118.db2.gz PHTVTKIWLOQGPE-MWPBCCPNSA-N 1 3 298.474 3.555 20 0 CHADHO CCC(CC)(NC[C@H]1CC[NH2+]C1)c1ccc(Cl)cc1 ZINC000647892326 1121966677 /nfs/dbraw/zinc/96/66/77/1121966677.db2.gz VCRMJKWAPCETTN-ZDUSSCGKSA-N 1 3 280.843 3.554 20 0 CHADHO C[C@@H](N)C[N@H+]([C@@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000420322913 1121995960 /nfs/dbraw/zinc/99/59/60/1121995960.db2.gz SSPKKZMHEXPACE-KGLIPLIRSA-N 1 3 268.404 3.712 20 0 CHADHO C[C@@H](N)C[N@@H+]([C@@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000420322913 1121995963 /nfs/dbraw/zinc/99/59/63/1121995963.db2.gz SSPKKZMHEXPACE-KGLIPLIRSA-N 1 3 268.404 3.712 20 0 CHADHO C[C@@H](CC[NH2+][C@@H](C)C1CCCCC1)N1CCCCC1 ZINC001180809261 1122017678 /nfs/dbraw/zinc/01/76/78/1122017678.db2.gz CHLBFDBQGICQBR-HOTGVXAUSA-N 1 3 266.473 3.809 20 0 CHADHO C[C@@H](C[N@H+](C)CCCN1CCCC1)c1cccc(Cl)c1 ZINC001181234589 1122044064 /nfs/dbraw/zinc/04/40/64/1122044064.db2.gz MLPGBHYNZFNGOW-HNNXBMFYSA-N 1 3 294.870 3.861 20 0 CHADHO C[C@@H](C[N@@H+](C)CCCN1CCCC1)c1cccc(Cl)c1 ZINC001181234589 1122044070 /nfs/dbraw/zinc/04/40/70/1122044070.db2.gz MLPGBHYNZFNGOW-HNNXBMFYSA-N 1 3 294.870 3.861 20 0 CHADHO CCN(CC)CCC[N@H+](CC)C[C@@H]1CCCC[C@@H]1C ZINC001181506321 1122059823 /nfs/dbraw/zinc/05/98/23/1122059823.db2.gz PYRGYUURUDAMIP-IRXDYDNUSA-N 1 3 268.489 3.867 20 0 CHADHO CCN(CC)CCC[N@@H+](CC)C[C@@H]1CCCC[C@@H]1C ZINC001181506321 1122059825 /nfs/dbraw/zinc/05/98/25/1122059825.db2.gz PYRGYUURUDAMIP-IRXDYDNUSA-N 1 3 268.489 3.867 20 0 CHADHO C[C@]12C[C@H]1CCC[C@H]2[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000502241507 1122061851 /nfs/dbraw/zinc/06/18/51/1122061851.db2.gz MFRNUKKTIPVFGN-LZQZEXGQSA-N 1 3 290.495 3.952 20 0 CHADHO CN1CCC[C@@H]1CC[N@@H+]1CCCC[C@H]1c1ccc(F)cc1 ZINC000502924500 1122158201 /nfs/dbraw/zinc/15/82/01/1122158201.db2.gz DSNIMYPYHQKBMV-MSOLQXFVSA-N 1 3 290.426 3.837 20 0 CHADHO CN1CCC[C@@H]1CC[N@H+]1CCCC[C@H]1c1ccc(F)cc1 ZINC000502924500 1122158203 /nfs/dbraw/zinc/15/82/03/1122158203.db2.gz DSNIMYPYHQKBMV-MSOLQXFVSA-N 1 3 290.426 3.837 20 0 CHADHO CN1CCC[C@H]1CC[NH2+]C1(c2ccc(F)cc2)CCCC1 ZINC000503065471 1122164716 /nfs/dbraw/zinc/16/47/16/1122164716.db2.gz VMTPLDRODHUXLA-KRWDZBQOSA-N 1 3 290.426 3.669 20 0 CHADHO C[N@@H+]1CCC[C@H]1CCNC1(c2ccc(F)cc2)CCCC1 ZINC000503065471 1122164718 /nfs/dbraw/zinc/16/47/18/1122164718.db2.gz VMTPLDRODHUXLA-KRWDZBQOSA-N 1 3 290.426 3.669 20 0 CHADHO C[N@H+]1CCC[C@H]1CCNC1(c2ccc(F)cc2)CCCC1 ZINC000503065471 1122164723 /nfs/dbraw/zinc/16/47/23/1122164723.db2.gz VMTPLDRODHUXLA-KRWDZBQOSA-N 1 3 290.426 3.669 20 0 CHADHO C[C@H](CN(C)C)[C@@H]1CCCC[N@@H+]1Cc1cc2ccccc2[nH]1 ZINC001183065551 1122204618 /nfs/dbraw/zinc/20/46/18/1122204618.db2.gz LXRYGCQTCXCVQC-BEFAXECRSA-N 1 3 299.462 3.720 20 0 CHADHO C[C@H](CN(C)C)[C@@H]1CCCC[N@H+]1Cc1cc2ccccc2[nH]1 ZINC001183065551 1122204620 /nfs/dbraw/zinc/20/46/20/1122204620.db2.gz LXRYGCQTCXCVQC-BEFAXECRSA-N 1 3 299.462 3.720 20 0 CHADHO CC(C)(C)c1cccc(CN2CCCC[C@](C)(C[NH3+])C2)c1 ZINC001206556435 1122204663 /nfs/dbraw/zinc/20/46/63/1122204663.db2.gz RRZKFGYWILHKMT-LJQANCHMSA-N 1 3 288.479 3.935 20 0 CHADHO c1ccc(CN2C[C@@H]3CCCC[C@H]([NH2+]CC4CC4)[C@@H]3C2)cc1 ZINC000514103653 1122375867 /nfs/dbraw/zinc/37/58/67/1122375867.db2.gz DFQCWVVPKSHUNJ-ZCNNSNEGSA-N 1 3 298.474 3.677 20 0 CHADHO CCN(Cc1cc(C)c2ncccc2c1)[C@H]1CCC[NH2+]CC1 ZINC000435390113 1122462502 /nfs/dbraw/zinc/46/25/02/1122462502.db2.gz ABTRDOLNQQZGQI-SFHVURJKSA-N 1 3 297.446 3.507 20 0 CHADHO C[C@H]1CCCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167960473 1122517625 /nfs/dbraw/zinc/51/76/25/1122517625.db2.gz ZEZPGRLEPVKOLO-AVAUJXNBSA-N 1 3 276.468 3.560 20 0 CHADHO CC(C)CN1CCC[C@@H](C[NH2+][C@H]2CCC(C)(C)C2)C1 ZINC000516038656 1122563923 /nfs/dbraw/zinc/56/39/23/1122563923.db2.gz WVUHWDXTIGIHKM-HOTGVXAUSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)C(CN[C@H](CC[NH+](C)C)c1cccnc1)C(C)C ZINC001203749742 1122628052 /nfs/dbraw/zinc/62/80/52/1122628052.db2.gz BOXLXTWHDLBJQL-GOSISDBHSA-N 1 3 291.483 3.592 20 0 CHADHO C(=C/C1CC1)\CN[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716693197 1122636362 /nfs/dbraw/zinc/63/63/62/1122636362.db2.gz OPHFIYMBASPBLC-RLOFBJMHSA-N 1 3 296.458 3.595 20 0 CHADHO C(=C/C1CC1)\CN[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716693197 1122636365 /nfs/dbraw/zinc/63/63/65/1122636365.db2.gz OPHFIYMBASPBLC-RLOFBJMHSA-N 1 3 296.458 3.595 20 0 CHADHO C(=C/C1CC1)\C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000716693197 1122636367 /nfs/dbraw/zinc/63/63/67/1122636367.db2.gz OPHFIYMBASPBLC-RLOFBJMHSA-N 1 3 296.458 3.595 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H]1CCC[C@@H]1CCC(C)C ZINC001193495408 1122693338 /nfs/dbraw/zinc/69/33/38/1122693338.db2.gz AZPLDLXUPVQERE-IAGOWNOFSA-N 1 3 268.489 3.913 20 0 CHADHO C[C@@H](NCC(C)(C)[NH2+][C@@H](C)c1ccccc1)[C@@H]1CC1(F)F ZINC000638602030 1122764472 /nfs/dbraw/zinc/76/44/72/1122764472.db2.gz RHUUALXEPORNPT-GUTXKFCHSA-N 1 3 296.405 3.749 20 0 CHADHO C[C@H]1CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001167972923 1122869970 /nfs/dbraw/zinc/86/99/70/1122869970.db2.gz FDVRBXPPNPYXMM-UBZVNHDXSA-N 1 3 276.468 3.560 20 0 CHADHO CCCC1([NH2+]C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CCC1 ZINC001167975285 1122879730 /nfs/dbraw/zinc/87/97/30/1122879730.db2.gz NQCGUAFSCQMVNO-ALOPSCKCSA-N 1 3 276.468 3.704 20 0 CHADHO CC1CCN(CC[C@H]2CCC[N@@H+]2[C@@H]2C=CCCC2)CC1 ZINC001196936129 1122939960 /nfs/dbraw/zinc/93/99/60/1122939960.db2.gz PYTIUGZNYKESQD-QZTJIDSGSA-N 1 3 276.468 3.682 20 0 CHADHO CC1CCN(CC[C@H]2CCC[N@H+]2[C@@H]2C=CCCC2)CC1 ZINC001196936129 1122939965 /nfs/dbraw/zinc/93/99/65/1122939965.db2.gz PYTIUGZNYKESQD-QZTJIDSGSA-N 1 3 276.468 3.682 20 0 CHADHO CC1CC[NH+](CC[C@H]2CCCN2[C@@H]2C=CCCC2)CC1 ZINC001196936129 1122939970 /nfs/dbraw/zinc/93/99/70/1122939970.db2.gz PYTIUGZNYKESQD-QZTJIDSGSA-N 1 3 276.468 3.682 20 0 CHADHO CC(C)C[C@H](CN1CC[C@@H]2[NH2+]CC[C@@H]2C1)c1ccccc1 ZINC000427120195 1122944705 /nfs/dbraw/zinc/94/47/05/1122944705.db2.gz AHMZKWRLXVPXNB-QRVBRYPASA-N 1 3 286.463 3.500 20 0 CHADHO CC[C@@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)c1cccc(F)c1 ZINC000187964815 1122981939 /nfs/dbraw/zinc/98/19/39/1122981939.db2.gz SXSDWFSGSASGBR-CRAIPNDOSA-N 1 3 292.442 3.987 20 0 CHADHO CC(C)C[C@H](C)C[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000305997051 1122992253 /nfs/dbraw/zinc/99/22/53/1122992253.db2.gz UMQGSUKRTLKLGR-AWEZNQCLSA-N 1 3 254.462 3.521 20 0 CHADHO Cc1cc(C)c(/C=C/CNC2CC[NH+](C3CC3)CC2)c(C)c1 ZINC001199077949 1123020529 /nfs/dbraw/zinc/02/05/29/1123020529.db2.gz MVEMOARIGWGSLE-SNAWJCMRSA-N 1 3 298.474 3.841 20 0 CHADHO Cc1ccc(C)c(C[NH2+]C2CCN(CC(C)C)CC2)c1 ZINC001199144949 1123021188 /nfs/dbraw/zinc/02/11/88/1123021188.db2.gz ZXTTTZRXEGMPPC-UHFFFAOYSA-N 1 3 274.452 3.513 20 0 CHADHO CSc1ccccc1[C@H](C)[NH2+]CCCN1CCCCC1 ZINC000440608688 1123021275 /nfs/dbraw/zinc/02/12/75/1123021275.db2.gz DWJARSURPGUELE-HNNXBMFYSA-N 1 3 292.492 3.935 20 0 CHADHO C[C@@H](C[NH2+]C[C@@H](C)CN1CCCC1)CC1CCCCC1 ZINC001199403578 1123030080 /nfs/dbraw/zinc/03/00/80/1123030080.db2.gz VYWVHKRHBGWJHG-IAGOWNOFSA-N 1 3 280.500 3.914 20 0 CHADHO CCCCCN1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC001201737580 1123143421 /nfs/dbraw/zinc/14/34/21/1123143421.db2.gz VQEMYFSOEJKNEJ-RBUKOAKNSA-N 1 3 286.463 3.631 20 0 CHADHO CCCCCN1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC001201737580 1123143423 /nfs/dbraw/zinc/14/34/23/1123143423.db2.gz VQEMYFSOEJKNEJ-RBUKOAKNSA-N 1 3 286.463 3.631 20 0 CHADHO C(C1CCCC1)N1CCC([NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)CC1 ZINC001201857661 1123153412 /nfs/dbraw/zinc/15/34/12/1123153412.db2.gz SMPVYLFXXLENSJ-DZFIZOCASA-N 1 3 290.495 3.809 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[NH+]1CCC2(CN(C)C2)CC1 ZINC001201980938 1123159191 /nfs/dbraw/zinc/15/91/91/1123159191.db2.gz HGGYBTMDUPLQIL-QGZVFWFLSA-N 1 3 278.484 3.787 20 0 CHADHO CCN1CC[C@@H]([N@H+](C)Cc2ccc(Cl)c(C)c2)C[C@@H]1C ZINC000507812446 1123218549 /nfs/dbraw/zinc/21/85/49/1123218549.db2.gz HNISFKPZLGWSKH-GOEBONIOSA-N 1 3 294.870 3.953 20 0 CHADHO CCN1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)c(C)c2)C[C@@H]1C ZINC000507812446 1123218551 /nfs/dbraw/zinc/21/85/51/1123218551.db2.gz HNISFKPZLGWSKH-GOEBONIOSA-N 1 3 294.870 3.953 20 0 CHADHO CCN1CC[C@H]([N@H+](C)Cc2ccc(Cl)c(C)c2)C[C@@H]1C ZINC000507812449 1123218930 /nfs/dbraw/zinc/21/89/30/1123218930.db2.gz HNISFKPZLGWSKH-HOCLYGCPSA-N 1 3 294.870 3.953 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)Cc2ccc(Cl)c(C)c2)C[C@@H]1C ZINC000507812449 1123218934 /nfs/dbraw/zinc/21/89/34/1123218934.db2.gz HNISFKPZLGWSKH-HOCLYGCPSA-N 1 3 294.870 3.953 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+]C1CCC(C(F)F)CC1 ZINC000442643952 1123331797 /nfs/dbraw/zinc/33/17/97/1123331797.db2.gz GZEKZPBQPOHGNF-WLYUNCDWSA-N 1 3 288.426 3.664 20 0 CHADHO CC(C)(CN[C@@H]1C[C@@H]([NH3+])c2ccccc21)CC(F)(F)F ZINC000665301093 1123350242 /nfs/dbraw/zinc/35/02/42/1123350242.db2.gz OCSBKMGFILUBIP-CHWSQXEVSA-N 1 3 286.341 3.699 20 0 CHADHO CCN1CCC[C@H](C[NH2+]C[C@H](C)CCc2ccccc2)C1 ZINC001648959959 1123439030 /nfs/dbraw/zinc/43/90/30/1123439030.db2.gz HDVINWGIQWAXEL-IEBWSBKVSA-N 1 3 288.479 3.577 20 0 CHADHO CCN1CCC[C@@H](C[NH2+]C[C@H](c2ccccc2)C(C)C)C1 ZINC000474604002 1123557420 /nfs/dbraw/zinc/55/74/20/1123557420.db2.gz PYMCCEIBJHDQEA-HKUYNNGSSA-N 1 3 288.479 3.748 20 0 CHADHO C[C@H](c1cccc2ccccc21)N1CC[C@@]2(CC[NH2+]C2)C1 ZINC000313870178 1129129773 /nfs/dbraw/zinc/12/97/73/1129129773.db2.gz QSRIHCMKEZARSW-DNVCBOLYSA-N 1 3 280.415 3.586 20 0 CHADHO C[C@H]1CCCC[N@@H+]1CCCNc1ccnc2ccccc21 ZINC000041720331 1123594792 /nfs/dbraw/zinc/59/47/92/1123594792.db2.gz SMWOLBGOZCZJJC-HNNXBMFYSA-N 1 3 283.419 3.911 20 0 CHADHO C[C@H]1CCCC[N@H+]1CCCNc1ccnc2ccccc21 ZINC000041720331 1123594795 /nfs/dbraw/zinc/59/47/95/1123594795.db2.gz SMWOLBGOZCZJJC-HNNXBMFYSA-N 1 3 283.419 3.911 20 0 CHADHO CC(C)[C@H]([NH3+])CCN(C)Cc1cccc(-c2ccncc2)c1 ZINC000346686667 1123708511 /nfs/dbraw/zinc/70/85/11/1123708511.db2.gz SASRBXAZFRGZDX-LJQANCHMSA-N 1 3 297.446 3.554 20 0 CHADHO Cc1ccsc1[C@@H](C)[NH2+]CC[C@@H](C)N1CCCCC1 ZINC000544374997 1123747334 /nfs/dbraw/zinc/74/73/34/1123747334.db2.gz JOYGFELKENUZIE-HUUCEWRRSA-N 1 3 280.481 3.972 20 0 CHADHO Cc1cccc([C@@H](C)[NH2+]CCCN2CCC(C)CC2)c1 ZINC000037233701 1123767001 /nfs/dbraw/zinc/76/70/01/1123767001.db2.gz VKFLDESIVKIZLD-QGZVFWFLSA-N 1 3 274.452 3.768 20 0 CHADHO Cc1cc2c(c(C)c1)[C@@H](NC1CC[NH+](C3CCC3)CC1)CC2 ZINC000655702334 1123772061 /nfs/dbraw/zinc/77/20/61/1123772061.db2.gz UCUYARRDBGWXHN-IBGZPJMESA-N 1 3 298.474 3.897 20 0 CHADHO CCC[NH+]1CCC(Nc2ccnc3ccc(C)cc32)CC1 ZINC000302175681 1123959621 /nfs/dbraw/zinc/95/96/21/1123959621.db2.gz WYKXRYDGKAGCRC-UHFFFAOYSA-N 1 3 283.419 3.830 20 0 CHADHO CCC(CC)(CN[C@@H]1CC[N@@H+]2CCC[C@H]2C1)C(F)(F)F ZINC000865756295 1124010977 /nfs/dbraw/zinc/01/09/77/1124010977.db2.gz IYDDWGMDCFWNHQ-OLZOCXBDSA-N 1 3 292.389 3.572 20 0 CHADHO CCC(CC)(CN[C@@H]1CC[N@H+]2CCC[C@H]2C1)C(F)(F)F ZINC000865756295 1124010982 /nfs/dbraw/zinc/01/09/82/1124010982.db2.gz IYDDWGMDCFWNHQ-OLZOCXBDSA-N 1 3 292.389 3.572 20 0 CHADHO C[C@H](C[NH2+]CC[C@H](C)N1CCCCC1)c1ccccc1 ZINC000446759678 1124122220 /nfs/dbraw/zinc/12/22/20/1124122220.db2.gz PVPNZRNMFKWRMZ-SJORKVTESA-N 1 3 274.452 3.644 20 0 CHADHO C[C@@H]([NH2+]CC[C@H]1CCCCN1C)c1cc2ccccc2o1 ZINC000526949595 1124527583 /nfs/dbraw/zinc/52/75/83/1124527583.db2.gz HDHCIEANHCUMIE-GDBMZVCRSA-N 1 3 286.419 3.958 20 0 CHADHO C[C@@H]([NH2+]CCCC(F)(F)F)[C@@H]1CCCN(C2CCC2)C1 ZINC001119931336 1131267121 /nfs/dbraw/zinc/26/71/21/1131267121.db2.gz KXBHLRKSTPMPIX-CHWSQXEVSA-N 1 3 292.389 3.572 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2cccc3ccoc32)C[C@@H]1C ZINC000449033239 1124636770 /nfs/dbraw/zinc/63/67/70/1124636770.db2.gz ZEIGBMOSWUASOA-YOEHRIQHSA-N 1 3 286.419 3.737 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2cccc3ccoc32)C[C@@H]1C ZINC000449033239 1124636774 /nfs/dbraw/zinc/63/67/74/1124636774.db2.gz ZEIGBMOSWUASOA-YOEHRIQHSA-N 1 3 286.419 3.737 20 0 CHADHO CC[C@H]([NH2+]C1CCN(CC2CCCC2)CC1)C1CCC1 ZINC000449107332 1124648254 /nfs/dbraw/zinc/64/82/54/1124648254.db2.gz PHVYFRPCFIAVMB-SFHVURJKSA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)=CCNC1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449278655 1124681525 /nfs/dbraw/zinc/68/15/25/1124681525.db2.gz LFHDNGBGAZXWQG-QGZVFWFLSA-N 1 3 286.463 3.638 20 0 CHADHO C[C@@H](NCc1cccs1)c1cccc(C[NH+](C)C)c1 ZINC000820806014 1131301935 /nfs/dbraw/zinc/30/19/35/1131301935.db2.gz XKBAQHZBGDLDJK-CYBMUJFWSA-N 1 3 274.433 3.661 20 0 CHADHO CC[C@H](N[C@@H](C)c1cccc(C[NH+](C)C)c1)c1ccncc1 ZINC000820811133 1131302461 /nfs/dbraw/zinc/30/24/61/1131302461.db2.gz LHKOVTROXHGGQJ-KXBFYZLASA-N 1 3 297.446 3.945 20 0 CHADHO C[C@@H](CSc1ccc(Cl)cc1)N[C@H]1CCC[NH2+]CC1 ZINC001246099895 1131317123 /nfs/dbraw/zinc/31/71/23/1131317123.db2.gz YZAZSEAQHGRRTJ-JSGCOSHPSA-N 1 3 298.883 3.552 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@H]2[NH2+][C@@H]2CCNC23CCC3)cc1 ZINC000530176269 1125129698 /nfs/dbraw/zinc/12/96/98/1125129698.db2.gz AGEIQBYPQBAEKJ-RCCFBDPRSA-N 1 3 284.447 3.505 20 0 CHADHO c1ccc([C@@H]2CCCC[C@@H]2[NH2+][C@H]2CCNC23CCC3)cc1 ZINC000530177149 1125130015 /nfs/dbraw/zinc/13/00/15/1125130015.db2.gz HRUPILPMQWZXIQ-BZSNNMDCSA-N 1 3 284.447 3.587 20 0 CHADHO CCC(F)(F)C(C)(C)C[NH2+][C@@H]1C[C@H](N)c2ccccc21 ZINC000530218448 1125134694 /nfs/dbraw/zinc/13/46/94/1125134694.db2.gz MLSGIQKDULDOJO-UONOGXRCSA-N 1 3 282.378 3.792 20 0 CHADHO CCc1ccc(CCN(C)[C@@H]2CC[N@@H+](CC)[C@H](C)C2)cc1 ZINC000530901510 1125185601 /nfs/dbraw/zinc/18/56/01/1125185601.db2.gz GNVRNFKHUQHJAC-VQIMIIECSA-N 1 3 288.479 3.596 20 0 CHADHO CCc1ccc(CCN(C)[C@@H]2CC[N@H+](CC)[C@H](C)C2)cc1 ZINC000530901510 1125185603 /nfs/dbraw/zinc/18/56/03/1125185603.db2.gz GNVRNFKHUQHJAC-VQIMIIECSA-N 1 3 288.479 3.596 20 0 CHADHO CC[C@H](CCC(F)(F)F)[NH2+][C@@H]1CCC[C@H](N(C)C)C1 ZINC000872041585 1125265074 /nfs/dbraw/zinc/26/50/74/1125265074.db2.gz UPYOHMHIBMQPIZ-UPJWGTAASA-N 1 3 280.378 3.570 20 0 CHADHO CC[C@@H](NC1CC[NH+](CC2CC2)CC1)c1ccccc1 ZINC000666199106 1125313347 /nfs/dbraw/zinc/31/33/47/1125313347.db2.gz ALFAYSZFXGECAL-GOSISDBHSA-N 1 3 272.436 3.602 20 0 CHADHO CC[C@H](C)C[C@H](CC)[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000040622061 1125388918 /nfs/dbraw/zinc/38/89/18/1125388918.db2.gz RCRYLDLUSLMNLT-JYJNAYRXSA-N 1 3 254.462 3.521 20 0 CHADHO Cc1ccccc1C1CC([NH2+]C[C@H]2CCN(C(C)C)C2)C1 ZINC000040622766 1125389015 /nfs/dbraw/zinc/38/90/15/1125389015.db2.gz ODYWUFWKZWTMEZ-WWDZGPRUSA-N 1 3 286.463 3.561 20 0 CHADHO CCCCN1CCC([NH2+]Cc2ccc3[nH]ccc3c2)CC1 ZINC000229632737 1125395016 /nfs/dbraw/zinc/39/50/16/1125395016.db2.gz GLRVSSSZCPFWFS-UHFFFAOYSA-N 1 3 285.435 3.522 20 0 CHADHO CC[C@H](NC[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1 ZINC000125782760 1125452022 /nfs/dbraw/zinc/45/20/22/1125452022.db2.gz NYISISIFOCYTHP-WMZOPIPTSA-N 1 3 274.452 3.848 20 0 CHADHO CC[C@H](NC[C@@H]1CCC[N@H+](C(C)C)C1)c1ccccc1 ZINC000125782760 1125452025 /nfs/dbraw/zinc/45/20/25/1125452025.db2.gz NYISISIFOCYTHP-WMZOPIPTSA-N 1 3 274.452 3.848 20 0 CHADHO CC[C@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)c1ccccc1 ZINC000125782760 1125452027 /nfs/dbraw/zinc/45/20/27/1125452027.db2.gz NYISISIFOCYTHP-WMZOPIPTSA-N 1 3 274.452 3.848 20 0 CHADHO CC[C@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)c1ccc(F)cc1 ZINC000125950053 1125452769 /nfs/dbraw/zinc/45/27/69/1125452769.db2.gz UQCPYZUWSBXLLW-YJBOKZPZSA-N 1 3 292.442 3.987 20 0 CHADHO NC[C@@H]1CCCC[N@H+](CC2(c3ccccc3)CCCC2)C1 ZINC001206606213 1129380565 /nfs/dbraw/zinc/38/05/65/1129380565.db2.gz HEZVUYPIIGVLEW-KRWDZBQOSA-N 1 3 286.463 3.559 20 0 CHADHO NC[C@@H]1CCCC[N@@H+](CC2(c3ccccc3)CCCC2)C1 ZINC001206606213 1129380569 /nfs/dbraw/zinc/38/05/69/1129380569.db2.gz HEZVUYPIIGVLEW-KRWDZBQOSA-N 1 3 286.463 3.559 20 0 CHADHO C1CC2(C1)C[C@H]([NH2+][C@H]1CCCCC13CCCC3)CCN2 ZINC000643548151 1129445602 /nfs/dbraw/zinc/44/56/02/1129445602.db2.gz NCKVPRSXRYERRZ-CVEARBPZSA-N 1 3 276.468 3.754 20 0 CHADHO c1ccc([C@@H]2CC[C@H]([NH2+][C@@H]3CCNC4(CCC4)C3)C2)cc1 ZINC000643548867 1129446176 /nfs/dbraw/zinc/44/61/76/1129446176.db2.gz WKMFZAKCGPWTIR-FGTMMUONSA-N 1 3 284.447 3.587 20 0 CHADHO CC(C)C[C@H](CN1CCC(C)([NH3+])CC1)c1ccccc1 ZINC000647530993 1129580309 /nfs/dbraw/zinc/58/03/09/1129580309.db2.gz UMQKYFMDMBEAJE-QGZVFWFLSA-N 1 3 274.452 3.630 20 0 CHADHO CCOc1cccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)c1 ZINC000766480741 1129670991 /nfs/dbraw/zinc/67/09/91/1129670991.db2.gz UUIDPMSUVPYUDZ-USXIJHARSA-N 1 3 290.451 3.609 20 0 CHADHO CCC[N@H+](CCCN)[C@@H](Cc1ccccc1)CC(C)C ZINC001169050199 1129692008 /nfs/dbraw/zinc/69/20/08/1129692008.db2.gz NDYRCEVYOWWVOW-GOSISDBHSA-N 1 3 276.468 3.705 20 0 CHADHO CN1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccc3ccccc3c1)C2 ZINC001169089309 1129699402 /nfs/dbraw/zinc/69/94/02/1129699402.db2.gz BCCYNVDEIDOFME-LDLYASANSA-N 1 3 280.415 3.555 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@H](N[C@@H](c1ccccc1)C(C)(C)C)C2 ZINC001169091434 1129700025 /nfs/dbraw/zinc/70/00/25/1129700025.db2.gz QZRFTRJSEVQFEP-FJIDUMEYSA-N 1 3 286.463 3.989 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](N[C@@H](c1ccccc1)C(C)(C)C)C2 ZINC001169091434 1129700027 /nfs/dbraw/zinc/70/00/27/1129700027.db2.gz QZRFTRJSEVQFEP-FJIDUMEYSA-N 1 3 286.463 3.989 20 0 CHADHO CCCC[C@H]1C[C@H]([NH2+]C(CCC)CCC)CCN1 ZINC001246196465 1131391959 /nfs/dbraw/zinc/39/19/59/1131391959.db2.gz FYUMBHLYBXIYKI-JKSUJKDBSA-N 1 3 254.462 3.856 20 0 CHADHO CC[NH+]1CCC(N[C@H](C)c2ccc(Cl)cc2C)CC1 ZINC001169238596 1129712101 /nfs/dbraw/zinc/71/21/01/1129712101.db2.gz JGOVBHWYMQYPJL-CYBMUJFWSA-N 1 3 280.843 3.783 20 0 CHADHO CCc1cc(N2CCC[C@H]([NH3+])c3cc(C)ccc32)ccn1 ZINC001169689417 1129746702 /nfs/dbraw/zinc/74/67/02/1129746702.db2.gz JCACFMKRTTXDBQ-KRWDZBQOSA-N 1 3 281.403 3.884 20 0 CHADHO CC[N@@H+]1CC[C@H](NCc2cccc3ccsc32)[C@@H](C)C1 ZINC000651863662 1129750657 /nfs/dbraw/zinc/75/06/57/1129750657.db2.gz SKNVMJWBSZJXLW-BBRMVZONSA-N 1 3 288.460 3.721 20 0 CHADHO CC[N@H+]1CC[C@H](NCc2cccc3ccsc32)[C@@H](C)C1 ZINC000651863662 1129750660 /nfs/dbraw/zinc/75/06/60/1129750660.db2.gz SKNVMJWBSZJXLW-BBRMVZONSA-N 1 3 288.460 3.721 20 0 CHADHO CC[N@H+](CCC1CCN(C/C=C\Cl)CC1)CC1CC1 ZINC000771476279 1129981717 /nfs/dbraw/zinc/98/17/17/1129981717.db2.gz WZBJWCQDCILWOV-OQFOIZHKSA-N 1 3 284.875 3.573 20 0 CHADHO CC[N@@H+](CCC1CCN(C/C=C\Cl)CC1)CC1CC1 ZINC000771476279 1129981718 /nfs/dbraw/zinc/98/17/18/1129981718.db2.gz WZBJWCQDCILWOV-OQFOIZHKSA-N 1 3 284.875 3.573 20 0 CHADHO C1CCC(N2CCC([NH2+]C3C[C@@H]4CCC[C@H]4C3)CC2)C1 ZINC000902831943 1130066599 /nfs/dbraw/zinc/06/65/99/1130066599.db2.gz HHKQPOAGNPFXLC-GJZGRUSLSA-N 1 3 276.468 3.562 20 0 CHADHO CC[C@]1(C)CCC[C@@H]1N[C@@H](CC[NH+](C)C)c1cccnc1 ZINC000903378133 1130167870 /nfs/dbraw/zinc/16/78/70/1130167870.db2.gz OSJGJHXTKLSABQ-OKZBNKHCSA-N 1 3 289.467 3.633 20 0 CHADHO CC1(C)CC([NH2+]C2CCN(CC3CCCCC3)CC2)C1 ZINC000788577120 1130195650 /nfs/dbraw/zinc/19/56/50/1130195650.db2.gz MRKJBGNDELTFMC-UHFFFAOYSA-N 1 3 278.484 3.809 20 0 CHADHO CCN(Cc1ccc(Cl)cc1)[C@@H]1CCC[N@H+](C)CC1 ZINC001254525654 1130262289 /nfs/dbraw/zinc/26/22/89/1130262289.db2.gz KKDZNOVDGYPKAO-MRXNPFEDSA-N 1 3 280.843 3.646 20 0 CHADHO CCN(Cc1ccc(Cl)cc1)[C@@H]1CCC[N@@H+](C)CC1 ZINC001254525654 1130262292 /nfs/dbraw/zinc/26/22/92/1130262292.db2.gz KKDZNOVDGYPKAO-MRXNPFEDSA-N 1 3 280.843 3.646 20 0 CHADHO CC(C)(C)[NH2+]Cc1ccc(-c2ccc3[nH]c(N)nc3c2)cc1 ZINC001240373639 1130282941 /nfs/dbraw/zinc/28/29/41/1130282941.db2.gz NEGBDGXHXNGNBS-UHFFFAOYSA-N 1 3 294.402 3.700 20 0 CHADHO CC(C)(C)[NH2+]Cc1ccc(-c2ccc3nc(N)[nH]c3c2)cc1 ZINC001240373639 1130282943 /nfs/dbraw/zinc/28/29/43/1130282943.db2.gz NEGBDGXHXNGNBS-UHFFFAOYSA-N 1 3 294.402 3.700 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2ccccc2C2CC2)[C@@H](C)C1 ZINC000678277434 1130387796 /nfs/dbraw/zinc/38/77/96/1130387796.db2.gz JHNNTKUKKZQPPB-KXBFYZLASA-N 1 3 286.463 3.726 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2ccccc2C2CC2)[C@@H](C)C1 ZINC000678277434 1130387801 /nfs/dbraw/zinc/38/78/01/1130387801.db2.gz JHNNTKUKKZQPPB-KXBFYZLASA-N 1 3 286.463 3.726 20 0 CHADHO FC1(F)CC[C@@H](NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000679071976 1130490415 /nfs/dbraw/zinc/49/04/15/1130490415.db2.gz NBDGIFLOQRLSQK-CQSZACIVSA-N 1 3 286.410 3.561 20 0 CHADHO FC1(F)CC[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000679071976 1130490418 /nfs/dbraw/zinc/49/04/18/1130490418.db2.gz NBDGIFLOQRLSQK-CQSZACIVSA-N 1 3 286.410 3.561 20 0 CHADHO CC(C)[N@H+](CCCCc1ccccc1)[C@@H]1CCCNCC1 ZINC001206579973 1130490996 /nfs/dbraw/zinc/49/09/96/1130490996.db2.gz BPXLWCMVMPTLNO-LJQANCHMSA-N 1 3 288.479 3.862 20 0 CHADHO CC(C)[N@@H+](CCCCc1ccccc1)[C@@H]1CCCNCC1 ZINC001206579973 1130490999 /nfs/dbraw/zinc/49/09/99/1130490999.db2.gz BPXLWCMVMPTLNO-LJQANCHMSA-N 1 3 288.479 3.862 20 0 CHADHO CCC(CC)C[NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000679738935 1130553694 /nfs/dbraw/zinc/55/36/94/1130553694.db2.gz GVHQFAIWSVLKPB-HOCLYGCPSA-N 1 3 266.473 3.665 20 0 CHADHO CCOC1CCC([NH2+]C2CCN(C(CC)CC)CC2)CC1 ZINC001256431343 1130674946 /nfs/dbraw/zinc/67/49/46/1130674946.db2.gz AACLBKKLRDYESX-UHFFFAOYSA-N 1 3 296.499 3.577 20 0 CHADHO CCCCCC[C@@H](C)[NH2+]C1CCC(N2CCOCC2)CC1 ZINC001256681801 1130678171 /nfs/dbraw/zinc/67/81/71/1130678171.db2.gz CRZUTPHDICQPOF-WWDZGPRUSA-N 1 3 296.499 3.578 20 0 CHADHO c1ccc(CCCC[N@@H+]2CCCC[C@@]23CCCNC3)cc1 ZINC001235172991 1130717384 /nfs/dbraw/zinc/71/73/84/1130717384.db2.gz OLZIVGYHHYIDCG-IBGZPJMESA-N 1 3 286.463 3.617 20 0 CHADHO c1ccc(CCCC[N@H+]2CCCC[C@@]23CCCNC3)cc1 ZINC001235172991 1130717386 /nfs/dbraw/zinc/71/73/86/1130717386.db2.gz OLZIVGYHHYIDCG-IBGZPJMESA-N 1 3 286.463 3.617 20 0 CHADHO CC(C)c1ccccc1C[N@@H+]1CCCCC12CCNCC2 ZINC001235189382 1130720733 /nfs/dbraw/zinc/72/07/33/1130720733.db2.gz KAUHLERGOPNIMZ-UHFFFAOYSA-N 1 3 286.463 3.918 20 0 CHADHO CC(C)c1ccccc1C[N@H+]1CCCCC12CCNCC2 ZINC001235189382 1130720737 /nfs/dbraw/zinc/72/07/37/1130720737.db2.gz KAUHLERGOPNIMZ-UHFFFAOYSA-N 1 3 286.463 3.918 20 0 CHADHO CC(C)=CCCC1=CC[C@H](CN2C[C@H]3C[NH2+]CC[C@H]32)CC1 ZINC001235254722 1130729610 /nfs/dbraw/zinc/72/96/10/1130729610.db2.gz CRXYQAGLJSPIBS-IPMKNSEASA-N 1 3 288.479 3.753 20 0 CHADHO CC(C)=CCCC1=CC[C@H](C[N@@H+]2C[C@H]3CNCC[C@H]32)CC1 ZINC001235254722 1130729616 /nfs/dbraw/zinc/72/96/16/1130729616.db2.gz CRXYQAGLJSPIBS-IPMKNSEASA-N 1 3 288.479 3.753 20 0 CHADHO CC(C)=CCCC1=CC[C@H](C[N@H+]2C[C@H]3CNCC[C@H]32)CC1 ZINC001235254722 1130729622 /nfs/dbraw/zinc/72/96/22/1130729622.db2.gz CRXYQAGLJSPIBS-IPMKNSEASA-N 1 3 288.479 3.753 20 0 CHADHO c1ccc([C@H]2CCC[N@@H+](Cc3ccc4c(c3)CNC4)C2)cc1 ZINC001235663366 1130761986 /nfs/dbraw/zinc/76/19/86/1130761986.db2.gz GYJOOGKVAIRZDM-IBGZPJMESA-N 1 3 292.426 3.669 20 0 CHADHO c1ccc([C@H]2CCC[N@H+](Cc3ccc4c(c3)CNC4)C2)cc1 ZINC001235663366 1130761992 /nfs/dbraw/zinc/76/19/92/1130761992.db2.gz GYJOOGKVAIRZDM-IBGZPJMESA-N 1 3 292.426 3.669 20 0 CHADHO CCCCN(CC[C@H]1CCCC[NH2+]1)Cc1ccccc1 ZINC001235663559 1130762893 /nfs/dbraw/zinc/76/28/93/1130762893.db2.gz JABDVPAHDGJZFI-GOSISDBHSA-N 1 3 274.452 3.821 20 0 CHADHO CC[C@@H](N)C[NH+]1CCC(c2ccc3ccccc3c2)CC1 ZINC001235714125 1130771410 /nfs/dbraw/zinc/77/14/10/1130771410.db2.gz HEOYEFOGQDFXPA-LJQANCHMSA-N 1 3 282.431 3.757 20 0 CHADHO [NH3+]Cc1cccc(CN2CCC[C@H]2c2ccccc2F)c1 ZINC001235718050 1130771457 /nfs/dbraw/zinc/77/14/57/1130771457.db2.gz BAGVGZJJUQVQQK-SFHVURJKSA-N 1 3 284.378 3.622 20 0 CHADHO Cc1ccc(-c2ccc(C[N@@H+]3C[C@@H]4CC[C@]4(N)C3)cc2)cc1 ZINC001235995462 1130825093 /nfs/dbraw/zinc/82/50/93/1130825093.db2.gz VYRWCVVVYZONEA-PMACEKPBSA-N 1 3 292.426 3.585 20 0 CHADHO Cc1ccc(-c2ccc(C[N@H+]3C[C@@H]4CC[C@]4(N)C3)cc2)cc1 ZINC001235995462 1130825098 /nfs/dbraw/zinc/82/50/98/1130825098.db2.gz VYRWCVVVYZONEA-PMACEKPBSA-N 1 3 292.426 3.585 20 0 CHADHO Cc1cccc(-c2ccc(C[N@@H+]3CCCN[C@@H](C)C3)cc2)c1 ZINC001236101094 1130861942 /nfs/dbraw/zinc/86/19/42/1130861942.db2.gz UEWSNFMAJYSJHW-KRWDZBQOSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1cccc(-c2ccc(C[N@H+]3CCCN[C@@H](C)C3)cc2)c1 ZINC001236101094 1130861948 /nfs/dbraw/zinc/86/19/48/1130861948.db2.gz UEWSNFMAJYSJHW-KRWDZBQOSA-N 1 3 294.442 3.846 20 0 CHADHO CC(C)=CCC[C@H](C)CN(C)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236210530 1130887612 /nfs/dbraw/zinc/88/76/12/1130887612.db2.gz DFZMOYAUJVVPTF-ARFHVFGLSA-N 1 3 252.446 3.571 20 0 CHADHO CC(C)Cc1ccc(C[N@H+](C)[C@H]2CCCC[C@@H]2N)cc1 ZINC001236218030 1130892982 /nfs/dbraw/zinc/89/29/82/1130892982.db2.gz RANWRIJYTBYGOH-ROUUACIJSA-N 1 3 274.452 3.587 20 0 CHADHO CC(C)Cc1ccc(C[N@@H+](C)[C@H]2CCCC[C@@H]2N)cc1 ZINC001236218030 1130892987 /nfs/dbraw/zinc/89/29/87/1130892987.db2.gz RANWRIJYTBYGOH-ROUUACIJSA-N 1 3 274.452 3.587 20 0 CHADHO CC(C)c1ccccc1C[N@H+](C)[C@@H]1CCCC[C@@H]1N ZINC001236219143 1130893653 /nfs/dbraw/zinc/89/36/53/1130893653.db2.gz VCKDPIIMHRAOEP-DLBZAZTESA-N 1 3 260.425 3.512 20 0 CHADHO CC(C)c1ccccc1C[N@@H+](C)[C@@H]1CCCC[C@@H]1N ZINC001236219143 1130893657 /nfs/dbraw/zinc/89/36/57/1130893657.db2.gz VCKDPIIMHRAOEP-DLBZAZTESA-N 1 3 260.425 3.512 20 0 CHADHO CC/C=C\CCCCCCN1CCC[NH2+]CCC1 ZINC001236241508 1130903380 /nfs/dbraw/zinc/90/33/80/1130903380.db2.gz ZNUHNSNGMDCHHM-ARJAWSKDSA-N 1 3 252.446 3.589 20 0 CHADHO NC[C@H]1CCC[N@@H+]1Cc1ccc(/C=C/c2ccccc2)cc1 ZINC001236247795 1130904294 /nfs/dbraw/zinc/90/42/94/1130904294.db2.gz ZNSCZQLUSUKGTJ-NDDJGDGRSA-N 1 3 292.426 3.780 20 0 CHADHO NC[C@H]1CCC[N@H+]1Cc1ccc(/C=C/c2ccccc2)cc1 ZINC001236247795 1130904299 /nfs/dbraw/zinc/90/42/99/1130904299.db2.gz ZNSCZQLUSUKGTJ-NDDJGDGRSA-N 1 3 292.426 3.780 20 0 CHADHO c1csc(CC[N@H+](C[C@H]2CCCNC2)C2CCCC2)c1 ZINC001236371987 1130922252 /nfs/dbraw/zinc/92/22/52/1130922252.db2.gz PHAKDLKSXMLJBE-HNNXBMFYSA-N 1 3 292.492 3.535 20 0 CHADHO c1csc(CC[N@@H+](C[C@H]2CCCNC2)C2CCCC2)c1 ZINC001236371987 1130922255 /nfs/dbraw/zinc/92/22/55/1130922255.db2.gz PHAKDLKSXMLJBE-HNNXBMFYSA-N 1 3 292.492 3.535 20 0 CHADHO CC1(c2ccccc2)CCN(CC[C@@H]2CCCC[NH2+]2)CC1 ZINC001236434704 1130940534 /nfs/dbraw/zinc/94/05/34/1130940534.db2.gz UWFGNJNMUVDXTL-SFHVURJKSA-N 1 3 286.463 3.572 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](CN2CC[C@](F)(C[NH3+])C2)CC1 ZINC001236433766 1130941121 /nfs/dbraw/zinc/94/11/21/1130941121.db2.gz IKTXJMDWUYMVND-MSOLQXFVSA-N 1 3 294.458 3.832 20 0 CHADHO CC(C)(C)C[N@H+](Cc1cc2ccccc2[nH]1)C1CCNCC1 ZINC001236457440 1130946860 /nfs/dbraw/zinc/94/68/60/1130946860.db2.gz KRHATWUVPQSHIO-UHFFFAOYSA-N 1 3 299.462 3.768 20 0 CHADHO CC(C)(C)C[N@@H+](Cc1cc2ccccc2[nH]1)C1CCNCC1 ZINC001236457440 1130946864 /nfs/dbraw/zinc/94/68/64/1130946864.db2.gz KRHATWUVPQSHIO-UHFFFAOYSA-N 1 3 299.462 3.768 20 0 CHADHO Cc1cccc(C[N@H+](CC(C)(C)C)C2CCNCC2)c1 ZINC001236457520 1130947302 /nfs/dbraw/zinc/94/73/02/1130947302.db2.gz MOJCHRFNCWUISL-UHFFFAOYSA-N 1 3 274.452 3.595 20 0 CHADHO Cc1cccc(C[N@@H+](CC(C)(C)C)C2CCNCC2)c1 ZINC001236457520 1130947304 /nfs/dbraw/zinc/94/73/04/1130947304.db2.gz MOJCHRFNCWUISL-UHFFFAOYSA-N 1 3 274.452 3.595 20 0 CHADHO C[C@@]1(C[NH3+])CCN(Cc2ccc(-c3ccc(F)cc3)cc2)C1 ZINC001236603639 1130981690 /nfs/dbraw/zinc/98/16/90/1130981690.db2.gz BLAHSCUBTHNKNX-IBGZPJMESA-N 1 3 298.405 3.663 20 0 CHADHO C[C@]1(C[NH3+])CCN(Cc2ccc3oc4ccccc4c3c2)C1 ZINC001236605331 1130983005 /nfs/dbraw/zinc/98/30/05/1130983005.db2.gz QWWZSPNBRUWANY-LJQANCHMSA-N 1 3 294.398 3.757 20 0 CHADHO C[C@H](NCCCCC[NH+]1CCCC1)c1cccnc1Cl ZINC000815647311 1131016376 /nfs/dbraw/zinc/01/63/76/1131016376.db2.gz GHFCCSIIOPOPEH-AWEZNQCLSA-N 1 3 295.858 3.652 20 0 CHADHO Cc1cc(CN2CCC(C[NH+](C)C)CC2)cc(C)c1Cl ZINC001238090903 1131169021 /nfs/dbraw/zinc/16/90/21/1131169021.db2.gz LTNGLEBRTWKHJC-UHFFFAOYSA-N 1 3 294.870 3.730 20 0 CHADHO CC(C)[C@@H](N)C[NH2+][C@@H](C)c1ccc(SC(F)F)cc1 ZINC000817959176 1131192682 /nfs/dbraw/zinc/19/26/82/1131192682.db2.gz PXBVLSOJFYFFRP-GWCFXTLKSA-N 1 3 288.407 3.635 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2ccc(Cl)nc2)cc1 ZINC000817962303 1131192992 /nfs/dbraw/zinc/19/29/92/1131192992.db2.gz HIMUMKFISBNBFP-VXGBXAGGSA-N 1 3 289.810 3.606 20 0 CHADHO CCCCC[C@H]([NH2+][C@@H]1CCN[C@@H](C)C1)C(C)(C)C ZINC000817970781 1131193874 /nfs/dbraw/zinc/19/38/74/1131193874.db2.gz FCHAEWJUWACVIT-ZNMIVQPWSA-N 1 3 254.462 3.712 20 0 CHADHO CCOc1cccc([C@@H](C)NCc2ccccc2C[NH2+]C)c1 ZINC000844923323 1131608135 /nfs/dbraw/zinc/60/81/35/1131608135.db2.gz FJCHWMGDJZRORT-OAHLLOKOSA-N 1 3 298.430 3.656 20 0 CHADHO C[C@@H]1CCC[N@@H+]([C@@H]2CCN[C@@H](C(C)(C)C)C2)C[C@@H]1C ZINC001246574956 1131660741 /nfs/dbraw/zinc/66/07/41/1131660741.db2.gz OZKVDFHKJLEFOX-QKPAOTATSA-N 1 3 266.473 3.521 20 0 CHADHO C[C@@H]1CCC[N@H+]([C@@H]2CCN[C@@H](C(C)(C)C)C2)C[C@@H]1C ZINC001246574956 1131660743 /nfs/dbraw/zinc/66/07/43/1131660743.db2.gz OZKVDFHKJLEFOX-QKPAOTATSA-N 1 3 266.473 3.521 20 0 CHADHO CCCCCC[C@@H](CC)[N@@H+]1CCCC[C@H](CN)C1 ZINC001246584776 1131693572 /nfs/dbraw/zinc/69/35/72/1131693572.db2.gz UUJHSJZXFJKORY-HZPDHXFCSA-N 1 3 254.462 3.796 20 0 CHADHO CCCCCC[C@@H](CC)[N@H+]1CCCC[C@H](CN)C1 ZINC001246584776 1131693574 /nfs/dbraw/zinc/69/35/74/1131693574.db2.gz UUJHSJZXFJKORY-HZPDHXFCSA-N 1 3 254.462 3.796 20 0 CHADHO CCCC(CCC)[N@H+](C(C)C)[C@@H]1CCCNCC1 ZINC001246588719 1131704016 /nfs/dbraw/zinc/70/40/16/1131704016.db2.gz CCXIOWWTWJXNPU-MRXNPFEDSA-N 1 3 254.462 3.808 20 0 CHADHO CCCC(CCC)[N@@H+](C(C)C)[C@@H]1CCCNCC1 ZINC001246588719 1131704018 /nfs/dbraw/zinc/70/40/18/1131704018.db2.gz CCXIOWWTWJXNPU-MRXNPFEDSA-N 1 3 254.462 3.808 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[N@@H+]1C[C@@H](CN)CC[C@@H]1C ZINC001246590685 1131707180 /nfs/dbraw/zinc/70/71/80/1131707180.db2.gz KOXSXBBJXLGTDG-YHUYYLMFSA-N 1 3 254.462 3.506 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[N@H+]1C[C@@H](CN)CC[C@@H]1C ZINC001246590685 1131707184 /nfs/dbraw/zinc/70/71/84/1131707184.db2.gz KOXSXBBJXLGTDG-YHUYYLMFSA-N 1 3 254.462 3.506 20 0 CHADHO CC(C)[N@H+]([C@H]1CC[C@@H](C)[C@@H](C)C1)[C@H]1CCCNCC1 ZINC001246595923 1131710405 /nfs/dbraw/zinc/71/04/05/1131710405.db2.gz UFKAVLUQOMPHCP-QZWWFDLISA-N 1 3 266.473 3.664 20 0 CHADHO CC(C)[N@@H+]([C@H]1CC[C@@H](C)[C@@H](C)C1)[C@H]1CCCNCC1 ZINC001246595923 1131710409 /nfs/dbraw/zinc/71/04/09/1131710409.db2.gz UFKAVLUQOMPHCP-QZWWFDLISA-N 1 3 266.473 3.664 20 0 CHADHO CCCCCC[C@@H](CCC)N1CCC[C@@]12CC[NH2+]C2 ZINC001246648513 1131777785 /nfs/dbraw/zinc/77/77/85/1131777785.db2.gz LZCWUATYXZGUAO-SJORKVTESA-N 1 3 266.473 3.953 20 0 CHADHO CC[C@H]1CCC[N@@H+]([C@@H]2CCNC3(CCCCC3)C2)C1 ZINC001246850032 1131789515 /nfs/dbraw/zinc/78/95/15/1131789515.db2.gz SYRFPBGFVILXKP-JKSUJKDBSA-N 1 3 264.457 3.563 20 0 CHADHO CC[C@H]1CCC[N@H+]([C@@H]2CCNC3(CCCCC3)C2)C1 ZINC001246850032 1131789521 /nfs/dbraw/zinc/78/95/21/1131789521.db2.gz SYRFPBGFVILXKP-JKSUJKDBSA-N 1 3 264.457 3.563 20 0 CHADHO C1=C[C@@H](C[NH2+][C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)CC1 ZINC000716694225 1132028299 /nfs/dbraw/zinc/02/82/99/1132028299.db2.gz RXQMHMAWRPAOLN-GTAWCEEGSA-N 1 3 296.458 3.595 20 0 CHADHO C1=CCC(C[NH2+][C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)C1 ZINC000716619024 1132029094 /nfs/dbraw/zinc/02/90/94/1132029094.db2.gz AMXSIIPVCYCDNB-UFYCRDLUSA-N 1 3 296.458 3.595 20 0 CHADHO CN1C(C)(C)CC([NH+]2Cc3ccccc3C2)CC1(C)C ZINC001171628634 1132061123 /nfs/dbraw/zinc/06/11/23/1132061123.db2.gz DPZDRUJOGGGHRF-UHFFFAOYSA-N 1 3 272.436 3.654 20 0 CHADHO CN1C(C)(C)CC([NH2+]CCc2cccc(F)c2)CC1(C)C ZINC001171617045 1132065736 /nfs/dbraw/zinc/06/57/36/1132065736.db2.gz FKMSOBYKYBTOLU-UHFFFAOYSA-N 1 3 292.442 3.609 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCCC3(CC(F)C3)CC1)C2 ZINC001172127323 1132125239 /nfs/dbraw/zinc/12/52/39/1132125239.db2.gz HZRXJOARFZXHDX-BXXFKTFBSA-N 1 3 294.458 3.606 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCCC3(CC(F)C3)CC1)C2 ZINC001172127323 1132125240 /nfs/dbraw/zinc/12/52/40/1132125240.db2.gz HZRXJOARFZXHDX-BXXFKTFBSA-N 1 3 294.458 3.606 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccc(Cl)c(F)c1)C2 ZINC001172100465 1132126256 /nfs/dbraw/zinc/12/62/56/1132126256.db2.gz QYQOEPGWXVHOSS-ZSOGYDGISA-N 1 3 296.817 3.584 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1csc(Cl)c1)C2 ZINC001172118241 1132134034 /nfs/dbraw/zinc/13/40/34/1132134034.db2.gz PTGWHNWEBYJBTM-CLLJXQQHSA-N 1 3 284.856 3.506 20 0 CHADHO CCc1ccc([C@@H](C)N[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172115627 1132134200 /nfs/dbraw/zinc/13/42/00/1132134200.db2.gz UGDILRPUUQAXFH-DQEVTTJGSA-N 1 3 286.463 3.915 20 0 CHADHO CCc1ccc([C@@H](C)N[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172115627 1132134202 /nfs/dbraw/zinc/13/42/02/1132134202.db2.gz UGDILRPUUQAXFH-DQEVTTJGSA-N 1 3 286.463 3.915 20 0 CHADHO CCc1ccc([C@@H](C)N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172115626 1132134661 /nfs/dbraw/zinc/13/46/61/1132134661.db2.gz UGDILRPUUQAXFH-AXUOBQJMSA-N 1 3 286.463 3.915 20 0 CHADHO CCc1ccc([C@@H](C)N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172115626 1132134663 /nfs/dbraw/zinc/13/46/63/1132134663.db2.gz UGDILRPUUQAXFH-AXUOBQJMSA-N 1 3 286.463 3.915 20 0 CHADHO CC[C@@H](CC(C)C)[N@H+](CCCN)C1CCCCC1 ZINC001172384188 1132209541 /nfs/dbraw/zinc/20/95/41/1132209541.db2.gz FEQZJFGUMZADGP-HNNXBMFYSA-N 1 3 254.462 3.795 20 0 CHADHO CC[C@@H](CC(C)C)[N@@H+](CCCN)C1CCCCC1 ZINC001172384188 1132209547 /nfs/dbraw/zinc/20/95/47/1132209547.db2.gz FEQZJFGUMZADGP-HNNXBMFYSA-N 1 3 254.462 3.795 20 0 CHADHO CC(C)OCC[C@@H](C)[N@@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001172450800 1132237958 /nfs/dbraw/zinc/23/79/58/1132237958.db2.gz KQQHUNVGTGSNGO-MSOLQXFVSA-N 1 3 296.499 3.530 20 0 CHADHO CC(C)OCC[C@@H](C)[N@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001172450800 1132237965 /nfs/dbraw/zinc/23/79/65/1132237965.db2.gz KQQHUNVGTGSNGO-MSOLQXFVSA-N 1 3 296.499 3.530 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001172560602 1132268710 /nfs/dbraw/zinc/26/87/10/1132268710.db2.gz PTLYYVSDQLWZBM-NCXUSEDFSA-N 1 3 286.463 3.785 20 0 CHADHO CCN(C)C1CC[NH+]([C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172565559 1132270366 /nfs/dbraw/zinc/27/03/66/1132270366.db2.gz KIVSUZULZBWBGP-IEBWSBKVSA-N 1 3 286.463 3.739 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+][C@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172537831 1132275162 /nfs/dbraw/zinc/27/51/62/1132275162.db2.gz VSPIHPDYLOYEOA-CEXWTWQISA-N 1 3 286.463 3.787 20 0 CHADHO CCC[N@H+](CCCN)[C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172538836 1132275876 /nfs/dbraw/zinc/27/58/76/1132275876.db2.gz UQNFAHMBDANJFQ-QZTJIDSGSA-N 1 3 274.452 3.774 20 0 CHADHO CCC[N@@H+](CCCN)[C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172538836 1132275883 /nfs/dbraw/zinc/27/58/83/1132275883.db2.gz UQNFAHMBDANJFQ-QZTJIDSGSA-N 1 3 274.452 3.774 20 0 CHADHO CCN(C)C1CC[NH+](C2CCC3(CCCC3)CC2)CC1 ZINC001172730916 1132305564 /nfs/dbraw/zinc/30/55/64/1132305564.db2.gz RCLDEWLIPHKGTD-UHFFFAOYSA-N 1 3 278.484 3.906 20 0 CHADHO Cc1ccc(CC[N@@H+](C)Cc2cc3cnccc3[nH]2)cc1 ZINC001232013795 1132410935 /nfs/dbraw/zinc/41/09/35/1132410935.db2.gz FTZCUJPAZVVYHY-UHFFFAOYSA-N 1 3 279.387 3.546 20 0 CHADHO Cc1ccc(CC[N@H+](C)Cc2cc3cnccc3[nH]2)cc1 ZINC001232013795 1132410937 /nfs/dbraw/zinc/41/09/37/1132410937.db2.gz FTZCUJPAZVVYHY-UHFFFAOYSA-N 1 3 279.387 3.546 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@@H+]2CC[C@@H]3CCC[C@H]3C2)c1 ZINC001232145225 1132427166 /nfs/dbraw/zinc/42/71/66/1132427166.db2.gz YQIMIRWMOGEAKI-IRXDYDNUSA-N 1 3 290.426 3.509 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@H+]2CC[C@@H]3CCC[C@H]3C2)c1 ZINC001232145225 1132427167 /nfs/dbraw/zinc/42/71/67/1132427167.db2.gz YQIMIRWMOGEAKI-IRXDYDNUSA-N 1 3 290.426 3.509 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)c1 ZINC001232145114 1132427773 /nfs/dbraw/zinc/42/77/73/1132427773.db2.gz VRPCUBUYOOYKTG-CALCHBBNSA-N 1 3 290.426 3.509 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)c1 ZINC001232145114 1132427776 /nfs/dbraw/zinc/42/77/76/1132427776.db2.gz VRPCUBUYOOYKTG-CALCHBBNSA-N 1 3 290.426 3.509 20 0 CHADHO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1cc(F)cc(CN(C)C)c1 ZINC001232146677 1132428736 /nfs/dbraw/zinc/42/87/36/1132428736.db2.gz YAOFNUVMMRWDFN-UONOGXRCSA-N 1 3 278.415 3.508 20 0 CHADHO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1cc(F)cc(CN(C)C)c1 ZINC001232146677 1132428740 /nfs/dbraw/zinc/42/87/40/1132428740.db2.gz YAOFNUVMMRWDFN-UONOGXRCSA-N 1 3 278.415 3.508 20 0 CHADHO CC(C)(C)c1cc(Nc2cccc3c2CC[NH2+]C3)ccn1 ZINC001159241064 1132818632 /nfs/dbraw/zinc/81/86/32/1132818632.db2.gz QDPZNTVQORUEOP-UHFFFAOYSA-N 1 3 281.403 3.768 20 0 CHADHO CCN(CC)Cc1cc(OC)ccc1NC(=[NH2+])C(C)(C)C ZINC001162665423 1133103022 /nfs/dbraw/zinc/10/30/22/1133103022.db2.gz GGXBGAAEAGKIOC-UHFFFAOYSA-N 1 3 291.439 3.972 20 0 CHADHO C[NH+]1CCC2(CCN(Cc3cccc(Cl)c3)CC2)CC1 ZINC001203801211 1133370592 /nfs/dbraw/zinc/37/05/92/1133370592.db2.gz NVVZXKMYDWTMOX-UHFFFAOYSA-N 1 3 292.854 3.648 20 0 CHADHO C[NH+]1CCC2(CCN(Cc3ccc(Cl)cc3)CC2)CC1 ZINC001203921904 1133384510 /nfs/dbraw/zinc/38/45/10/1133384510.db2.gz GBDHVVYSCJUXGN-UHFFFAOYSA-N 1 3 292.854 3.648 20 0 CHADHO Cc1ccc(C[N@@H+]2CCCC[C@H]2CCN2CCCC2)s1 ZINC001204034324 1133401406 /nfs/dbraw/zinc/40/14/06/1133401406.db2.gz GRCJRFYFURSIHW-INIZCTEOSA-N 1 3 292.492 3.897 20 0 CHADHO Cc1ccc(C[N@H+]2CCCC[C@H]2CCN2CCCC2)s1 ZINC001204034324 1133401409 /nfs/dbraw/zinc/40/14/09/1133401409.db2.gz GRCJRFYFURSIHW-INIZCTEOSA-N 1 3 292.492 3.897 20 0 CHADHO C[NH2+]C[C@@H]1CCCN(Cc2ccc(C)c3ccccc23)C1 ZINC001205008431 1133515817 /nfs/dbraw/zinc/51/58/17/1133515817.db2.gz AOGVEUGYWXRJQJ-INIZCTEOSA-N 1 3 282.431 3.580 20 0 CHADHO [NH3+][C@H]1CCCN(Cc2ccc(-c3cccs3)cc2)CC1 ZINC001205109505 1133531213 /nfs/dbraw/zinc/53/12/13/1133531213.db2.gz HFWKSIBHFYBSFY-INIZCTEOSA-N 1 3 286.444 3.728 20 0 CHADHO C[C@@]1([NH3+])CCCN(Cc2csc3ccccc23)CC1 ZINC001205274391 1133553592 /nfs/dbraw/zinc/55/35/92/1133553592.db2.gz WXOVJRDQIIPMFZ-MRXNPFEDSA-N 1 3 274.433 3.605 20 0 CHADHO Cc1ccc2ccccc2c1C[N@H+]1CC[C@H](C)[C@H](CN)C1 ZINC001205305956 1133558532 /nfs/dbraw/zinc/55/85/32/1133558532.db2.gz USISBSITRAFKHO-WMLDXEAASA-N 1 3 282.431 3.565 20 0 CHADHO Cc1ccc2ccccc2c1C[N@@H+]1CC[C@H](C)[C@H](CN)C1 ZINC001205305956 1133558534 /nfs/dbraw/zinc/55/85/34/1133558534.db2.gz USISBSITRAFKHO-WMLDXEAASA-N 1 3 282.431 3.565 20 0 CHADHO Cc1c(C[N@H+]2CCNCC[C@H]2C)cccc1-c1ccccc1 ZINC001205333312 1133563407 /nfs/dbraw/zinc/56/34/07/1133563407.db2.gz ZTRVRQKBTLWUDZ-MRXNPFEDSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1c(C[N@@H+]2CCNCC[C@H]2C)cccc1-c1ccccc1 ZINC001205333312 1133563409 /nfs/dbraw/zinc/56/34/09/1133563409.db2.gz ZTRVRQKBTLWUDZ-MRXNPFEDSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1ccc([C@H](C)C[NH2+]CC[C@@H](C)N2CCCCC2)cc1 ZINC001205391380 1133573265 /nfs/dbraw/zinc/57/32/65/1133573265.db2.gz MVLZRHLPZGNRJO-QZTJIDSGSA-N 1 3 288.479 3.953 20 0 CHADHO Cc1ccc(F)c(CN2CC[C@H](C)[C@@H](C[NH3+])CC2)c1Cl ZINC001205617232 1133594980 /nfs/dbraw/zinc/59/49/80/1133594980.db2.gz INOPYZKAIWAQLW-WCQYABFASA-N 1 3 298.833 3.594 20 0 CHADHO CC[C@H](CCC(F)(F)F)[NH2+]CC(C)(C)CN1CCCC1 ZINC001205646043 1133598261 /nfs/dbraw/zinc/59/82/61/1133598261.db2.gz XGDKSNLOTGPFJO-CYBMUJFWSA-N 1 3 294.405 3.819 20 0 CHADHO CC[C@@H](C)C[C@@H](CC)[NH2+]CC(C)(C)CN1CCCC1 ZINC001205645658 1133598447 /nfs/dbraw/zinc/59/84/47/1133598447.db2.gz MXZZDFFMAOINHG-HZPDHXFCSA-N 1 3 268.489 3.913 20 0 CHADHO CC[C@H](C)C[C@H](CC)[NH2+]CC(C)(C)CN1CCCC1 ZINC001205645657 1133598978 /nfs/dbraw/zinc/59/89/78/1133598978.db2.gz MXZZDFFMAOINHG-HOTGVXAUSA-N 1 3 268.489 3.913 20 0 CHADHO Fc1ccc([C@H]2CCCN2Cc2ccc3c(c2)C[NH2+]C3)cc1 ZINC001206050035 1133649449 /nfs/dbraw/zinc/64/94/49/1133649449.db2.gz YOGDJSAKTVNCJN-LJQANCHMSA-N 1 3 296.389 3.766 20 0 CHADHO CC(C)(C)c1ccc(C[N@@H+]2CCCC[C@@](F)(CN)C2)cc1 ZINC001206344089 1133692265 /nfs/dbraw/zinc/69/22/65/1133692265.db2.gz NEVWNTACDITZLL-GOSISDBHSA-N 1 3 292.442 3.637 20 0 CHADHO CC(C)(C)c1ccc(C[N@H+]2CCCC[C@@](F)(CN)C2)cc1 ZINC001206344089 1133692268 /nfs/dbraw/zinc/69/22/68/1133692268.db2.gz NEVWNTACDITZLL-GOSISDBHSA-N 1 3 292.442 3.637 20 0 CHADHO C[C@]1(C[NH3+])CCCCN(Cc2ccc(F)c3ccoc32)C1 ZINC001206573909 1133720740 /nfs/dbraw/zinc/72/07/40/1133720740.db2.gz PDBYDIGQOREVBZ-QGZVFWFLSA-N 1 3 290.382 3.523 20 0 CHADHO CC(C)N(Cc1cc2ccccc2n1C)[C@H]1CCC[NH2+]CC1 ZINC001206588944 1133723537 /nfs/dbraw/zinc/72/35/37/1133723537.db2.gz DNTLFXANDMENHH-KRWDZBQOSA-N 1 3 299.462 3.531 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CCCC[C@H](CN)C1 ZINC001206607246 1133726380 /nfs/dbraw/zinc/72/63/80/1133726380.db2.gz YPSTYLBKXNVGFG-CWIOURORSA-N 1 3 266.473 3.964 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CCCC[C@H](CN)C1 ZINC001206607246 1133726384 /nfs/dbraw/zinc/72/63/84/1133726384.db2.gz YPSTYLBKXNVGFG-CWIOURORSA-N 1 3 266.473 3.964 20 0 CHADHO CCCN1C[C@@H]2C[NH+](CC[C@@H]3CC=C(C)C3(C)C)C[C@H]2C1 ZINC001207274621 1133785109 /nfs/dbraw/zinc/78/51/09/1133785109.db2.gz DDRNFSHSERVDMF-KURKYZTESA-N 1 3 290.495 3.643 20 0 CHADHO CCC[N@H+]1C[C@H]2CN(CCCC3CCCCC3)C[C@H]2C1 ZINC001207608426 1133831051 /nfs/dbraw/zinc/83/10/51/1133831051.db2.gz NPFBJWPRQUEDKK-HDICACEKSA-N 1 3 278.484 3.621 20 0 CHADHO CCC[N@@H+]1C[C@H]2CN(CCCC3CCCCC3)C[C@H]2C1 ZINC001207608426 1133831053 /nfs/dbraw/zinc/83/10/53/1133831053.db2.gz NPFBJWPRQUEDKK-HDICACEKSA-N 1 3 278.484 3.621 20 0 CHADHO CCCN1C[C@@H]2C[N@@H+](CCCC3CCCCC3)C[C@@H]2C1 ZINC001207608426 1133831057 /nfs/dbraw/zinc/83/10/57/1133831057.db2.gz NPFBJWPRQUEDKK-HDICACEKSA-N 1 3 278.484 3.621 20 0 CHADHO CCCN1C[C@@H]2C[N@H+](CCCC3CCCCC3)C[C@@H]2C1 ZINC001207608426 1133831060 /nfs/dbraw/zinc/83/10/60/1133831060.db2.gz NPFBJWPRQUEDKK-HDICACEKSA-N 1 3 278.484 3.621 20 0 CHADHO CCN(CC)CC[C@@H](C)[NH2+][C@H](C)CC1CCCC1 ZINC001207858541 1133854409 /nfs/dbraw/zinc/85/44/09/1133854409.db2.gz UDPAKOOZYURBOH-HUUCEWRRSA-N 1 3 254.462 3.665 20 0 CHADHO CN(Cc1ccccc1Cl)CC1(C)CC[NH+](C)CC1 ZINC001208107632 1133876692 /nfs/dbraw/zinc/87/66/92/1133876692.db2.gz XGFYGMWUFBMPEF-UHFFFAOYSA-N 1 3 280.843 3.504 20 0 CHADHO CC1=C[C@H](C)[C@@H](CN2CCC([NH+]3CCCC3)CC2)CC1 ZINC001208166052 1133892288 /nfs/dbraw/zinc/89/22/88/1133892288.db2.gz VDIJEBPCFJUJKE-DLBZAZTESA-N 1 3 276.468 3.539 20 0 CHADHO CC1=C[C@H](C)[C@@H](C[NH+]2CCC(N3CCCC3)CC2)CC1 ZINC001208166052 1133892293 /nfs/dbraw/zinc/89/22/93/1133892293.db2.gz VDIJEBPCFJUJKE-DLBZAZTESA-N 1 3 276.468 3.539 20 0 CHADHO Cc1cccc(CN(C[C@H]2CCC[N@@H+](C)C2)C2CC2)c1C ZINC001208619565 1133919702 /nfs/dbraw/zinc/91/97/02/1133919702.db2.gz YGVBIFSXOOKDJZ-KRWDZBQOSA-N 1 3 286.463 3.610 20 0 CHADHO Cc1cccc(CN(C[C@H]2CCC[N@H+](C)C2)C2CC2)c1C ZINC001208619565 1133919705 /nfs/dbraw/zinc/91/97/05/1133919705.db2.gz YGVBIFSXOOKDJZ-KRWDZBQOSA-N 1 3 286.463 3.610 20 0 CHADHO C(C[N@@H+]1CCCC[C@H]1CCN1CCCC1)C1CCCC1 ZINC001208695387 1133928511 /nfs/dbraw/zinc/92/85/11/1133928511.db2.gz PFTUJGLKAPXFKN-SFHVURJKSA-N 1 3 278.484 3.907 20 0 CHADHO C(C[N@H+]1CCCC[C@H]1CCN1CCCC1)C1CCCC1 ZINC001208695387 1133928513 /nfs/dbraw/zinc/92/85/13/1133928513.db2.gz PFTUJGLKAPXFKN-SFHVURJKSA-N 1 3 278.484 3.907 20 0 CHADHO CC/C=C\CC[N@@H+]1CCCC[C@@H]1C[C@@H]1CCCN1C ZINC001208730255 1133937534 /nfs/dbraw/zinc/93/75/34/1133937534.db2.gz SAJWNVXOPNNXDE-PPPANMTLSA-N 1 3 264.457 3.682 20 0 CHADHO CC/C=C\CC[N@H+]1CCCC[C@@H]1C[C@@H]1CCCN1C ZINC001208730255 1133937537 /nfs/dbraw/zinc/93/75/37/1133937537.db2.gz SAJWNVXOPNNXDE-PPPANMTLSA-N 1 3 264.457 3.682 20 0 CHADHO c1ccc(CN2CC[C@H](C[N@@H+]3CCC[C@@H]4CCC[C@H]43)C2)cc1 ZINC001208954596 1133967210 /nfs/dbraw/zinc/96/72/10/1133967210.db2.gz WOKKQFIIROXDGB-SLFFLAALSA-N 1 3 298.474 3.773 20 0 CHADHO c1ccc(CN2CC[C@H](C[N@H+]3CCC[C@@H]4CCC[C@H]43)C2)cc1 ZINC001208954596 1133967214 /nfs/dbraw/zinc/96/72/14/1133967214.db2.gz WOKKQFIIROXDGB-SLFFLAALSA-N 1 3 298.474 3.773 20 0 CHADHO c1ccc(CN2CC[C@@H](C[N@@H+]3CCCCC34CC4)C2)cc1 ZINC001208954089 1133967723 /nfs/dbraw/zinc/96/77/23/1133967723.db2.gz UHSFDARPBHDBDW-GOSISDBHSA-N 1 3 284.447 3.527 20 0 CHADHO c1ccc(CN2CC[C@@H](C[N@H+]3CCCCC34CC4)C2)cc1 ZINC001208954089 1133967728 /nfs/dbraw/zinc/96/77/28/1133967728.db2.gz UHSFDARPBHDBDW-GOSISDBHSA-N 1 3 284.447 3.527 20 0 CHADHO c1ccc(C[N@H+]2CC[C@H](CN3CC[C@@H]4CCC[C@H]4C3)C2)cc1 ZINC001208943219 1133967785 /nfs/dbraw/zinc/96/77/85/1133967785.db2.gz SAPYMXCAWBJYSB-UFYCRDLUSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(C[N@@H+]2CC[C@H](CN3CC[C@@H]4CCC[C@H]4C3)C2)cc1 ZINC001208943219 1133967788 /nfs/dbraw/zinc/96/77/88/1133967788.db2.gz SAPYMXCAWBJYSB-UFYCRDLUSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(CN2CC[C@H](C[N@@H+]3CC[C@@H]4CCC[C@H]4C3)C2)cc1 ZINC001208943219 1133967794 /nfs/dbraw/zinc/96/77/94/1133967794.db2.gz SAPYMXCAWBJYSB-UFYCRDLUSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(CN2CC[C@H](C[N@H+]3CC[C@@H]4CCC[C@H]4C3)C2)cc1 ZINC001208943219 1133967796 /nfs/dbraw/zinc/96/77/96/1133967796.db2.gz SAPYMXCAWBJYSB-UFYCRDLUSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(C[N@H+]2CC[C@@H](CN3CC4CCC(CC4)C3)C2)cc1 ZINC001208955711 1133968535 /nfs/dbraw/zinc/96/85/35/1133968535.db2.gz FBLRPKFKJDTPPU-SOAGJPPSSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(C[N@@H+]2CC[C@@H](CN3CC4CCC(CC4)C3)C2)cc1 ZINC001208955711 1133968552 /nfs/dbraw/zinc/96/85/52/1133968552.db2.gz FBLRPKFKJDTPPU-SOAGJPPSSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(CN2CC[C@@H](C[NH+]3CC4CCC(CC4)C3)C2)cc1 ZINC001208955711 1133968559 /nfs/dbraw/zinc/96/85/59/1133968559.db2.gz FBLRPKFKJDTPPU-SOAGJPPSSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(CN2CC[C@H](C[NH+]3C4CCCC3CCC4)C2)cc1 ZINC001208957352 1133969276 /nfs/dbraw/zinc/96/92/76/1133969276.db2.gz KQMVPHSZFIQGPK-HDYDNRTBSA-N 1 3 298.474 3.916 20 0 CHADHO Cc1ccc(C[N@H+](C)CCCN2CCCCC2)cc1C ZINC001209452088 1134025087 /nfs/dbraw/zinc/02/50/87/1134025087.db2.gz BSUSATNKWYXJCJ-UHFFFAOYSA-N 1 3 274.452 3.611 20 0 CHADHO Cc1ccc(C[N@@H+](C)CCCN2CCCCC2)cc1C ZINC001209452088 1134025090 /nfs/dbraw/zinc/02/50/90/1134025090.db2.gz BSUSATNKWYXJCJ-UHFFFAOYSA-N 1 3 274.452 3.611 20 0 CHADHO C[C@H]1CC[N@H+](Cc2cccc3c4ccccc4oc32)CCN1 ZINC001210497880 1134230368 /nfs/dbraw/zinc/23/03/68/1134230368.db2.gz OWZMMJBWJAJTBW-AWEZNQCLSA-N 1 3 294.398 3.770 20 0 CHADHO C[C@H]1CC[N@@H+](Cc2cccc3c4ccccc4oc32)CCN1 ZINC001210497880 1134230376 /nfs/dbraw/zinc/23/03/76/1134230376.db2.gz OWZMMJBWJAJTBW-AWEZNQCLSA-N 1 3 294.398 3.770 20 0 CHADHO Cc1ccc(CN2CCCC[C@]3(CCCC[NH2+]C3)C2)cc1 ZINC001222161410 1135202871 /nfs/dbraw/zinc/20/28/71/1135202871.db2.gz NVCUUZGRNZRDJP-IBGZPJMESA-N 1 3 286.463 3.741 20 0 CHADHO C(CC1CCCCC1)C[N@@H+]1CCC[C@]12CCCNC2 ZINC001222231096 1135210453 /nfs/dbraw/zinc/21/04/53/1135210453.db2.gz JAYXHEXXQAYGQB-KRWDZBQOSA-N 1 3 264.457 3.565 20 0 CHADHO C(CC1CCCCC1)C[N@H+]1CCC[C@]12CCCNC2 ZINC001222231096 1135210459 /nfs/dbraw/zinc/21/04/59/1135210459.db2.gz JAYXHEXXQAYGQB-KRWDZBQOSA-N 1 3 264.457 3.565 20 0 CHADHO CC1=CC[C@H](CC[N@@H+]2CCC[C@]23CCCNC3)C1(C)C ZINC001222230720 1135211223 /nfs/dbraw/zinc/21/12/23/1135211223.db2.gz CLCSMWHVEIMCFS-AEFFLSMTSA-N 1 3 276.468 3.587 20 0 CHADHO CC1=CC[C@H](CC[N@H+]2CCC[C@]23CCCNC3)C1(C)C ZINC001222230720 1135211228 /nfs/dbraw/zinc/21/12/28/1135211228.db2.gz CLCSMWHVEIMCFS-AEFFLSMTSA-N 1 3 276.468 3.587 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@@H+]1CCC[C@@]12CCCNC2 ZINC001222231637 1135211573 /nfs/dbraw/zinc/21/15/73/1135211573.db2.gz OSWAKPFLMQYDIP-DLBZAZTESA-N 1 3 264.457 3.587 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@H+]1CCC[C@@]12CCCNC2 ZINC001222231637 1135211576 /nfs/dbraw/zinc/21/15/76/1135211576.db2.gz OSWAKPFLMQYDIP-DLBZAZTESA-N 1 3 264.457 3.587 20 0 CHADHO CC(C)=CCC[C@H](C)CN1CCC[C@@]12CCC[NH2+]C2 ZINC001222231637 1135211581 /nfs/dbraw/zinc/21/15/81/1135211581.db2.gz OSWAKPFLMQYDIP-DLBZAZTESA-N 1 3 264.457 3.587 20 0 CHADHO Cc1ccc(CN2CCC3(CCC[NH2+]C3)CC2)c(Cl)c1 ZINC001222457647 1135245186 /nfs/dbraw/zinc/24/51/86/1135245186.db2.gz VGGCXXZQFBEUED-UHFFFAOYSA-N 1 3 292.854 3.614 20 0 CHADHO c1ccc([C@H]2C[N@@H+](CCCC3CCCC3)CC23CNC3)cc1 ZINC001222596535 1135254333 /nfs/dbraw/zinc/25/43/33/1135254333.db2.gz YQXKXSJFIOWSAU-LJQANCHMSA-N 1 3 298.474 3.646 20 0 CHADHO c1ccc([C@H]2C[N@H+](CCCC3CCCC3)CC23CNC3)cc1 ZINC001222596535 1135254335 /nfs/dbraw/zinc/25/43/35/1135254335.db2.gz YQXKXSJFIOWSAU-LJQANCHMSA-N 1 3 298.474 3.646 20 0 CHADHO c1ccc([C@H]2CN(CCCC3CCCC3)CC23C[NH2+]C3)cc1 ZINC001222596535 1135254341 /nfs/dbraw/zinc/25/43/41/1135254341.db2.gz YQXKXSJFIOWSAU-LJQANCHMSA-N 1 3 298.474 3.646 20 0 CHADHO c1csc(-c2ccc(CN3CC[C@H]4C[NH2+]CC[C@H]43)cc2)c1 ZINC001222620305 1135256758 /nfs/dbraw/zinc/25/67/58/1135256758.db2.gz LZEASNBNWVWERI-DLBZAZTESA-N 1 3 298.455 3.599 20 0 CHADHO c1csc(-c2ccc(C[N@@H+]3CC[C@H]4CNCC[C@H]43)cc2)c1 ZINC001222620305 1135256763 /nfs/dbraw/zinc/25/67/63/1135256763.db2.gz LZEASNBNWVWERI-DLBZAZTESA-N 1 3 298.455 3.599 20 0 CHADHO c1csc(-c2ccc(C[N@H+]3CC[C@H]4CNCC[C@H]43)cc2)c1 ZINC001222620305 1135256764 /nfs/dbraw/zinc/25/67/64/1135256764.db2.gz LZEASNBNWVWERI-DLBZAZTESA-N 1 3 298.455 3.599 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]CCCc1c(Cl)cccc1Cl ZINC000574205148 335000550 /nfs/dbraw/zinc/00/05/50/335000550.db2.gz UAMDMXBDSDDKSK-WDEREUQCSA-N 1 3 289.250 3.641 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCCCc1c(Cl)cccc1Cl ZINC000574205148 335000552 /nfs/dbraw/zinc/00/05/52/335000552.db2.gz UAMDMXBDSDDKSK-WDEREUQCSA-N 1 3 289.250 3.641 20 0 CHADHO CC[C@H](NCc1ccc(C[NH+](C)C)cc1)c1ccccc1 ZINC000171133091 335056329 /nfs/dbraw/zinc/05/63/29/335056329.db2.gz RLZHVNQTNAEDJG-IBGZPJMESA-N 1 3 282.431 3.989 20 0 CHADHO CCC[C@@H](NCCC[NH+]1CCCC1)c1ccccc1 ZINC000020555214 262302030 /nfs/dbraw/zinc/30/20/30/262302030.db2.gz BMZXKQMQXSPFEQ-QGZVFWFLSA-N 1 3 260.425 3.603 20 0 CHADHO CCC[C@@H]([NH2+]CCCN1CCCC1)c1ccccc1 ZINC000020555214 262302032 /nfs/dbraw/zinc/30/20/32/262302032.db2.gz BMZXKQMQXSPFEQ-QGZVFWFLSA-N 1 3 260.425 3.603 20 0 CHADHO CC(C)C[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC000037042980 260064754 /nfs/dbraw/zinc/06/47/54/260064754.db2.gz KEBYDGAQFKFIGX-XVLXNVKGSA-N 1 3 286.463 3.989 20 0 CHADHO CC(C)C[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC000037042980 260064755 /nfs/dbraw/zinc/06/47/55/260064755.db2.gz KEBYDGAQFKFIGX-XVLXNVKGSA-N 1 3 286.463 3.989 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCCc2cc(F)ccc21)CN1CCCC1 ZINC000341762984 130027783 /nfs/dbraw/zinc/02/77/83/130027783.db2.gz WWFJIMMHXJTKKP-RDTXWAMCSA-N 1 3 290.426 3.525 20 0 CHADHO CCC[NH+]1CCC(N[C@@H]2CCCCc3ccccc32)CC1 ZINC000021815304 171331892 /nfs/dbraw/zinc/33/18/92/171331892.db2.gz HAUUXPJRLYQTSR-LJQANCHMSA-N 1 3 286.463 3.918 20 0 CHADHO CCC(C)(C)C1CCC([N@@H+]2CC[C@@H](CNC)C2)CC1 ZINC000071142142 176040197 /nfs/dbraw/zinc/04/01/97/176040197.db2.gz ROPBJJMRBUTBQK-FHERZECASA-N 1 3 266.473 3.523 20 0 CHADHO CCC(C)(C)C1CCC([N@H+]2CC[C@@H](CNC)C2)CC1 ZINC000071142142 176040198 /nfs/dbraw/zinc/04/01/98/176040198.db2.gz ROPBJJMRBUTBQK-FHERZECASA-N 1 3 266.473 3.523 20 0 CHADHO CCC(C)(C)C1CCC(N2CC[C@@H](C[NH2+]C)C2)CC1 ZINC000071142142 176040200 /nfs/dbraw/zinc/04/02/00/176040200.db2.gz ROPBJJMRBUTBQK-FHERZECASA-N 1 3 266.473 3.523 20 0 CHADHO C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000193140410 228139228 /nfs/dbraw/zinc/13/92/28/228139228.db2.gz QIPZDVLCZASBJC-RHSMWYFYSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@H]1CC(C)(C)C[C@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000193140424 228139452 /nfs/dbraw/zinc/13/94/52/228139452.db2.gz QIPZDVLCZASBJC-WMLDXEAASA-N 1 3 278.484 3.808 20 0 CHADHO CC[C@@H](NC[C@@H](C)C[NH+]1CCCC1)c1cccc(C)c1 ZINC000312830820 260209487 /nfs/dbraw/zinc/20/94/87/260209487.db2.gz UPMFFSXHEQJOEL-SJLPKXTDSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H](C)CN1CCCC1)c1cccc(C)c1 ZINC000312830820 260209488 /nfs/dbraw/zinc/20/94/88/260209488.db2.gz UPMFFSXHEQJOEL-SJLPKXTDSA-N 1 3 274.452 3.768 20 0 CHADHO C[C@H](Cc1ccccc1F)NC1CC[NH+](C(C)(C)C)CC1 ZINC000222582514 260226214 /nfs/dbraw/zinc/22/62/14/260226214.db2.gz WASILUPRBYXQHS-CQSZACIVSA-N 1 3 292.442 3.609 20 0 CHADHO C[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1ccc(C(F)(F)F)cc1 ZINC000093213241 260273000 /nfs/dbraw/zinc/27/30/00/260273000.db2.gz RJEYASWRWPXBPC-BPNCWPANSA-N 1 3 286.341 3.626 20 0 CHADHO CC(C)(C)[C@@H](N[C@@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000129011883 260380689 /nfs/dbraw/zinc/38/06/89/260380689.db2.gz AZRFESRJHKCIDK-CVEARBPZSA-N 1 3 260.425 3.506 20 0 CHADHO CC(C)(C)C[C@@H](NC[C@H]1CCC[NH2+]C1)c1ccccc1 ZINC000130957040 260399435 /nfs/dbraw/zinc/39/94/35/260399435.db2.gz SDLQXNNVOHSQMG-DOTOQJQBSA-N 1 3 274.452 3.753 20 0 CHADHO CC(C)(C)C[C@@H]([NH2+]C[C@H]1CCCNC1)c1ccccc1 ZINC000130957040 260399437 /nfs/dbraw/zinc/39/94/37/260399437.db2.gz SDLQXNNVOHSQMG-DOTOQJQBSA-N 1 3 274.452 3.753 20 0 CHADHO C1CC2(C1)CC([NH2+]C1CCN(C3CCCCC3)CC1)C2 ZINC000448058240 260795457 /nfs/dbraw/zinc/79/54/57/260795457.db2.gz KUUCNYGPYRRUHA-UHFFFAOYSA-N 1 3 276.468 3.706 20 0 CHADHO C1CC2(C1)CC(NC1CC[NH+](C3CCCCC3)CC1)C2 ZINC000448058240 260795459 /nfs/dbraw/zinc/79/54/59/260795459.db2.gz KUUCNYGPYRRUHA-UHFFFAOYSA-N 1 3 276.468 3.706 20 0 CHADHO c1ccc2c(c1)cccc2CNC1CC[NH+](C2CCC2)CC1 ZINC000448336760 261118303 /nfs/dbraw/zinc/11/83/03/261118303.db2.gz HTGREPFRADHWCU-UHFFFAOYSA-N 1 3 294.442 3.946 20 0 CHADHO c1ccc(CCCN2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000157287892 261143845 /nfs/dbraw/zinc/14/38/45/261143845.db2.gz RNWKFJYIZKLLBP-IBGZPJMESA-N 1 3 286.463 3.570 20 0 CHADHO C[C@H]([NH2+]C1CCN(C2CCCCC2)CC1)[C@H]1CC1(C)C ZINC000487275473 261677600 /nfs/dbraw/zinc/67/76/00/261677600.db2.gz PFSQUBINSIQHME-WMLDXEAASA-N 1 3 278.484 3.808 20 0 CHADHO C[C@@H]([NH2+]CC1(CN(C)C)CCCC1)c1ccc(Cl)nc1 ZINC000183953997 262001729 /nfs/dbraw/zinc/00/17/29/262001729.db2.gz UJSANUYLHDADLO-CYBMUJFWSA-N 1 3 295.858 3.508 20 0 CHADHO CCC[C@H](NCc1cccc(C[NH+](C)C)c1)c1cccnc1 ZINC000184936532 262033948 /nfs/dbraw/zinc/03/39/48/262033948.db2.gz HLKUMZVAWGZXKW-IBGZPJMESA-N 1 3 297.446 3.774 20 0 CHADHO C[C@H]1C[N@H+](C)CC[C@@H]1NCc1ccc(-c2ccccc2)cc1 ZINC000319700955 262351057 /nfs/dbraw/zinc/35/10/57/262351057.db2.gz TWZTVUHRUZIFTK-JXFKEZNVSA-N 1 3 294.442 3.783 20 0 CHADHO C[C@H]1C[N@@H+](C)CC[C@@H]1NCc1ccc(-c2ccccc2)cc1 ZINC000319700955 262351058 /nfs/dbraw/zinc/35/10/58/262351058.db2.gz TWZTVUHRUZIFTK-JXFKEZNVSA-N 1 3 294.442 3.783 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCCC1)c1ccc2ccccc2c1 ZINC000021013864 262374113 /nfs/dbraw/zinc/37/41/13/262374113.db2.gz YTMJVMLFXYDYNE-MRXNPFEDSA-N 1 3 282.431 3.976 20 0 CHADHO CC[NH2+]CC1CCN(Cc2cccc(SCC)c2)CC1 ZINC000414654339 263021945 /nfs/dbraw/zinc/02/19/45/263021945.db2.gz BZBQWHLXBKONJB-UHFFFAOYSA-N 1 3 292.492 3.620 20 0 CHADHO C[NH2+]CCC1CCN(Cc2ccc(-c3ccccc3)o2)CC1 ZINC000414663001 263024089 /nfs/dbraw/zinc/02/40/89/263024089.db2.gz QYUCJTYYEYMHDV-UHFFFAOYSA-N 1 3 298.430 3.768 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@@H](N2CCC[C@]3(CC[NH2+]C3)C2)C1 ZINC000414784211 263046593 /nfs/dbraw/zinc/04/65/93/263046593.db2.gz KQLBQYAVQSIJPF-HSALFYBXSA-N 1 3 298.474 3.572 20 0 CHADHO C[C@H](CCC(F)(F)F)[NH2+]CCNC1CCCCCC1 ZINC000414798961 263050501 /nfs/dbraw/zinc/05/05/01/263050501.db2.gz CURSCDJIQHIDSO-GFCCVEGCSA-N 1 3 280.378 3.619 20 0 CHADHO Cc1cc(CNCc2ccc([C@@H](C)[NH3+])cc2)ccc1Cl ZINC000414804001 263051817 /nfs/dbraw/zinc/05/18/17/263051817.db2.gz DOAJIGBHDZSLJX-CYBMUJFWSA-N 1 3 288.822 3.958 20 0 CHADHO CSc1ccc(CNCc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000414810446 263052882 /nfs/dbraw/zinc/05/28/82/263052882.db2.gz ODAIPBDSOCQWEW-ZDUSSCGKSA-N 1 3 286.444 3.718 20 0 CHADHO Cc1cccc(CNCc2ccc([C@@H](C)[NH3+])cc2)c1C ZINC000414809253 263052926 /nfs/dbraw/zinc/05/29/26/263052926.db2.gz LUUSPHBWLDTOLJ-OAHLLOKOSA-N 1 3 268.404 3.613 20 0 CHADHO C[C@H]([NH3+])c1ccc(CNCc2ccc(F)c(Cl)c2)cc1 ZINC000414812314 263053360 /nfs/dbraw/zinc/05/33/60/263053360.db2.gz RBAHNHHHGVGJPW-NSHDSACASA-N 1 3 292.785 3.789 20 0 CHADHO C[C@@H]1C[C@@H](NC2C[C@H]3CC[C@@H](C2)[NH2+]3)C[C@H](c2ccccc2)C1 ZINC000414822925 263055539 /nfs/dbraw/zinc/05/55/39/263055539.db2.gz CZTJCCGBIZRVLN-HMSCLLRNSA-N 1 3 298.474 3.831 20 0 CHADHO C[C@H](CCc1ccsc1)NCC1([NH3+])CCCCCC1 ZINC000414858459 263074709 /nfs/dbraw/zinc/07/47/09/263074709.db2.gz JLSTZMJDPNKEAW-CQSZACIVSA-N 1 3 280.481 3.711 20 0 CHADHO C[N@@H+]1CCC[C@@H]1CCN(C1CC1)[C@H]1CCc2ccccc21 ZINC000340370030 263120024 /nfs/dbraw/zinc/12/00/24/263120024.db2.gz KIDCMCUBBWSWDS-APWZRJJASA-N 1 3 284.447 3.623 20 0 CHADHO C[N@H+]1CCC[C@@H]1CCN(C1CC1)[C@H]1CCc2ccccc21 ZINC000340370030 263120025 /nfs/dbraw/zinc/12/00/25/263120025.db2.gz KIDCMCUBBWSWDS-APWZRJJASA-N 1 3 284.447 3.623 20 0 CHADHO Cc1ccccc1-c1cccc(C[NH2+]C2(C)CCNCC2)c1 ZINC000414929969 263136111 /nfs/dbraw/zinc/13/61/11/263136111.db2.gz AFZFRMLFNOBARO-UHFFFAOYSA-N 1 3 294.442 3.894 20 0 CHADHO CCCC[C@H](C)[NH2+]C[C@@H]1CNCC[C@@H]1c1ccc(F)cc1 ZINC000414998176 263197191 /nfs/dbraw/zinc/19/71/91/263197191.db2.gz IANAHSMFDJZEEM-QILLFSRXSA-N 1 3 292.442 3.687 20 0 CHADHO Clc1ccc([C@H]2CCC[C@@H]2[NH2+]CCCNC2CC2)cc1 ZINC000415064643 263259419 /nfs/dbraw/zinc/25/94/19/263259419.db2.gz DFSDOSIQBHRNAF-SJORKVTESA-N 1 3 292.854 3.708 20 0 CHADHO C[C@@H]([NH2+]C1CCNCC1)C(c1ccccc1)c1ccccc1 ZINC000415076352 263266588 /nfs/dbraw/zinc/26/65/88/263266588.db2.gz AVRLOMANSHPPLX-MRXNPFEDSA-N 1 3 294.442 3.549 20 0 CHADHO C[C@@H](NC1CC[NH2+]CC1)C(c1ccccc1)c1ccccc1 ZINC000415076352 263266590 /nfs/dbraw/zinc/26/65/90/263266590.db2.gz AVRLOMANSHPPLX-MRXNPFEDSA-N 1 3 294.442 3.549 20 0 CHADHO CCc1ccccc1CN[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415084912 263268653 /nfs/dbraw/zinc/26/86/53/263268653.db2.gz PFEOUKHXRSPGME-PMACEKPBSA-N 1 3 294.442 3.832 20 0 CHADHO CC(C)(C)CC[NH2+]C[C@@H]1CCN(CCc2ccccc2)C1 ZINC000187816834 263269949 /nfs/dbraw/zinc/26/99/49/263269949.db2.gz KPSNRJSVHKQDRN-SFHVURJKSA-N 1 3 288.479 3.577 20 0 CHADHO c1ccc(C[C@H](N[C@H]2CCC[NH2+]CC2)c2ccccc2)cc1 ZINC000415088415 263271724 /nfs/dbraw/zinc/27/17/24/263271724.db2.gz LYEYWNNDXOXJJU-PMACEKPBSA-N 1 3 294.442 3.702 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)NC[C@H]1CCC[NH2+]C1 ZINC000415112991 263272988 /nfs/dbraw/zinc/27/29/88/263272988.db2.gz SCBLSHAUSPYIFU-WMZOPIPTSA-N 1 3 274.452 3.671 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)[NH2+]C[C@H]1CCCNC1 ZINC000415112991 263272989 /nfs/dbraw/zinc/27/29/89/263272989.db2.gz SCBLSHAUSPYIFU-WMZOPIPTSA-N 1 3 274.452 3.671 20 0 CHADHO Cc1ccccc1[C@@H](CC(C)C)N[C@H]1CCC[NH2+]CC1 ZINC000415115603 263273826 /nfs/dbraw/zinc/27/38/26/263273826.db2.gz UGUITFRJCMFVOA-FUHWJXTLSA-N 1 3 274.452 3.814 20 0 CHADHO CS[C@H]1CC[C@H]1NCc1ccccc1C[N@H+](C)C(C)C ZINC000425365384 264211271 /nfs/dbraw/zinc/21/12/71/264211271.db2.gz YDHGACBZNLSCMM-SJORKVTESA-N 1 3 292.492 3.510 20 0 CHADHO CS[C@H]1CC[C@H]1NCc1ccccc1C[N@@H+](C)C(C)C ZINC000425365384 264211273 /nfs/dbraw/zinc/21/12/73/264211273.db2.gz YDHGACBZNLSCMM-SJORKVTESA-N 1 3 292.492 3.510 20 0 CHADHO CC(C)CC1(CN[C@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC000391948176 265032294 /nfs/dbraw/zinc/03/22/94/265032294.db2.gz XUTQBFYVKDUDBU-CVEARBPZSA-N 1 3 258.409 3.547 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1C[NH+]1CCC(N2CCCC2)CC1 ZINC000191047230 265136362 /nfs/dbraw/zinc/13/63/62/265136362.db2.gz UWZVILIDIHHFGH-FUHWJXTLSA-N 1 3 276.468 3.539 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1CN1CCC([NH+]2CCCC2)CC1 ZINC000191047230 265136366 /nfs/dbraw/zinc/13/63/66/265136366.db2.gz UWZVILIDIHHFGH-FUHWJXTLSA-N 1 3 276.468 3.539 20 0 CHADHO Cc1ccc(C)c(C[NH2+]C[C@@H](C)CN2CCCCC2)c1 ZINC000048327221 328051722 /nfs/dbraw/zinc/05/17/22/328051722.db2.gz CBCIFMHIDMXSOM-MRXNPFEDSA-N 1 3 274.452 3.515 20 0 CHADHO C[C@@H](NCCCCC[NH+]1CCCC1)c1cccc(F)c1F ZINC000563669689 328083373 /nfs/dbraw/zinc/08/33/73/328083373.db2.gz FBZQIEOHIKPRBR-CQSZACIVSA-N 1 3 296.405 3.882 20 0 CHADHO C[C@H](C[C@H]1CCCCC[NH2+]1)NCCCc1cccs1 ZINC000582719737 329129872 /nfs/dbraw/zinc/12/98/72/329129872.db2.gz VDEBUZVLALMLOX-HUUCEWRRSA-N 1 3 280.481 3.581 20 0 CHADHO C[C@H]1C[N@H+](CC2CCC(c3ccccc3)CC2)CC[C@@H]1N ZINC000414652039 328208292 /nfs/dbraw/zinc/20/82/92/328208292.db2.gz CYLLPXKSRWQUTH-GSHBMFQSSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@H]1C[N@@H+](CC2CCC(c3ccccc3)CC2)CC[C@@H]1N ZINC000414652039 328208294 /nfs/dbraw/zinc/20/82/94/328208294.db2.gz CYLLPXKSRWQUTH-GSHBMFQSSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@H]1CN(CC2CCC(c3ccccc3)CC2)CC[C@@H]1[NH3+] ZINC000414652039 328208295 /nfs/dbraw/zinc/20/82/95/328208295.db2.gz CYLLPXKSRWQUTH-GSHBMFQSSA-N 1 3 286.463 3.630 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](NCc2ccc(-c3ccccc3)s2)C1 ZINC000414934578 328274979 /nfs/dbraw/zinc/27/49/79/328274979.db2.gz XWINRXNXEVCOGL-HUUCEWRRSA-N 1 3 286.444 3.775 20 0 CHADHO [NH3+][C@H]1CCC[C@H](CNCc2cc(Cl)ccc2Cl)C1 ZINC000414998964 328292384 /nfs/dbraw/zinc/29/23/84/328292384.db2.gz RFKYXFFTXJKCFR-GWCFXTLKSA-N 1 3 287.234 3.601 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@@H](C)c1cccc2ccccc21 ZINC000049552001 328371770 /nfs/dbraw/zinc/37/17/70/328371770.db2.gz NPAAAPTVQYYQAA-CABCVRRESA-N 1 3 270.420 3.831 20 0 CHADHO Cc1ccsc1[C@H](C)[NH2+]C[C@H](C)CN1CCCCC1 ZINC000070091863 328386753 /nfs/dbraw/zinc/38/67/53/328386753.db2.gz PIKHIAGYVFTMAA-ZFWWWQNUSA-N 1 3 280.481 3.829 20 0 CHADHO Cc1cc(N2C[C@H]([NH+]3CCCC3)C[C@@H]2C)c2ccccc2n1 ZINC000557735457 327023607 /nfs/dbraw/zinc/02/36/07/327023607.db2.gz YTMACBCRUUNDQQ-JKSUJKDBSA-N 1 3 295.430 3.606 20 0 CHADHO C[C@@H](c1ccccc1Cl)N1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000584172994 327057516 /nfs/dbraw/zinc/05/75/16/327057516.db2.gz OIFUVJASVIQRHJ-ZFWWWQNUSA-N 1 3 292.854 3.723 20 0 CHADHO CC[C@H](NCC1CC[NH+](CC)CC1)c1ccc(F)cc1F ZINC000558800578 327121177 /nfs/dbraw/zinc/12/11/77/327121177.db2.gz XBKKPSILMBHCDF-KRWDZBQOSA-N 1 3 296.405 3.737 20 0 CHADHO CC[NH+](CC)C[C@H]1CCN([C@H]2C=CCCCCC2)C1 ZINC000559105655 327141333 /nfs/dbraw/zinc/14/13/33/327141333.db2.gz GGYKWJKXNQANIX-SJORKVTESA-N 1 3 264.457 3.539 20 0 CHADHO CCN(CC)C[C@H]1CC[N@@H+]([C@H]2C=CCCCCC2)C1 ZINC000559105655 327141335 /nfs/dbraw/zinc/14/13/35/327141335.db2.gz GGYKWJKXNQANIX-SJORKVTESA-N 1 3 264.457 3.539 20 0 CHADHO CCN(CC)C[C@H]1CC[N@H+]([C@H]2C=CCCCCC2)C1 ZINC000559105655 327141336 /nfs/dbraw/zinc/14/13/36/327141336.db2.gz GGYKWJKXNQANIX-SJORKVTESA-N 1 3 264.457 3.539 20 0 CHADHO CC(C)C[C@@H](C)C[N@@H+]1CCC[C@@H](N2CCCC2)CC1 ZINC000410378047 327188880 /nfs/dbraw/zinc/18/88/80/327188880.db2.gz KASZIEKUFYVOLV-IAGOWNOFSA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)C[C@@H](C)C[N@H+]1CCC[C@@H](N2CCCC2)CC1 ZINC000410378047 327188882 /nfs/dbraw/zinc/18/88/82/327188882.db2.gz KASZIEKUFYVOLV-IAGOWNOFSA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)C[C@@H](C)CN1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000410378047 327188884 /nfs/dbraw/zinc/18/88/84/327188884.db2.gz KASZIEKUFYVOLV-IAGOWNOFSA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000560550150 327323768 /nfs/dbraw/zinc/32/37/68/327323768.db2.gz VAXHAPCYSUGSNW-LAQRGFTBSA-N 1 3 278.484 3.664 20 0 CHADHO CN(C)Cc1ccc(C[NH2+][C@H]2CC[C@H]2C(C)(C)C)cc1 ZINC000570505083 327596491 /nfs/dbraw/zinc/59/64/91/327596491.db2.gz YKNLUJUFBWXLRJ-SJORKVTESA-N 1 3 274.452 3.663 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)[NH2+][C@@H](C)[C@@H]2CCCNC2)cc1 ZINC000570673959 327610117 /nfs/dbraw/zinc/61/01/17/327610117.db2.gz GLYGYZJEPBBRKT-JTDSTZFVSA-N 1 3 288.479 3.719 20 0 CHADHO C[C@@H]1CCCC[C@H]1C[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000394863724 329158338 /nfs/dbraw/zinc/15/83/38/329158338.db2.gz RVYWCVJNJDMTSM-KGLIPLIRSA-N 1 3 266.473 3.712 20 0 CHADHO C[C@H]1CCCC[C@H]1C[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000394863723 329158373 /nfs/dbraw/zinc/15/83/73/329158373.db2.gz RVYWCVJNJDMTSM-KBPBESRZSA-N 1 3 266.473 3.712 20 0 CHADHO CCN(C)C[C@H]1CC[N@H+](Cc2c(C)oc3ccccc32)C1 ZINC000180044007 329214777 /nfs/dbraw/zinc/21/47/77/329214777.db2.gz SYEITWNHDMQBTQ-OAHLLOKOSA-N 1 3 286.419 3.515 20 0 CHADHO CCN(C)C[C@H]1CC[N@@H+](Cc2c(C)oc3ccccc32)C1 ZINC000180044007 329214779 /nfs/dbraw/zinc/21/47/79/329214779.db2.gz SYEITWNHDMQBTQ-OAHLLOKOSA-N 1 3 286.419 3.515 20 0 CHADHO CCC(CC)[C@H](NC1CC[NH2+]CC1)c1ccccc1 ZINC000038041297 329354810 /nfs/dbraw/zinc/35/48/10/329354810.db2.gz LJFWEANYIKMPIK-KRWDZBQOSA-N 1 3 260.425 3.506 20 0 CHADHO CCC(CC)[C@H]([NH2+]C1CCNCC1)c1ccccc1 ZINC000038041297 329354811 /nfs/dbraw/zinc/35/48/11/329354811.db2.gz LJFWEANYIKMPIK-KRWDZBQOSA-N 1 3 260.425 3.506 20 0 CHADHO CC[NH2+]CCCN[C@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000583198213 329360180 /nfs/dbraw/zinc/36/01/80/329360180.db2.gz SVFKRLFRJKDSDA-HOCLYGCPSA-N 1 3 280.843 3.565 20 0 CHADHO CCNCCC[NH2+][C@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000583198213 329360181 /nfs/dbraw/zinc/36/01/81/329360181.db2.gz SVFKRLFRJKDSDA-HOCLYGCPSA-N 1 3 280.843 3.565 20 0 CHADHO C[C@@H](NCC[C@@H]1CCC[NH2+]C1)c1c(F)cccc1Cl ZINC000420404238 329764173 /nfs/dbraw/zinc/76/41/73/329764173.db2.gz MAYLUMCVZCLTOX-NEPJUHHUSA-N 1 3 284.806 3.519 20 0 CHADHO CC[C@H](C)C[NH2+]C1CCN([C@H]2CCC[C@H](C)C2)CC1 ZINC000421383254 329818314 /nfs/dbraw/zinc/81/83/14/329818314.db2.gz NUFKERMVPSLZLA-ZOBUZTSGSA-N 1 3 266.473 3.665 20 0 CHADHO CCC[N@H+](Cc1cccc(C2CC2)c1)C1CCNCC1 ZINC000422551556 330149158 /nfs/dbraw/zinc/14/91/58/330149158.db2.gz FCLJIDFHVSJILW-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO CCC[N@@H+](Cc1cccc(C2CC2)c1)C1CCNCC1 ZINC000422551556 330149159 /nfs/dbraw/zinc/14/91/59/330149159.db2.gz FCLJIDFHVSJILW-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO CCCN(Cc1cccc(C2CC2)c1)C1CC[NH2+]CC1 ZINC000422551556 330149160 /nfs/dbraw/zinc/14/91/60/330149160.db2.gz FCLJIDFHVSJILW-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@@H](C)[C@@H]2CCC[NH2+]C2)cc1 ZINC000422693205 330150843 /nfs/dbraw/zinc/15/08/43/330150843.db2.gz LGYDFIFTVUUBRL-RLFYNMQTSA-N 1 3 274.452 3.849 20 0 CHADHO c1ccc(C[C@H]2CCCC[C@@H]2NC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000422712031 330151414 /nfs/dbraw/zinc/15/14/14/330151414.db2.gz NRQTWCVIAXYAKS-QDSUGMFFSA-N 1 3 298.474 3.661 20 0 CHADHO NC[C@H]1CCC[C@H]1[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000422756556 330153682 /nfs/dbraw/zinc/15/36/82/330153682.db2.gz LSKOTMUOBXJVRW-UYAOXDASSA-N 1 3 294.442 3.536 20 0 CHADHO NC[C@@H]1CCC[C@@H]1[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000422756554 330153731 /nfs/dbraw/zinc/15/37/31/330153731.db2.gz LSKOTMUOBXJVRW-ICSRJNTNSA-N 1 3 294.442 3.536 20 0 CHADHO CC(C)(CN[C@H]1C[C@H]([NH3+])c2ccccc21)c1cccc(F)c1 ZINC000422762884 330153990 /nfs/dbraw/zinc/15/39/90/330153990.db2.gz OOTURZMRTPIGCN-ROUUACIJSA-N 1 3 298.405 3.838 20 0 CHADHO Cc1ccc(CN[C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC000422763956 330154110 /nfs/dbraw/zinc/15/41/10/330154110.db2.gz PDDBSMNDUCUHGR-OALUTQOASA-N 1 3 280.415 3.578 20 0 CHADHO NC[C@H]1CCC[C@@H]1[NH2+]CC1(c2cccs2)CCCCC1 ZINC000422767937 330154264 /nfs/dbraw/zinc/15/42/64/330154264.db2.gz NHZOBVHGYJHYQR-CABCVRRESA-N 1 3 292.492 3.667 20 0 CHADHO CCC[C@H](N[C@H](C)[C@@H]1CCC[NH2+]C1)c1ccccc1 ZINC000422771578 330154280 /nfs/dbraw/zinc/15/42/80/330154280.db2.gz WCQOUTBUKKGUEL-OIISXLGYSA-N 1 3 260.425 3.506 20 0 CHADHO CCC[C@H]([NH2+][C@H](C)[C@@H]1CCCNC1)c1ccccc1 ZINC000422771578 330154281 /nfs/dbraw/zinc/15/42/81/330154281.db2.gz WCQOUTBUKKGUEL-OIISXLGYSA-N 1 3 260.425 3.506 20 0 CHADHO Cc1cccc([C@H](C)CN[C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)c1 ZINC000422786744 330155113 /nfs/dbraw/zinc/15/51/13/330155113.db2.gz QQFGRVNYTHPARA-NXWXRZEISA-N 1 3 286.463 3.609 20 0 CHADHO Cc1cccc([C@H](C)CN[C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)c1 ZINC000422786749 330155337 /nfs/dbraw/zinc/15/53/37/330155337.db2.gz QQFGRVNYTHPARA-XGXHKWSGSA-N 1 3 286.463 3.609 20 0 CHADHO Cc1cc(C)cc(CCN[C@@H]2C[C@@H]([NH3+])c3ccccc32)c1 ZINC000422794273 330155474 /nfs/dbraw/zinc/15/54/74/330155474.db2.gz YYHIGYQZHSRSSD-RTBURBONSA-N 1 3 280.415 3.580 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H](c1ccccc1)C(C)C ZINC000422792781 330155502 /nfs/dbraw/zinc/15/55/02/330155502.db2.gz WLAGRTKTTIONFP-HNAYVOBHSA-N 1 3 297.446 3.897 20 0 CHADHO CC[C@H](N[C@H](C)[C@H]1CCC[NH2+]C1)c1ccc(Cl)cc1 ZINC000422825556 330156593 /nfs/dbraw/zinc/15/65/93/330156593.db2.gz PZKKKLUQFVNUFP-INWMFGNUSA-N 1 3 280.843 3.769 20 0 CHADHO C[C@H](N[C@@H](c1cccc(F)c1)C(C)(C)C)[C@H]1CC[NH2+]C1 ZINC000422837560 330157199 /nfs/dbraw/zinc/15/71/99/330157199.db2.gz MBQFXXYZUNEZJS-NOLJZWGESA-N 1 3 278.415 3.501 20 0 CHADHO CC[C@H](N[C@H](C)C[C@@H](C)[NH3+])c1cccc(Cl)c1 ZINC000422853783 330157452 /nfs/dbraw/zinc/15/74/52/330157452.db2.gz CGSRYKIIPPFYLQ-GYSYKLTISA-N 1 3 254.805 3.507 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](c1cccc(F)c1)C1CCCC1 ZINC000422879415 330158960 /nfs/dbraw/zinc/15/89/60/330158960.db2.gz VIIHJNAKMYOQCD-OGHNNQOOSA-N 1 3 278.415 3.772 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]CC(C)(C)Cc1cccc(Cl)c1 ZINC000422880674 330159033 /nfs/dbraw/zinc/15/90/33/330159033.db2.gz XKYBGLQFOUUQFA-QWHCGFSZSA-N 1 3 282.859 3.624 20 0 CHADHO CC[C@H](N[C@@H](C)CCC[NH3+])c1ccccc1Br ZINC000422892163 330159104 /nfs/dbraw/zinc/15/91/04/330159104.db2.gz MKGDNRKUTBXFGI-FZMZJTMJSA-N 1 3 299.256 3.617 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C1CCC(C(C)C)CC1 ZINC000422890018 330159137 /nfs/dbraw/zinc/15/91/37/330159137.db2.gz HKBCZNLCTOMPDA-JEYLPNPQSA-N 1 3 289.467 3.714 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CC(C)(C)CC(C)C ZINC000422917399 330160208 /nfs/dbraw/zinc/16/02/08/330160208.db2.gz DQOYQTVPNQBMTR-CYBMUJFWSA-N 1 3 277.456 3.572 20 0 CHADHO [NH3+][C@@H]1C[C@H](N[C@H](Cc2ccccc2)C2CC2)c2ccccc21 ZINC000422914705 330160326 /nfs/dbraw/zinc/16/03/26/330160326.db2.gz VOVLXUFSVDZBOG-AQNXPRMDSA-N 1 3 292.426 3.742 20 0 CHADHO C[C@@H](CCC[NH3+])N[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000422935098 330161460 /nfs/dbraw/zinc/16/14/60/330161460.db2.gz KPNPUYVOTGFABM-KBXCAEBGSA-N 1 3 286.394 3.632 20 0 CHADHO NC[C@H]1CCCC[C@@H]1[NH2+]CCc1csc2ccccc12 ZINC000422935637 330161520 /nfs/dbraw/zinc/16/15/20/330161520.db2.gz LGXQIEKHSCMHGS-CJNGLKHVSA-N 1 3 288.460 3.551 20 0 CHADHO C[C@@H](N[C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccccc1 ZINC000422986454 330163064 /nfs/dbraw/zinc/16/30/64/330163064.db2.gz GVLNCSFTFZLYJS-LZQZEXGQSA-N 1 3 280.415 3.831 20 0 CHADHO [NH3+][C@@H]1C[C@H](NCC2(Cc3ccccc3)CC2)c2ccccc21 ZINC000422996446 330163550 /nfs/dbraw/zinc/16/35/50/330163550.db2.gz MDFMBAPNBFNUNB-MOPGFXCFSA-N 1 3 292.426 3.744 20 0 CHADHO Cc1ccc(CC[C@H](C)N[C@@H]2C[C@@H]([NH3+])c3ccccc32)o1 ZINC000423008518 330165127 /nfs/dbraw/zinc/16/51/27/330165127.db2.gz SWSXZBMKFPFWCM-JBBXEZCESA-N 1 3 284.403 3.644 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](C)Cc1c(Cl)cccc1Cl ZINC000423017135 330165448 /nfs/dbraw/zinc/16/54/48/330165448.db2.gz VMPLDGIQZVOVNV-AXFHLTTASA-N 1 3 289.250 3.640 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+][C@@H](C)Cc1c(Cl)cccc1Cl ZINC000423017135 330165449 /nfs/dbraw/zinc/16/54/49/330165449.db2.gz VMPLDGIQZVOVNV-AXFHLTTASA-N 1 3 289.250 3.640 20 0 CHADHO CC1(CN[C@@H]2C[C@@H]([NH3+])c3ccccc32)Cc2ccccc2C1 ZINC000423019003 330165785 /nfs/dbraw/zinc/16/57/85/330165785.db2.gz STHSLPCRMIXBDD-RTBURBONSA-N 1 3 292.426 3.526 20 0 CHADHO CC1(CN[C@@H]2C[C@H]([NH3+])c3ccccc32)Cc2ccccc2C1 ZINC000423019002 330165816 /nfs/dbraw/zinc/16/58/16/330165816.db2.gz STHSLPCRMIXBDD-RBUKOAKNSA-N 1 3 292.426 3.526 20 0 CHADHO c1ccc([C@@H](CC2CCC2)N[C@H]2CCC[NH2+]CC2)cc1 ZINC000423038884 330166516 /nfs/dbraw/zinc/16/65/16/330166516.db2.gz DJCPNIMXOQUFHS-ZWKOTPCHSA-N 1 3 272.436 3.650 20 0 CHADHO C[C@@H](N)C[C@@H](C)[NH2+]C1CCC(c2ccc(F)cc2)CC1 ZINC000423037484 330166669 /nfs/dbraw/zinc/16/66/69/330166669.db2.gz WBCMTTXIAXOEFL-MZPXATCKSA-N 1 3 278.415 3.567 20 0 CHADHO NC[C@H]1CCC[C@@H]1[NH2+]CC1(Cc2ccccc2)CCCC1 ZINC000423049473 330166975 /nfs/dbraw/zinc/16/69/75/330166975.db2.gz XSBCGSBBYREHDY-MSOLQXFVSA-N 1 3 286.463 3.507 20 0 CHADHO C[C@@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)C1(c2ccccc2)CCCC1 ZINC000423052731 330167517 /nfs/dbraw/zinc/16/75/17/330167517.db2.gz QJUKLVTZTKFSAE-YJJAZYOBSA-N 1 3 298.474 3.760 20 0 CHADHO C[C@H](N[C@H]1CCC[NH2+]CC1)c1cc2ccccc2s1 ZINC000423062651 330168022 /nfs/dbraw/zinc/16/80/22/330168022.db2.gz UOXLFFKBDUTLAH-JSGCOSHPSA-N 1 3 274.433 3.694 20 0 CHADHO C[C@H](CCCC(F)(F)F)N[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423078785 330168570 /nfs/dbraw/zinc/16/85/70/330168570.db2.gz WTHHACLOXOAUAF-LERXQTSPSA-N 1 3 286.341 3.842 20 0 CHADHO CC(C)[C@@H]1C[C@@H](C[NH2+][C@H](C)C[C@H](C)N)c2ccccc21 ZINC000423089424 330169012 /nfs/dbraw/zinc/16/90/12/330169012.db2.gz VHUPPCGYJHJYLZ-KRXQYRFLSA-N 1 3 274.452 3.629 20 0 CHADHO CC(C)[C@@H]1C[C@@H](C[NH2+][C@H](C)C[C@@H](C)N)c2ccccc21 ZINC000423089423 330169252 /nfs/dbraw/zinc/16/92/52/330169252.db2.gz VHUPPCGYJHJYLZ-BSXFFOKHSA-N 1 3 274.452 3.629 20 0 CHADHO CC(C)[C@H](CN[C@H]1CCC[C@H]1[NH3+])c1ccc(Cl)cc1 ZINC000423103287 330170440 /nfs/dbraw/zinc/17/04/40/330170440.db2.gz GGOKARODKYYONQ-XHSDSOJGSA-N 1 3 280.843 3.549 20 0 CHADHO N[C@H]1CCCCC[C@@H]1[NH2+]Cc1ccc2sccc2c1 ZINC000423130035 330171703 /nfs/dbraw/zinc/17/17/03/330171703.db2.gz XXFQIHHLNRMFKF-GJZGRUSLSA-N 1 3 274.433 3.651 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](C)c1ccc(F)c2ccccc21 ZINC000423132407 330171805 /nfs/dbraw/zinc/17/18/05/330171805.db2.gz UNZQJEGVSSQPTK-AVGNSLFASA-N 1 3 274.383 3.755 20 0 CHADHO c1ccc2c(c1)CC[C@@H]2CCN[C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000423149818 330172944 /nfs/dbraw/zinc/17/29/44/330172944.db2.gz XXGOBARHSGCOEV-GSEOLPGOSA-N 1 3 298.474 3.617 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@@H]1CCCC(C)(C)C1 ZINC000423165675 330173865 /nfs/dbraw/zinc/17/38/65/330173865.db2.gz QBLFUPDPNRBDTC-DZGCQCFKSA-N 1 3 289.467 3.716 20 0 CHADHO C[C@H](NCCC[NH3+])c1ccc(SC2CCCC2)cc1 ZINC000423174403 330174795 /nfs/dbraw/zinc/17/47/95/330174795.db2.gz AOWPQILXMJJDQA-ZDUSSCGKSA-N 1 3 278.465 3.721 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000423177690 330175101 /nfs/dbraw/zinc/17/51/01/330175101.db2.gz HMLKCMKILAOAHE-DUPGQFARSA-N 1 3 280.843 3.692 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000423177692 330175263 /nfs/dbraw/zinc/17/52/63/330175263.db2.gz HMLKCMKILAOAHE-LMRQPLJMSA-N 1 3 280.843 3.692 20 0 CHADHO Clc1ccc([C@@H]2CC[C@@H]([NH2+]C[C@H]3CCCNC3)C2)cc1 ZINC000423202651 330176866 /nfs/dbraw/zinc/17/68/66/330176866.db2.gz BINDCLIXHVZFKM-YSVLISHTSA-N 1 3 292.854 3.565 20 0 CHADHO Clc1ccc([C@H](CC2CC2)NC[C@H]2CCC[NH2+]C2)cc1 ZINC000423205615 330177040 /nfs/dbraw/zinc/17/70/40/330177040.db2.gz FEUJEEPQEKUUCF-YOEHRIQHSA-N 1 3 292.854 3.770 20 0 CHADHO CNCCC[NH2+][C@@H]1CCC[C@H](c2ccc(Cl)cc2)C1 ZINC000423208075 330177315 /nfs/dbraw/zinc/17/73/15/330177315.db2.gz YQXKUQLQEDKBHU-GOEBONIOSA-N 1 3 280.843 3.565 20 0 CHADHO C[NH2+]CCCN[C@@H]1CCC[C@H](c2ccc(Cl)cc2)C1 ZINC000423208075 330177316 /nfs/dbraw/zinc/17/73/16/330177316.db2.gz YQXKUQLQEDKBHU-GOEBONIOSA-N 1 3 280.843 3.565 20 0 CHADHO Clc1ccc2c(c1)[C@@H](NC[C@H]1CCC[NH2+]C1)CCCC2 ZINC000423221222 330179413 /nfs/dbraw/zinc/17/94/13/330179413.db2.gz ZJPOBPFXRJRIER-GUYCJALGSA-N 1 3 292.854 3.697 20 0 CHADHO CCc1ccc([C@H](CC)N[C@@H](C)[C@H]2CCC[NH2+]C2)cc1 ZINC000423221918 330179828 /nfs/dbraw/zinc/17/98/28/330179828.db2.gz YRQZVBQNPKEVNM-WBAXXEDZSA-N 1 3 274.452 3.678 20 0 CHADHO CCc1ccc([C@H](CC)[NH2+][C@@H](C)[C@H]2CCCNC2)cc1 ZINC000423221918 330179830 /nfs/dbraw/zinc/17/98/30/330179830.db2.gz YRQZVBQNPKEVNM-WBAXXEDZSA-N 1 3 274.452 3.678 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+][C@H]2CCCC[C@H]2CN)c2sccc21 ZINC000423267243 330184377 /nfs/dbraw/zinc/18/43/77/330184377.db2.gz CPJJAPDLRFEWLZ-DHMWGJHJSA-N 1 3 278.465 3.794 20 0 CHADHO C[C@@H]1CC[C@H](N[C@H]2CCCC[C@H]2C[NH3+])c2sccc21 ZINC000423267243 330184378 /nfs/dbraw/zinc/18/43/78/330184378.db2.gz CPJJAPDLRFEWLZ-DHMWGJHJSA-N 1 3 278.465 3.794 20 0 CHADHO CSc1ccccc1[C@H](C)N[C@H]1CCCC[C@H]1C[NH3+] ZINC000423275020 330184797 /nfs/dbraw/zinc/18/47/97/330184797.db2.gz LHGFBAOIWPAIFU-YDHLFZDLSA-N 1 3 278.465 3.577 20 0 CHADHO CC[C@@H](CSc1ccc(Cl)cc1)N[C@@H](C[NH3+])C1CC1 ZINC000423277472 330184965 /nfs/dbraw/zinc/18/49/65/330184965.db2.gz OEMKGPNPPYFETP-ZFWWWQNUSA-N 1 3 298.883 3.538 20 0 CHADHO CC(C)[C@@H]([NH3+])CN[C@@H](C)C(c1ccccc1)c1ccccc1 ZINC000423285888 330185876 /nfs/dbraw/zinc/18/58/76/330185876.db2.gz ZSOHQNWUGMJLNG-LPHOPBHVSA-N 1 3 296.458 3.780 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCCc2c3ccccc3[nH]c21 ZINC000423282463 330185880 /nfs/dbraw/zinc/18/58/80/330185880.db2.gz VCLHDKWGIXRAJJ-OWQGQXMQSA-N 1 3 297.446 3.652 20 0 CHADHO [NH3+]C[C@@H]1CCCC[C@@H]1N[C@H]1CCCc2c3ccccc3[nH]c21 ZINC000423282463 330185882 /nfs/dbraw/zinc/18/58/82/330185882.db2.gz VCLHDKWGIXRAJJ-OWQGQXMQSA-N 1 3 297.446 3.652 20 0 CHADHO Cc1ccc([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)s1 ZINC000423290526 330186769 /nfs/dbraw/zinc/18/67/69/330186769.db2.gz DINJSDCUVPLYOA-OLZOCXBDSA-N 1 3 274.433 3.927 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@H]2CCCc3sccc32)cc1 ZINC000423290260 330186918 /nfs/dbraw/zinc/18/69/18/330186918.db2.gz CODVEGOKIYATDP-LRDDRELGSA-N 1 3 286.444 3.935 20 0 CHADHO COc1ccsc1[C@@H](C)NCc1ccc([C@@H](C)[NH3+])cc1 ZINC000423291535 330187201 /nfs/dbraw/zinc/18/72/01/330187201.db2.gz ISUOFWWAGSTTAZ-VXGBXAGGSA-N 1 3 290.432 3.627 20 0 CHADHO CCC[C@@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1cccnc1 ZINC000423290871 330187205 /nfs/dbraw/zinc/18/72/05/330187205.db2.gz FTCNLZMILIOMLO-RDTXWAMCSA-N 1 3 283.419 3.732 20 0 CHADHO CO[C@H](c1ccccc1)[C@H](C)NCc1ccc([C@@H](C)[NH3+])cc1 ZINC000423292413 330187535 /nfs/dbraw/zinc/18/75/35/330187535.db2.gz MWPFYBGHDQRWFI-VCBZYWHSSA-N 1 3 298.430 3.572 20 0 CHADHO Cc1nc(C)c([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)s1 ZINC000423292841 330187750 /nfs/dbraw/zinc/18/77/50/330187750.db2.gz ORATZSGWEYHZOP-WDEREUQCSA-N 1 3 289.448 3.630 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H]2CCc3ccc(F)cc32)cc1 ZINC000423293806 330188040 /nfs/dbraw/zinc/18/80/40/330188040.db2.gz SCHGVZCEXGJJFH-KZULUSFZSA-N 1 3 284.378 3.623 20 0 CHADHO CC[C@@H](NC[C@@H](C)C[NH3+])c1ccc(Cl)c(Cl)c1 ZINC000423300890 330189003 /nfs/dbraw/zinc/18/90/03/330189003.db2.gz SJZFLKZXFBVBAQ-TVQRCGJNSA-N 1 3 275.223 3.629 20 0 CHADHO C[C@H](C[NH3+])CN[C@H](C)c1ccc(-c2ccccc2F)s1 ZINC000423298265 330189077 /nfs/dbraw/zinc/18/90/77/330189077.db2.gz NVCQVYFLWPFSMS-VXGBXAGGSA-N 1 3 292.423 3.800 20 0 CHADHO C[C@H](CN)C[NH2+][C@H]1CCC[C@@H](c2ccc(Cl)cc2)C1 ZINC000423306553 330189283 /nfs/dbraw/zinc/18/92/83/330189283.db2.gz LTPODZDPOAKKRX-XPKDYRNWSA-N 1 3 280.843 3.551 20 0 CHADHO [NH3+]CCCCN[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000423320006 330190324 /nfs/dbraw/zinc/19/03/24/330190324.db2.gz GAJYWHAJKSFEAU-QGZVFWFLSA-N 1 3 288.822 3.758 20 0 CHADHO CC(C)Sc1ccc([C@@H](C)[NH2+]CC2(N)CCC2)cc1 ZINC000423339791 330192089 /nfs/dbraw/zinc/19/20/89/330192089.db2.gz WYHXJMVUOYBYTD-CYBMUJFWSA-N 1 3 278.465 3.719 20 0 CHADHO C[C@H](NCC1=CC[NH2+]CC1)c1cc(Cl)ccc1Cl ZINC000423345962 330192222 /nfs/dbraw/zinc/19/22/22/330192222.db2.gz OTCDSPXLZRNLBS-JTQLQIEISA-N 1 3 285.218 3.564 20 0 CHADHO C[C@@H]1CC[C@H](NC[C@]2(C)CCC[NH2+]C2)c2ccccc21 ZINC000423343857 330192356 /nfs/dbraw/zinc/19/23/56/330192356.db2.gz XKMUYXZTDLTMDU-FHLIZLRMSA-N 1 3 272.436 3.604 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]C[C@]2(C)CCCNC2)c2ccccc21 ZINC000423343857 330192358 /nfs/dbraw/zinc/19/23/58/330192358.db2.gz XKMUYXZTDLTMDU-FHLIZLRMSA-N 1 3 272.436 3.604 20 0 CHADHO C[C@@H](NCC1=CC[NH2+]CC1)c1ccc(-c2ccccc2)o1 ZINC000423346718 330192540 /nfs/dbraw/zinc/19/25/40/330192540.db2.gz PMVRMZGPCJLVMN-CQSZACIVSA-N 1 3 282.387 3.517 20 0 CHADHO C[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1ccc(F)c2ccccc21 ZINC000423361485 330194105 /nfs/dbraw/zinc/19/41/05/330194105.db2.gz GYPORSUZQQLHTE-IHRRRGAJSA-N 1 3 286.394 3.899 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H](CC2CC2)c2ccc(Cl)cc2)CCN1 ZINC000423367814 330194774 /nfs/dbraw/zinc/19/47/74/330194774.db2.gz AQPVXLBDOJAQDM-CSMYWGQOSA-N 1 3 292.854 3.911 20 0 CHADHO CC(C)[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1ccc(F)c(F)c1 ZINC000423371471 330194908 /nfs/dbraw/zinc/19/49/08/330194908.db2.gz GEVCXDGLTVQRHS-ZENOOKHLSA-N 1 3 282.378 3.521 20 0 CHADHO CC(C)[C@H](CCc1ccccc1)[NH2+][C@H]1CCC[C@@H](N)C1 ZINC000423372214 330195210 /nfs/dbraw/zinc/19/52/10/330195210.db2.gz GXDOVDXIJDPDOV-SQNIBIBYSA-N 1 3 274.452 3.503 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1cc(Cl)cc(Cl)c1 ZINC000423371515 330195364 /nfs/dbraw/zinc/19/53/64/330195364.db2.gz GJQGXTKTTTWXCI-QCZZGDTMSA-N 1 3 287.234 3.914 20 0 CHADHO CCN[C@H](C)C[NH2+][C@@H](c1cccs1)C1CCCC1 ZINC000423373632 330195607 /nfs/dbraw/zinc/19/56/07/330195607.db2.gz HMHJRBSVQRJNMX-IUODEOHRSA-N 1 3 266.454 3.567 20 0 CHADHO CCC[C@H]([NH2+]C[C@@H](N)C1CC1)c1ccc(Cl)cc1 ZINC000423325549 330195658 /nfs/dbraw/zinc/19/56/58/330195658.db2.gz QECHFYQMCDITRD-CABCVRRESA-N 1 3 266.816 3.508 20 0 CHADHO CCCC[C@H](C)[C@@H](C)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423398250 330196074 /nfs/dbraw/zinc/19/60/74/330196074.db2.gz UGPZYZXIPVRODH-UONOGXRCSA-N 1 3 260.425 3.594 20 0 CHADHO CC1(C)Cc2occc2[C@@H](NCc2ccc3c(c2)C[NH2+]C3)C1 ZINC000423401157 330196188 /nfs/dbraw/zinc/19/61/88/330196188.db2.gz VUXOJBHYWFIQIY-KRWDZBQOSA-N 1 3 296.414 3.686 20 0 CHADHO C[C@@H](CCc1ccc(F)cc1)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423403694 330196470 /nfs/dbraw/zinc/19/64/70/330196470.db2.gz XCXHFFWJEYMJPF-AWEZNQCLSA-N 1 3 298.405 3.540 20 0 CHADHO CC[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1ccc(OC(F)F)cc1 ZINC000423406080 330196588 /nfs/dbraw/zinc/19/65/88/330196588.db2.gz YKTQIASOKDGXLI-GUTXKFCHSA-N 1 3 298.377 3.599 20 0 CHADHO CC(C)COc1ccc([C@H](C)N[C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000423405446 330196705 /nfs/dbraw/zinc/19/67/05/330196705.db2.gz YAFTWRUIJRAQGK-BHYGNILZSA-N 1 3 290.451 3.642 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](N[C@H]2CCSc3c(Cl)cccc32)C1 ZINC000423406825 330196916 /nfs/dbraw/zinc/19/69/16/330196916.db2.gz ZERSRTKJZLTXMN-SUNKGSAMSA-N 1 3 296.867 3.736 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](N[C@H]2CCSc3c(Cl)cccc32)C1 ZINC000423406823 330196966 /nfs/dbraw/zinc/19/69/66/330196966.db2.gz ZERSRTKJZLTXMN-GYSYKLTISA-N 1 3 296.867 3.736 20 0 CHADHO C[C@@H](CCc1cccc(F)c1)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423406632 330197119 /nfs/dbraw/zinc/19/71/19/330197119.db2.gz ZCXMEEKKHWQERS-AWEZNQCLSA-N 1 3 298.405 3.540 20 0 CHADHO Cc1ccc2c(c1)[C@@H](NCc1ccc3c(c1)C[NH2+]C3)[C@H](C)C2 ZINC000423375895 330198726 /nfs/dbraw/zinc/19/87/26/330198726.db2.gz IXNUHVNRMUBWGC-VLIAUNLRSA-N 1 3 292.426 3.621 20 0 CHADHO COc1ccc2cc([C@H](C)[NH2+][C@H]3CCN[C@@H](C)C3)ccc2c1 ZINC000423374339 330198734 /nfs/dbraw/zinc/19/87/34/330198734.db2.gz JUHKTGGXGJNNMA-DEYYWGMASA-N 1 3 298.430 3.640 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)CCN1 ZINC000423377883 330198986 /nfs/dbraw/zinc/19/89/86/330198986.db2.gz KPXZYHZAQWMCLB-JLZZUVOBSA-N 1 3 292.854 3.911 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCN[C@@H](C)C1)c1cccc(Cl)c1 ZINC000423383197 330199384 /nfs/dbraw/zinc/19/93/84/330199384.db2.gz PGEXXCFVDVUPOL-GLQYFDAESA-N 1 3 266.816 3.521 20 0 CHADHO C[C@H]([NH2+]Cc1ccc2c(c1)CNC2)[C@@H](C)c1ccccc1 ZINC000423383046 330199450 /nfs/dbraw/zinc/19/94/50/330199450.db2.gz KHUNFVNJBAIWJZ-CABCVRRESA-N 1 3 280.415 3.572 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@H]1N[C@@H](c1ccccc1)C1CCCC1 ZINC000423385205 330199701 /nfs/dbraw/zinc/19/97/01/330199701.db2.gz GOLFEVCZYZCAOA-OLMNPRSZSA-N 1 3 272.436 3.506 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@@H](c1ccccc1)C1CCCC1 ZINC000423385205 330199702 /nfs/dbraw/zinc/19/97/02/330199702.db2.gz GOLFEVCZYZCAOA-OLMNPRSZSA-N 1 3 272.436 3.506 20 0 CHADHO Cc1ccccc1[C@H]([NH2+][C@H]1CCNC[C@H]1C)C1CCCC1 ZINC000423386273 330199761 /nfs/dbraw/zinc/19/97/61/330199761.db2.gz GZZPJRJDEHSADI-AYOQOUSVSA-N 1 3 286.463 3.814 20 0 CHADHO Cc1ccccc1[C@H](N[C@H]1CC[NH2+]C[C@H]1C)C1CCCC1 ZINC000423386273 330199762 /nfs/dbraw/zinc/19/97/62/330199762.db2.gz GZZPJRJDEHSADI-AYOQOUSVSA-N 1 3 286.463 3.814 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](N[C@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000423388970 330199986 /nfs/dbraw/zinc/19/99/86/330199986.db2.gz NUVWEDFOJOTVEV-OAGGEKHMSA-N 1 3 278.827 3.651 20 0 CHADHO FC(F)(F)[C@@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CNC3)C1 ZINC000423389093 330200005 /nfs/dbraw/zinc/20/00/05/330200005.db2.gz NYMWIGFCMJTEEG-CABCVRRESA-N 1 3 298.352 3.501 20 0 CHADHO CC(C)[C@H](CSc1ccccc1)N[C@H]1CCC[C@H]([NH3+])C1 ZINC000423391109 330200166 /nfs/dbraw/zinc/20/01/66/330200166.db2.gz PIBGTSCQBMEPIE-ZOBUZTSGSA-N 1 3 292.492 3.663 20 0 CHADHO CC(C)[C@H](CSc1ccccc1)[NH2+][C@H]1CCC[C@H](N)C1 ZINC000423391109 330200167 /nfs/dbraw/zinc/20/01/67/330200167.db2.gz PIBGTSCQBMEPIE-ZOBUZTSGSA-N 1 3 292.492 3.663 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCC(C)(C)c3ccccc32)CCN1 ZINC000423394442 330200682 /nfs/dbraw/zinc/20/06/82/330200682.db2.gz ZRMZNIREDFSCGN-CKEIUWERSA-N 1 3 272.436 3.529 20 0 CHADHO C[C@@H](N[C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccc(F)cc1Cl ZINC000423430785 330200899 /nfs/dbraw/zinc/20/08/99/330200899.db2.gz IJTPPCQRYMUMAM-FUEDEBDSSA-N 1 3 296.817 3.518 20 0 CHADHO Cc1nc(C(C)(C)C)sc1[C@H](C)N[C@H]1CCC[C@@H]([NH3+])C1 ZINC000423395100 330201004 /nfs/dbraw/zinc/20/10/04/330201004.db2.gz RRGSBHDTGNMNCM-UHTWSYAYSA-N 1 3 295.496 3.670 20 0 CHADHO C[C@@H](N[C@@H](C)CCC[NH3+])c1ccc(Oc2ccccc2)cn1 ZINC000423445089 330202025 /nfs/dbraw/zinc/20/20/25/330202025.db2.gz BOYSUMRUDFPUET-LSDHHAIUSA-N 1 3 299.418 3.652 20 0 CHADHO C[C@H](N)[C@H](C)[NH2+][C@@H](C)c1ccc(-c2cccs2)cc1 ZINC000423452733 330203081 /nfs/dbraw/zinc/20/30/81/330203081.db2.gz WTONFGYPPBEIPB-AVGNSLFASA-N 1 3 274.433 3.801 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)c1cccc(OCc2ccccc2)c1)[C@H](C)N ZINC000423453744 330203205 /nfs/dbraw/zinc/20/32/05/330203205.db2.gz YAFXFTZFAFKZIM-XHSDSOJGSA-N 1 3 298.430 3.652 20 0 CHADHO CC[C@@H](N)C[NH2+][C@@H](C)c1cccc(OCc2ccccc2)c1 ZINC000423464628 330204195 /nfs/dbraw/zinc/20/41/95/330204195.db2.gz MHXCPOFPSKHZST-MAUKXSAKSA-N 1 3 298.430 3.654 20 0 CHADHO CC(C)Oc1ccc([C@H](C)[NH2+][C@H](C)[C@H](C)N)cc1Cl ZINC000423466336 330204549 /nfs/dbraw/zinc/20/45/49/330204549.db2.gz NKSRGEKWOJSCEU-TUAOUCFPSA-N 1 3 284.831 3.514 20 0 CHADHO CC[C@@H](N)C[NH2+][C@H](c1cccc(C(F)(F)F)c1)C(C)C ZINC000423486662 330206738 /nfs/dbraw/zinc/20/67/38/330206738.db2.gz ZYDHIOQQRJMEHY-KGLIPLIRSA-N 1 3 288.357 3.729 20 0 CHADHO C[C@H](N[C@@H]1CC[C@@H](C[NH3+])C1)c1cccc(Cl)c1Cl ZINC000423494675 330207519 /nfs/dbraw/zinc/20/75/19/330207519.db2.gz SOLVOAWQULDEMN-HBNTYKKESA-N 1 3 287.234 3.771 20 0 CHADHO COc1ccccc1[C@H](C)N[C@@H](CCC[NH3+])c1ccccc1 ZINC000423498598 330208183 /nfs/dbraw/zinc/20/81/83/330208183.db2.gz IHBCLONVWKHWRT-YJBOKZPZSA-N 1 3 298.430 3.826 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CNC[C@H]1c1ccccc1)[C@@H](C)c1ccccc1 ZINC000423501367 330208579 /nfs/dbraw/zinc/20/85/79/330208579.db2.gz DIVBDVNAHUEETE-YAJHFMINSA-N 1 3 294.442 3.524 20 0 CHADHO Cc1cncc([C@@H](C)N[C@H](CCC[NH3+])c2ccccc2)c1 ZINC000423519703 330209755 /nfs/dbraw/zinc/20/97/55/330209755.db2.gz QETAQHYTTSAWRT-CRAIPNDOSA-N 1 3 283.419 3.521 20 0 CHADHO C[C@@H]([NH2+]CCCNC1CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423547222 330211396 /nfs/dbraw/zinc/21/13/96/330211396.db2.gz FWYBYGSTMUJHMS-KGYLQXTDSA-N 1 3 298.883 3.625 20 0 CHADHO C[C@@H](NCCC[NH2+]C1CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423547222 330211397 /nfs/dbraw/zinc/21/13/97/330211397.db2.gz FWYBYGSTMUJHMS-KGYLQXTDSA-N 1 3 298.883 3.625 20 0 CHADHO Cc1ccc([C@H](NCCC[NH2+]C2CC2)C2CCC2)cc1 ZINC000423567914 330212056 /nfs/dbraw/zinc/21/20/56/330212056.db2.gz VJGAUKDLDVXSDY-GOSISDBHSA-N 1 3 272.436 3.568 20 0 CHADHO Cc1ccc([C@H]([NH2+]CCCNC2CC2)C2CCC2)cc1 ZINC000423567914 330212057 /nfs/dbraw/zinc/21/20/57/330212057.db2.gz VJGAUKDLDVXSDY-GOSISDBHSA-N 1 3 272.436 3.568 20 0 CHADHO CC(C)CN1CCC([NH2+]Cc2ccc(C(F)F)cc2)CC1 ZINC000527223432 330238049 /nfs/dbraw/zinc/23/80/49/330238049.db2.gz HWJYTGNOTNHEHT-UHFFFAOYSA-N 1 3 296.405 3.834 20 0 CHADHO C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNCC2(F)CC2)cc1 ZINC000527514187 330255885 /nfs/dbraw/zinc/25/58/85/330255885.db2.gz XREVKEHSWWRPOX-OAHLLOKOSA-N 1 3 290.426 3.653 20 0 CHADHO C[C@@H]1CCCC[N@H+]1Cc1ccc(CNCC2(F)CC2)cc1 ZINC000527514187 330255888 /nfs/dbraw/zinc/25/58/88/330255888.db2.gz XREVKEHSWWRPOX-OAHLLOKOSA-N 1 3 290.426 3.653 20 0 CHADHO CCC(F)(F)C(C)(C)CNC1CC([NH+]2CCCCC2)C1 ZINC000527701491 330274568 /nfs/dbraw/zinc/27/45/68/330274568.db2.gz PGOVZFIOXKZMNV-UHFFFAOYSA-N 1 3 288.426 3.664 20 0 CHADHO Cc1cccc([C@H](N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)C(C)C)c1 ZINC000527810209 330284761 /nfs/dbraw/zinc/28/47/61/330284761.db2.gz OVVYPMPEYRFMJV-IPMKNSEASA-N 1 3 286.463 3.909 20 0 CHADHO Cc1cccc([C@H](N[C@H]2CC[N@H+]3CCC[C@@H]3C2)C(C)C)c1 ZINC000527810209 330284762 /nfs/dbraw/zinc/28/47/62/330284762.db2.gz OVVYPMPEYRFMJV-IPMKNSEASA-N 1 3 286.463 3.909 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](c2cccc(C)c2)C(C)C)C1 ZINC000527855132 330288786 /nfs/dbraw/zinc/28/87/86/330288786.db2.gz ZRGNHGFMXAGESC-FUHWJXTLSA-N 1 3 274.452 3.624 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@@H](c2cccc(C)c2)C(C)C)C1 ZINC000527855132 330288787 /nfs/dbraw/zinc/28/87/87/330288787.db2.gz ZRGNHGFMXAGESC-FUHWJXTLSA-N 1 3 274.452 3.624 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@@H](c2cccc(C)c2)C(C)C)C1 ZINC000527855132 330288788 /nfs/dbraw/zinc/28/87/88/330288788.db2.gz ZRGNHGFMXAGESC-FUHWJXTLSA-N 1 3 274.452 3.624 20 0 CHADHO Cc1cccc([C@@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)C(C)C)c1 ZINC000527905881 330290121 /nfs/dbraw/zinc/29/01/21/330290121.db2.gz RRODKXPNHVBCQM-IPQPSQTFSA-N 1 3 286.463 3.907 20 0 CHADHO Cc1cccc([C@@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)C(C)C)c1 ZINC000527905881 330290122 /nfs/dbraw/zinc/29/01/22/330290122.db2.gz RRODKXPNHVBCQM-IPQPSQTFSA-N 1 3 286.463 3.907 20 0 CHADHO CCCc1ccc([C@H](C)NC[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000044534925 330329968 /nfs/dbraw/zinc/32/99/68/330329968.db2.gz WJJLQZXHTXKZKN-RDJZCZTQSA-N 1 3 274.452 3.632 20 0 CHADHO CCCc1ccc([C@H](C)NC[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000044534925 330329969 /nfs/dbraw/zinc/32/99/69/330329969.db2.gz WJJLQZXHTXKZKN-RDJZCZTQSA-N 1 3 274.452 3.632 20 0 CHADHO Cc1cc(N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c2ccccc2n1 ZINC000107830457 330351320 /nfs/dbraw/zinc/35/13/20/330351320.db2.gz CLCRTMQQNNFDOG-HUUCEWRRSA-N 1 3 281.403 3.582 20 0 CHADHO Cc1cc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc2n1 ZINC000107830457 330351321 /nfs/dbraw/zinc/35/13/21/330351321.db2.gz CLCRTMQQNNFDOG-HUUCEWRRSA-N 1 3 281.403 3.582 20 0 CHADHO CCC[C@@H]([NH2+]C[C@H]1CCN(CCC)C1)C(C)(C)C ZINC000453086556 331087874 /nfs/dbraw/zinc/08/78/74/331087874.db2.gz HZQQKHDVCGYYHF-HUUCEWRRSA-N 1 3 254.462 3.523 20 0 CHADHO Cc1cc([C@H](C)[NH2+]C[C@H]2CCCN(C(C)C)C2)cs1 ZINC000453113601 331090402 /nfs/dbraw/zinc/09/04/02/331090402.db2.gz UMMPEFPTURWKJS-LSDHHAIUSA-N 1 3 280.481 3.828 20 0 CHADHO C1CC1[C@@H]([NH2+]C1CCN(C2CCCC2)CC1)C1CCCC1 ZINC000453124435 331091697 /nfs/dbraw/zinc/09/16/97/331091697.db2.gz GMXMYURVOQOBHV-IBGZPJMESA-N 1 3 290.495 3.952 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1N[C@@H]1CCCc2c(F)cccc21 ZINC000453239856 331105773 /nfs/dbraw/zinc/10/57/73/331105773.db2.gz TURVDSCWUMWGNG-HLNSBACISA-N 1 3 290.426 3.521 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1N[C@@H]1CCCc2c(F)cccc21 ZINC000453239856 331105774 /nfs/dbraw/zinc/10/57/74/331105774.db2.gz TURVDSCWUMWGNG-HLNSBACISA-N 1 3 290.426 3.521 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)o1 ZINC000195131994 331138023 /nfs/dbraw/zinc/13/80/23/331138023.db2.gz KWKDOKUJPGJKNM-WMZOPIPTSA-N 1 3 298.430 3.761 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)CCc2cccc(Cl)c2)[C@H](C)C1 ZINC000459376896 331279003 /nfs/dbraw/zinc/27/90/03/331279003.db2.gz ODGGLXJCQYDQLE-RHSMWYFYSA-N 1 3 294.870 3.545 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)CCc2cccc(Cl)c2)[C@H](C)C1 ZINC000459376896 331279004 /nfs/dbraw/zinc/27/90/04/331279004.db2.gz ODGGLXJCQYDQLE-RHSMWYFYSA-N 1 3 294.870 3.545 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)CCc2cccc(Cl)c2)[C@@H](C)C1 ZINC000459376897 331279016 /nfs/dbraw/zinc/27/90/16/331279016.db2.gz ODGGLXJCQYDQLE-WMLDXEAASA-N 1 3 294.870 3.545 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)CCc2cccc(Cl)c2)[C@@H](C)C1 ZINC000459376897 331279017 /nfs/dbraw/zinc/27/90/17/331279017.db2.gz ODGGLXJCQYDQLE-WMLDXEAASA-N 1 3 294.870 3.545 20 0 CHADHO C[C@@H]1CCC[C@H](N2CCC([NH2+][C@H]3CCC[C@@H]4C[C@@H]43)CC2)C1 ZINC000459751680 331298497 /nfs/dbraw/zinc/29/84/97/331298497.db2.gz ICYZVQJTEIYOLB-PTGCCPEKSA-N 1 3 290.495 3.808 20 0 CHADHO CC(C)(C[NH2+][C@H]1CCCC[C@H]1C1CC1)CN1CCCC1 ZINC000477942189 331695063 /nfs/dbraw/zinc/69/50/63/331695063.db2.gz SVQMLENUUZZCTI-IRXDYDNUSA-N 1 3 278.484 3.667 20 0 CHADHO CC1CCN(CCC[NH2+][C@@H]2CS[C@@H](C(C)(C)C)C2)CC1 ZINC000488445280 332009510 /nfs/dbraw/zinc/00/95/10/332009510.db2.gz DXIRGLCLBZTTOX-JKSUJKDBSA-N 1 3 298.540 3.618 20 0 CHADHO CC1CC[NH+](CCCN[C@@H]2CS[C@@H](C(C)(C)C)C2)CC1 ZINC000488445280 332009512 /nfs/dbraw/zinc/00/95/12/332009512.db2.gz DXIRGLCLBZTTOX-JKSUJKDBSA-N 1 3 298.540 3.618 20 0 CHADHO Cc1cc(C)c(CN[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@H]32)c(C)c1 ZINC000513652799 333029270 /nfs/dbraw/zinc/02/92/70/333029270.db2.gz BWAYTYXBLXGLJF-UHOSZYNNSA-N 1 3 286.463 3.574 20 0 CHADHO Cc1cc(C)c(CN[C@@H]2CC[N@H+](C)[C@H]3CCC[C@H]32)c(C)c1 ZINC000513652799 333029271 /nfs/dbraw/zinc/02/92/71/333029271.db2.gz BWAYTYXBLXGLJF-UHOSZYNNSA-N 1 3 286.463 3.574 20 0 CHADHO CC(C)CC[C@@H]([NH2+]C[C@@H](C)CN1CCCC1)C1CC1 ZINC000311551834 333069752 /nfs/dbraw/zinc/06/97/52/333069752.db2.gz LDFAEZFEHMVWDZ-NVXWUHKLSA-N 1 3 266.473 3.523 20 0 CHADHO CC[C@@H](NC1CC[NH+](C(C)C)CC1)c1cccc(C)c1 ZINC000336841321 335120621 /nfs/dbraw/zinc/12/06/21/335120621.db2.gz RMAJJOGJYUUGBQ-GOSISDBHSA-N 1 3 274.452 3.909 20 0 CHADHO C[C@@H](Cc1ccccc1F)NC1CC[NH+](C(C)(C)C)CC1 ZINC000222582444 333197310 /nfs/dbraw/zinc/19/73/10/333197310.db2.gz WASILUPRBYXQHS-AWEZNQCLSA-N 1 3 292.442 3.609 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@@H]([NH3+])C1)c1cccc2ccccc21 ZINC000222905455 333202003 /nfs/dbraw/zinc/20/20/03/333202003.db2.gz HDGPVFWLXOQYNH-NUEKZKHPSA-N 1 3 268.404 3.760 20 0 CHADHO Cc1c[nH+]ccc1N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000192669724 333237557 /nfs/dbraw/zinc/23/75/57/333237557.db2.gz OEPSFQIUQNBUPY-SJLPKXTDSA-N 1 3 295.430 3.855 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+][C@H](c1ccccc1)C1CC1 ZINC000226900112 333271841 /nfs/dbraw/zinc/27/18/41/333271841.db2.gz CTKHJMYHDKYEGI-VQIMIIECSA-N 1 3 286.463 3.992 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CC[C@@H]([C@@H](C)[NH3+])C2)cc1 ZINC000227200892 333278024 /nfs/dbraw/zinc/27/80/24/333278024.db2.gz WOYVXELLERAPPO-JKIFEVAISA-N 1 3 260.425 3.540 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H]2C[C@H](C)Sc3sccc32)C1 ZINC000250341667 333304525 /nfs/dbraw/zinc/30/45/25/333304525.db2.gz PXDPUMRDVMYDQR-SCRDCRAPSA-N 1 3 296.505 3.605 20 0 CHADHO CC(C)[C@H](C[NH2+]CCCN1CCCC1)c1ccccc1 ZINC000232745445 333341990 /nfs/dbraw/zinc/34/19/90/333341990.db2.gz JCEYUWYTDSOMMH-SFHVURJKSA-N 1 3 274.452 3.502 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CC[C@H]1CCCC1(C)C ZINC000530210033 333528109 /nfs/dbraw/zinc/52/81/09/333528109.db2.gz KIQYKIGUNISUKF-UKRRQHHQSA-N 1 3 289.467 3.716 20 0 CHADHO CC[C@H](C)[C@@H](C)[NH2+][C@H](C)c1cccc(OCCN(C)C)c1 ZINC000540183118 333718562 /nfs/dbraw/zinc/71/85/62/333718562.db2.gz QJWNFAHDDVHZLG-ARFHVFGLSA-N 1 3 292.467 3.712 20 0 CHADHO CC1=CCC[C@@H](C)[C@H]1C[NH2+]C1CCN(C2CCCC2)CC1 ZINC000152615899 333786317 /nfs/dbraw/zinc/78/63/17/333786317.db2.gz AHSYFXUSEXFXJU-APWZRJJASA-N 1 3 290.495 3.975 20 0 CHADHO C[NH+](C)CC1CCN(CCCc2ccccc2Cl)CC1 ZINC000542212008 333816203 /nfs/dbraw/zinc/81/62/03/333816203.db2.gz BISNGPSWRBZFBM-UHFFFAOYSA-N 1 3 294.870 3.546 20 0 CHADHO Cc1ccsc1[C@@H](C)NCC1(C[NH+](C)C)CCCC1 ZINC000546932501 334055769 /nfs/dbraw/zinc/05/57/69/334055769.db2.gz LCSDVFKPDDZQQT-CQSZACIVSA-N 1 3 280.481 3.829 20 0 CHADHO C[C@@H](Cc1ccccc1F)[NH2+]CCCN1CCCC[C@H]1C ZINC000133924363 334071460 /nfs/dbraw/zinc/07/14/60/334071460.db2.gz DQIXJTBJPUEBKE-JKSUJKDBSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@@H](Cc1ccccc1F)NCCC[N@@H+]1CCCC[C@H]1C ZINC000133924363 334071462 /nfs/dbraw/zinc/07/14/62/334071462.db2.gz DQIXJTBJPUEBKE-JKSUJKDBSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@@H](Cc1ccccc1F)NCCC[N@H+]1CCCC[C@H]1C ZINC000133924363 334071463 /nfs/dbraw/zinc/07/14/63/334071463.db2.gz DQIXJTBJPUEBKE-JKSUJKDBSA-N 1 3 292.442 3.611 20 0 CHADHO CC(C)CC[C@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)C1CC1 ZINC000549228204 334188266 /nfs/dbraw/zinc/18/82/66/334188266.db2.gz HMCGCEVBCWIFBT-WMZOPIPTSA-N 1 3 280.500 3.911 20 0 CHADHO CC[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000245755895 334217489 /nfs/dbraw/zinc/21/74/89/334217489.db2.gz UVGBAIVMBMYQEI-ZACQAIPSSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCN3CCC[C@H]3C2)CC1 ZINC000245917975 334223984 /nfs/dbraw/zinc/22/39/84/334223984.db2.gz FWDOFLLNBOUGFO-XDNAFOTISA-N 1 3 278.484 3.808 20 0 CHADHO Cc1ccsc1[C@H](C)[NH2+][C@H]1CCC[C@@H](N(C)C)C1 ZINC000247010999 334273838 /nfs/dbraw/zinc/27/38/38/334273838.db2.gz KHZXLEMSEZVFJL-MELADBBJSA-N 1 3 266.454 3.580 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H]2CCCc3cc(F)ccc32)C1 ZINC000246089489 334231221 /nfs/dbraw/zinc/23/12/21/334231221.db2.gz WLRAOQLBVXACLD-KDOFPFPSSA-N 1 3 290.426 3.525 20 0 CHADHO C[C@@H]1CC[C@H](NC[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc21 ZINC000247080332 334275276 /nfs/dbraw/zinc/27/52/76/334275276.db2.gz OVBOQTJATACSEQ-CLCXKQKWSA-N 1 3 284.447 3.699 20 0 CHADHO C[C@@H]1CC[C@H](NC[C@H]2CC[N@H+](C3CC3)C2)c2ccccc21 ZINC000247080332 334275278 /nfs/dbraw/zinc/27/52/78/334275278.db2.gz OVBOQTJATACSEQ-CLCXKQKWSA-N 1 3 284.447 3.699 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CC=CCC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000248401255 334300378 /nfs/dbraw/zinc/30/03/78/334300378.db2.gz LQSQOFQRMGBBTK-GVDBMIGSSA-N 1 3 276.468 3.585 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](C)c2cc3ccccc3s2)C1 ZINC000249079885 334326856 /nfs/dbraw/zinc/32/68/56/334326856.db2.gz CMYIBNHVVWYMGC-KGLIPLIRSA-N 1 3 288.460 3.894 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](C)c2cc3ccccc3s2)C1 ZINC000249079885 334326858 /nfs/dbraw/zinc/32/68/58/334326858.db2.gz CMYIBNHVVWYMGC-KGLIPLIRSA-N 1 3 288.460 3.894 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](C)c2cc3ccccc3s2)C1 ZINC000249079885 334326860 /nfs/dbraw/zinc/32/68/60/334326860.db2.gz CMYIBNHVVWYMGC-KGLIPLIRSA-N 1 3 288.460 3.894 20 0 CHADHO C[C@@H](NCCCC[N@@H+]1CCC[C@H](C)C1)c1cccc(O)c1 ZINC000249410636 334333613 /nfs/dbraw/zinc/33/36/13/334333613.db2.gz CSYMXYBUBUBLAC-JKSUJKDBSA-N 1 3 290.451 3.555 20 0 CHADHO C[C@@H](NCCCC[N@H+]1CCC[C@H](C)C1)c1cccc(O)c1 ZINC000249410636 334333615 /nfs/dbraw/zinc/33/36/15/334333615.db2.gz CSYMXYBUBUBLAC-JKSUJKDBSA-N 1 3 290.451 3.555 20 0 CHADHO CC[C@H](N[C@H](C)C[C@H]1CCC[NH2+]1)c1ccc(C)cc1 ZINC000251076687 334356034 /nfs/dbraw/zinc/35/60/34/334356034.db2.gz KTTKQOQWKCOAIZ-OIISXLGYSA-N 1 3 260.425 3.566 20 0 CHADHO CCCC1CCC([NH2+][C@@H]2CCN3CCC[C@H]3C2)CC1 ZINC000252674999 334385242 /nfs/dbraw/zinc/38/52/42/334385242.db2.gz WPAMHESSDJMMPT-BACDZXNISA-N 1 3 264.457 3.562 20 0 CHADHO CC1(C)CC([NH2+][C@@H]2CCN3CCC[C@H]3C2)CC(C)(C)C1 ZINC000252738719 334388266 /nfs/dbraw/zinc/38/82/66/334388266.db2.gz FUTFEHPYXNAEFT-ZBFHGGJFSA-N 1 3 278.484 3.808 20 0 CHADHO CC[C@@H]1CCC[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000157562479 334775864 /nfs/dbraw/zinc/77/58/64/334775864.db2.gz WBADZZXPZNHWHQ-CRAIPNDOSA-N 1 3 278.484 3.952 20 0 CHADHO CCC[C@H](Cc1ccccc1)[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000576692829 335235344 /nfs/dbraw/zinc/23/53/44/335235344.db2.gz LEINXIPPGXMXGV-RBUKOAKNSA-N 1 3 288.479 3.718 20 0 CHADHO C[C@@H](N)C[C@H](C)[NH2+]CC1(c2ccccc2)CCCCC1 ZINC000577499439 335359962 /nfs/dbraw/zinc/35/99/62/335359962.db2.gz JSNZGHXRYNNNGR-CVEARBPZSA-N 1 3 274.452 3.604 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCC1(c2ccccc2)CCCCC1 ZINC000577499439 335359963 /nfs/dbraw/zinc/35/99/63/335359963.db2.gz JSNZGHXRYNNNGR-CVEARBPZSA-N 1 3 274.452 3.604 20 0 CHADHO C[C@H]1CC[C@@H](NCc2ccc(C[NH3+])cc2)c2sccc21 ZINC000578324042 335609287 /nfs/dbraw/zinc/60/92/87/335609287.db2.gz GZJPXSCDPRISFB-BLLLJJGKSA-N 1 3 286.444 3.935 20 0 CHADHO C[N@H+](CCCNC/C=C\c1ccccc1)Cc1ccccc1 ZINC000381812211 336073524 /nfs/dbraw/zinc/07/35/24/336073524.db2.gz HZICWBHWPTUFMW-ZSOIEALJSA-N 1 3 294.442 3.812 20 0 CHADHO C[N@@H+](CCCNC/C=C\c1ccccc1)Cc1ccccc1 ZINC000381812211 336073526 /nfs/dbraw/zinc/07/35/26/336073526.db2.gz HZICWBHWPTUFMW-ZSOIEALJSA-N 1 3 294.442 3.812 20 0 CHADHO CSCC1CCC(N[C@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC000385349143 336144689 /nfs/dbraw/zinc/14/46/89/336144689.db2.gz ZYXHZAQVXMZDOF-SMELUJQZSA-N 1 3 290.476 3.643 20 0 CHADHO Cc1cc(Cl)cc(C)c1CN1CCC([C@H](C)[NH3+])CC1 ZINC000347219612 533769616 /nfs/dbraw/zinc/76/96/16/533769616.db2.gz SVASLSMXPGJVHD-ZDUSSCGKSA-N 1 3 280.843 3.516 20 0 CHADHO C[C@@H](N(C)CCC[N@H+](C)[C@H](C)C1(C)CC1)C1(C)CC1 ZINC000343741076 534285218 /nfs/dbraw/zinc/28/52/18/534285218.db2.gz MXMSZVDWKDCCTP-HUUCEWRRSA-N 1 3 266.473 3.617 20 0 CHADHO C[C@@H](N(C)CCC[N@@H+](C)[C@H](C)C1(C)CC1)C1(C)CC1 ZINC000343741076 534285222 /nfs/dbraw/zinc/28/52/22/534285222.db2.gz MXMSZVDWKDCCTP-HUUCEWRRSA-N 1 3 266.473 3.617 20 0 CHADHO CC(C)c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)cc1 ZINC000045039226 519836287 /nfs/dbraw/zinc/83/62/87/519836287.db2.gz AUFLQUJGVKIOKG-AYHJJNSGSA-N 1 3 272.436 3.525 20 0 CHADHO CC[C@H](NC1CC[NH+](CC)CC1)c1cccc(Cl)c1 ZINC000037878825 522563534 /nfs/dbraw/zinc/56/35/34/522563534.db2.gz DOBCNRKFLMUXFK-INIZCTEOSA-N 1 3 280.843 3.865 20 0 CHADHO C[C@H]1CCC[N@H+](CCCCNCc2ccc(Cl)o2)C1 ZINC000340426856 524088632 /nfs/dbraw/zinc/08/86/32/524088632.db2.gz JUWFNUHRYLEOOD-ZDUSSCGKSA-N 1 3 284.831 3.535 20 0 CHADHO C[C@H]1CCC[N@@H+](CCCCNCc2ccc(Cl)o2)C1 ZINC000340426856 524088633 /nfs/dbraw/zinc/08/86/33/524088633.db2.gz JUWFNUHRYLEOOD-ZDUSSCGKSA-N 1 3 284.831 3.535 20 0 CHADHO Cc1ccc([C@@H](C)NCCCC[N@@H+]2CCC[C@H](C)C2)o1 ZINC000157952877 525725371 /nfs/dbraw/zinc/72/53/71/525725371.db2.gz FMYMWMCDGNEQMZ-GOEBONIOSA-N 1 3 278.440 3.751 20 0 CHADHO Cc1ccc([C@@H](C)NCCCC[N@H+]2CCC[C@H](C)C2)o1 ZINC000157952877 525725375 /nfs/dbraw/zinc/72/53/75/525725375.db2.gz FMYMWMCDGNEQMZ-GOEBONIOSA-N 1 3 278.440 3.751 20 0 CHADHO Cc1ccsc1[C@@H](C)NC[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000125833980 525869447 /nfs/dbraw/zinc/86/94/47/525869447.db2.gz ROVLIPWLSNWMRH-HUUCEWRRSA-N 1 3 280.481 3.828 20 0 CHADHO Cc1ccsc1[C@@H](C)NC[C@H]1CCC[N@H+](C(C)C)C1 ZINC000125833980 525869453 /nfs/dbraw/zinc/86/94/53/525869453.db2.gz ROVLIPWLSNWMRH-HUUCEWRRSA-N 1 3 280.481 3.828 20 0 CHADHO Cc1ccsc1[C@@H](C)[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000125833980 525869464 /nfs/dbraw/zinc/86/94/64/525869464.db2.gz ROVLIPWLSNWMRH-HUUCEWRRSA-N 1 3 280.481 3.828 20 0 CHADHO C[C@H](c1ccccc1F)N1CCC(CC[NH+](C)C)CC1 ZINC000056521742 526116890 /nfs/dbraw/zinc/11/68/90/526116890.db2.gz QLGALDGSHQIAAY-CQSZACIVSA-N 1 3 278.415 3.550 20 0 CHADHO [NH3+]C[C@@H]1CCC[C@@H]1N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000227122338 527213924 /nfs/dbraw/zinc/21/39/24/527213924.db2.gz YCFNZGPQHDLEKD-LEWSCRJBSA-N 1 3 296.867 3.594 20 0 CHADHO [NH3+]C[C@H]1CCCN(Cc2ccc(-c3ccccc3)cc2)C1 ZINC000044527776 527233480 /nfs/dbraw/zinc/23/34/80/527233480.db2.gz BTEXDGFMQBTXPR-QGZVFWFLSA-N 1 3 280.415 3.524 20 0 CHADHO [NH3+][C@@H]1C[C@H](N[C@@H]2CCC[C@@H](C(F)(F)F)C2)c2ccccc21 ZINC000227538215 527378356 /nfs/dbraw/zinc/37/83/56/527378356.db2.gz YKPGSNRFOIPTTM-FKGLVLAHSA-N 1 3 298.352 3.842 20 0 CHADHO CCC[NH+]1CCC(CN[C@H](CC)c2ccccc2F)CC1 ZINC000352682865 528188220 /nfs/dbraw/zinc/18/82/20/528188220.db2.gz IABWBMQJDMGOJO-GOSISDBHSA-N 1 3 292.442 3.988 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CC[C@]2(C1)CCCNC2 ZINC001222141288 1120492892 /nfs/dbraw/zinc/49/28/92/1120492892.db2.gz JPHFZMQOIUTUMP-ZWKOTPCHSA-N 1 3 278.484 3.835 20 0 CHADHO CCC[N@H+](C[C@H](C)N)[C@H](C)c1cc2ccccc2o1 ZINC000420295786 1121995593 /nfs/dbraw/zinc/99/55/93/1121995593.db2.gz ASNVLDYBTLLFRE-QWHCGFSZSA-N 1 3 260.381 3.553 20 0 CHADHO CCC[N@@H+](C[C@H](C)N)[C@H](C)c1cc2ccccc2o1 ZINC000420295786 1121995598 /nfs/dbraw/zinc/99/55/98/1121995598.db2.gz ASNVLDYBTLLFRE-QWHCGFSZSA-N 1 3 260.381 3.553 20 0 CHADHO CCCC[N@@H+](CC)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167982079 1122900462 /nfs/dbraw/zinc/90/04/62/1122900462.db2.gz VPDSREDEUCRXKG-SJPCQFCGSA-N 1 3 264.457 3.514 20 0 CHADHO CC(C)(C[NH2+]CC1CCC(C)(C)CC1)CN1CCCC1 ZINC001202241684 1123193339 /nfs/dbraw/zinc/19/33/39/1123193339.db2.gz HCNUQTPNLBBNHG-UHFFFAOYSA-N 1 3 280.500 3.914 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000665281109 1123312207 /nfs/dbraw/zinc/31/22/07/1123312207.db2.gz UZBAPMUIFKGTDL-BXUZGUMPSA-N 1 3 288.357 3.729 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H]2C[C@H](C)CC[C@@H]2C)C1 ZINC000449129624 1124653423 /nfs/dbraw/zinc/65/34/23/1124653423.db2.gz CYNZLLUTJXIFBG-YYIAUSFCSA-N 1 3 266.473 3.521 20 0 CHADHO CCCCCC[C@@H](CCC)N1CCC[C@]12CC[NH2+]C2 ZINC001246648506 1131776292 /nfs/dbraw/zinc/77/62/92/1131776292.db2.gz LZCWUATYXZGUAO-IAGOWNOFSA-N 1 3 266.473 3.953 20 0 CHADHO CCCC[C@@H]1C[C@@H]([N@H+]2CCCCC[C@H]2C)CCN1 ZINC001246771595 1131781635 /nfs/dbraw/zinc/78/16/35/1131781635.db2.gz ZEVKZHOQGFSANA-OAGGEKHMSA-N 1 3 252.446 3.562 20 0 CHADHO CCCC[C@H]1C[C@H]([N@@H+]2CCC3(CCCC3)C2)CCN1 ZINC001246810143 1131783006 /nfs/dbraw/zinc/78/30/06/1131783006.db2.gz YEDPAAAWXPKVQM-JKSUJKDBSA-N 1 3 264.457 3.563 20 0 CHADHO CCCC[C@H]1C[C@H]([N@H+]2CCC3(CCCC3)C2)CCN1 ZINC001246810143 1131783013 /nfs/dbraw/zinc/78/30/13/1131783013.db2.gz YEDPAAAWXPKVQM-JKSUJKDBSA-N 1 3 264.457 3.563 20 0 CHADHO CC1CCN(CCC[NH2+][C@H]2C[C@H](C)C[C@H](C)C2)CC1 ZINC000251808193 1125511360 /nfs/dbraw/zinc/51/13/60/1125511360.db2.gz YOIHECASAMFGLL-FVQHAEBGSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H]2CCc3c2cccc3F)C1 ZINC000482358666 1126752708 /nfs/dbraw/zinc/75/27/08/1126752708.db2.gz OTNVLTJEAUEFAU-KSSFIOAISA-N 1 3 290.426 3.523 20 0 CHADHO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H](N(C)C)C2)c(C)c1 ZINC000484466048 1126817089 /nfs/dbraw/zinc/81/70/89/1126817089.db2.gz JEECOSZLJKNUSG-BBWFWOEESA-N 1 3 274.452 3.827 20 0 CHADHO Cc1ccc(C)c([C@H](C)[NH2+][C@@H]2CCC[C@H](N(C)C)C2)c1 ZINC000484482997 1126820793 /nfs/dbraw/zinc/82/07/93/1126820793.db2.gz GAKUNFOUFMYQEL-BBWFWOEESA-N 1 3 274.452 3.827 20 0 CHADHO C[C@@H](NC1CC(C[NH3+])C1)c1cc(F)c(Cl)cc1Cl ZINC000904367972 1126849396 /nfs/dbraw/zinc/84/93/96/1126849396.db2.gz LMOLQQZJPORTIM-AFPNSQJFSA-N 1 3 291.197 3.520 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@@H+]1CCCC12CCNCC2 ZINC001235139773 1130714520 /nfs/dbraw/zinc/71/45/20/1130714520.db2.gz DATWRHJDQZZHTM-MRXNPFEDSA-N 1 3 264.457 3.587 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@H+]1CCCC12CCNCC2 ZINC001235139773 1130714524 /nfs/dbraw/zinc/71/45/24/1130714524.db2.gz DATWRHJDQZZHTM-MRXNPFEDSA-N 1 3 264.457 3.587 20 0 CHADHO CCC[C@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)c1cccnc1 ZINC000185357798 1126899417 /nfs/dbraw/zinc/89/94/17/1126899417.db2.gz RJWFYQCKLYMQBD-WMZOPIPTSA-N 1 3 289.467 3.633 20 0 CHADHO CC[C@H]([NH2+]C1CCN(CC2CC2)CC1)c1cccc(F)c1 ZINC000187798212 1126914655 /nfs/dbraw/zinc/91/46/55/1126914655.db2.gz GCCBMHWNGMTCSU-SFHVURJKSA-N 1 3 290.426 3.741 20 0 CHADHO c1ccc2c(c1)CCCC[C@H]2NC1CC[NH+](CC2CC2)CC1 ZINC001168370683 1126964048 /nfs/dbraw/zinc/96/40/48/1126964048.db2.gz DYAXLNIOOUFAHW-HXUWFJFHSA-N 1 3 298.474 3.918 20 0 CHADHO C[C@@H]([NH2+]CC1(CN(C)C)CCCC1)c1ccnc(Cl)c1 ZINC000760896756 1127324467 /nfs/dbraw/zinc/32/44/67/1127324467.db2.gz JDXBOLCMIFYPCD-CYBMUJFWSA-N 1 3 295.858 3.508 20 0 CHADHO CC1(C)Cc2occc2[C@@H]([NH2+]CCCN2CCCCC2)C1 ZINC000359619589 1127470149 /nfs/dbraw/zinc/47/01/49/1127470149.db2.gz KIQDPIHVRCNAFN-INIZCTEOSA-N 1 3 290.451 3.759 20 0 CHADHO CC[C@H]1CCC[C@H](CN2CCC([NH2+]C3CCC3)CC2)C1 ZINC001308970072 1127623888 /nfs/dbraw/zinc/62/38/88/1127623888.db2.gz BJAKSGODTNEOIN-HOTGVXAUSA-N 1 3 278.484 3.809 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@@H]1C[C@H](OC(C)(C)C)C1(C)C ZINC001308987531 1127638672 /nfs/dbraw/zinc/63/86/72/1127638672.db2.gz PTAYJXGFHCVSAC-XHSDSOJGSA-N 1 3 298.515 3.679 20 0 CHADHO C[C@H](c1ccccc1Cl)N(C)CCCCCC[NH3+] ZINC000062018698 1127730896 /nfs/dbraw/zinc/73/08/96/1127730896.db2.gz UOQJOIGJURPPAD-CYBMUJFWSA-N 1 3 268.832 3.852 20 0 CHADHO CN(C)C1CC[NH+](CCC23CC4CC(CC(C4)C2)C3)CC1 ZINC000607192914 1127796581 /nfs/dbraw/zinc/79/65/81/1127796581.db2.gz SDMFZRLKARTGPN-UHFFFAOYSA-N 1 3 290.495 3.619 20 0 CHADHO C[NH+](C)C1CCN(CCC23CC4CC(CC(C4)C2)C3)CC1 ZINC000607192914 1127796585 /nfs/dbraw/zinc/79/65/85/1127796585.db2.gz SDMFZRLKARTGPN-UHFFFAOYSA-N 1 3 290.495 3.619 20 0 CHADHO C[C@H](CN[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cccc(Cl)c1 ZINC000372459310 1127799690 /nfs/dbraw/zinc/79/96/90/1127799690.db2.gz BVYJZJYUNYHRCO-KBRIMQKVSA-N 1 3 292.854 3.660 20 0 CHADHO C[C@H](CN[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc(Cl)c1 ZINC000372459310 1127799694 /nfs/dbraw/zinc/79/96/94/1127799694.db2.gz BVYJZJYUNYHRCO-KBRIMQKVSA-N 1 3 292.854 3.660 20 0 CHADHO CCN(C)C[C@@H]1CC[N@H+](C[C@@H](C)CCc2ccccc2)C1 ZINC000539405104 1127921509 /nfs/dbraw/zinc/92/15/09/1127921509.db2.gz NAVCOJMDDVHJBN-HKUYNNGSSA-N 1 3 288.479 3.529 20 0 CHADHO CCN(C)C[C@@H]1CC[N@@H+](C[C@@H](C)CCc2ccccc2)C1 ZINC000539405104 1127921510 /nfs/dbraw/zinc/92/15/10/1127921510.db2.gz NAVCOJMDDVHJBN-HKUYNNGSSA-N 1 3 288.479 3.529 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2CC[C@H](C)C[C@H]2CC)C1 ZINC000539857714 1127948225 /nfs/dbraw/zinc/94/82/25/1127948225.db2.gz BNBSQLUDRLYHKG-YLFCFFPRSA-N 1 3 266.473 3.523 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]CC[C@H](C)N2CCCCC2)s1 ZINC000544373895 1127970721 /nfs/dbraw/zinc/97/07/21/1127970721.db2.gz XIGVRJXOVPAHCV-DZGCQCFKSA-N 1 3 280.481 3.972 20 0 CHADHO CC[C@H](CN(C)CCC[NH+]1CCCC1)c1ccccc1 ZINC000467516037 1127972456 /nfs/dbraw/zinc/97/24/56/1127972456.db2.gz DRVOHECIYHPADB-QGZVFWFLSA-N 1 3 274.452 3.598 20 0 CHADHO CC[C@H](C[N@H+](C)CCCN1CCCC1)c1ccccc1 ZINC000467516037 1127972457 /nfs/dbraw/zinc/97/24/57/1127972457.db2.gz DRVOHECIYHPADB-QGZVFWFLSA-N 1 3 274.452 3.598 20 0 CHADHO CC[C@H](C[N@@H+](C)CCCN1CCCC1)c1ccccc1 ZINC000467516037 1127972459 /nfs/dbraw/zinc/97/24/59/1127972459.db2.gz DRVOHECIYHPADB-QGZVFWFLSA-N 1 3 274.452 3.598 20 0 CHADHO CC(C)([NH3+])CN1CCC[C@@H]1c1cccc2ccccc21 ZINC000469874224 1128056438 /nfs/dbraw/zinc/05/64/38/1128056438.db2.gz WMOIMKYTRYTFPY-QGZVFWFLSA-N 1 3 268.404 3.714 20 0 CHADHO CN(Cc1ccccc1-c1ccccc1)C[C@H]1CCC[NH2+]C1 ZINC000469874481 1128057156 /nfs/dbraw/zinc/05/71/56/1128057156.db2.gz IEQCFFDEBSSECW-KRWDZBQOSA-N 1 3 294.442 3.785 20 0 CHADHO CCC[C@@H](CC)[NH2+]CCCN1C[C@H](C)C[C@H](C)C1 ZINC001257245095 1128078571 /nfs/dbraw/zinc/07/85/71/1128078571.db2.gz JTWHGVDOEAAOHG-OWCLPIDISA-N 1 3 254.462 3.523 20 0 CHADHO C[C@H](NCCC(C)(C)[NH3+])c1cccc(-c2ccncc2)c1 ZINC000925739692 1128139410 /nfs/dbraw/zinc/13/94/10/1128139410.db2.gz DBVFRPVIKVACFL-AWEZNQCLSA-N 1 3 283.419 3.527 20 0 CHADHO CC1(C)C[C@@H]([NH3+])C[C@H](NCc2ccc(C(F)F)cc2)C1 ZINC000925638872 1128135869 /nfs/dbraw/zinc/13/58/69/1128135869.db2.gz HONRMEKDIRYLFP-KBPBESRZSA-N 1 3 282.378 3.620 20 0 CHADHO CC(C)CCN1CCC([NH2+]CC2(C)CC(F)(F)C2)CC1 ZINC000926840725 1128197729 /nfs/dbraw/zinc/19/77/29/1128197729.db2.gz FTIYSBJIXXDZDF-UHFFFAOYSA-N 1 3 288.426 3.522 20 0 CHADHO Cc1ccc(C)c([C@H](C)NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1 ZINC000037103447 1128413820 /nfs/dbraw/zinc/41/38/20/1128413820.db2.gz KHZXEXSNKYPFTO-XYTVBORESA-N 1 3 272.436 3.579 20 0 CHADHO Cc1ccc(C)c([C@H](C)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1 ZINC000037103447 1128413824 /nfs/dbraw/zinc/41/38/24/1128413824.db2.gz KHZXEXSNKYPFTO-XYTVBORESA-N 1 3 272.436 3.579 20 0 CHADHO CCC(C)(C)[C@@H](C)[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000562778798 1128419934 /nfs/dbraw/zinc/41/99/34/1128419934.db2.gz JZABQJAHJFGSEO-CABCVRRESA-N 1 3 254.462 3.521 20 0 CHADHO C[C@@H](CC(C)(C)c1ccccc1)[NH2+]CCCN1CCCC1 ZINC000037229469 1128424874 /nfs/dbraw/zinc/42/48/74/1128424874.db2.gz ZYJGDSNQEADIPI-KRWDZBQOSA-N 1 3 288.479 3.818 20 0 CHADHO CCCC[C@H]([NH2+]C[C@@H]1CCN(CC)C1)c1ccccc1 ZINC000037644529 1128433805 /nfs/dbraw/zinc/43/38/05/1128433805.db2.gz SPHLVLSVLSPXGS-WMZOPIPTSA-N 1 3 274.452 3.849 20 0 CHADHO CCCC[C@H](NC[C@@H]1CC[N@H+](CC)C1)c1ccccc1 ZINC000037644529 1128433808 /nfs/dbraw/zinc/43/38/08/1128433808.db2.gz SPHLVLSVLSPXGS-WMZOPIPTSA-N 1 3 274.452 3.849 20 0 CHADHO CCCC[C@H](NC[C@@H]1CC[N@@H+](CC)C1)c1ccccc1 ZINC000037644529 1128433809 /nfs/dbraw/zinc/43/38/09/1128433809.db2.gz SPHLVLSVLSPXGS-WMZOPIPTSA-N 1 3 274.452 3.849 20 0 CHADHO CCCC[C@H]([NH2+]C[C@H]1CCN(CC)C1)c1ccccc1 ZINC000037644531 1128433887 /nfs/dbraw/zinc/43/38/87/1128433887.db2.gz SPHLVLSVLSPXGS-AEFFLSMTSA-N 1 3 274.452 3.849 20 0 CHADHO CCCC[C@H](NC[C@H]1CC[N@H+](CC)C1)c1ccccc1 ZINC000037644531 1128433889 /nfs/dbraw/zinc/43/38/89/1128433889.db2.gz SPHLVLSVLSPXGS-AEFFLSMTSA-N 1 3 274.452 3.849 20 0 CHADHO CCCC[C@H](NC[C@H]1CC[N@@H+](CC)C1)c1ccccc1 ZINC000037644531 1128433890 /nfs/dbraw/zinc/43/38/90/1128433890.db2.gz SPHLVLSVLSPXGS-AEFFLSMTSA-N 1 3 274.452 3.849 20 0 CHADHO CCc1ccc([C@H](C)NC[C@H](C)C[NH+]2CCCC2)cc1 ZINC000062078080 1128436255 /nfs/dbraw/zinc/43/62/55/1128436255.db2.gz SSWLAKJNUFMZHL-HOTGVXAUSA-N 1 3 274.452 3.632 20 0 CHADHO CC[NH+]1CCC(N(C)Cc2cc(C)c(C)cc2C)CC1 ZINC000125192993 1128448041 /nfs/dbraw/zinc/44/80/41/1128448041.db2.gz GVQSDRMSECLRJU-UHFFFAOYSA-N 1 3 274.452 3.528 20 0 CHADHO CC[C@@H](NC[C@H]1CCC[N@@H+](C(C)C)C1)c1cccs1 ZINC000125826494 1128454466 /nfs/dbraw/zinc/45/44/66/1128454466.db2.gz RSOBBWQJEPCQFG-HUUCEWRRSA-N 1 3 280.481 3.909 20 0 CHADHO CC[C@@H](NC[C@H]1CCC[N@H+](C(C)C)C1)c1cccs1 ZINC000125826494 1128454469 /nfs/dbraw/zinc/45/44/69/1128454469.db2.gz RSOBBWQJEPCQFG-HUUCEWRRSA-N 1 3 280.481 3.909 20 0 CHADHO CC[C@@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)c1cccs1 ZINC000125826494 1128454471 /nfs/dbraw/zinc/45/44/71/1128454471.db2.gz RSOBBWQJEPCQFG-HUUCEWRRSA-N 1 3 280.481 3.909 20 0 CHADHO Cc1ccc([C@H](C)[NH2+][C@@H](CCN(C)C)C(C)(C)C)o1 ZINC000126001851 1128460454 /nfs/dbraw/zinc/46/04/54/1128460454.db2.gz PLHZDDFPSDELBV-ZFWWWQNUSA-N 1 3 266.429 3.605 20 0 CHADHO CC(C)Cc1cccc([C@@H](C)NC[C@@H]2CCC[N@H+](C)C2)c1 ZINC000563904459 1128484292 /nfs/dbraw/zinc/48/42/92/1128484292.db2.gz YYZPUCULLKLRSZ-AEFFLSMTSA-N 1 3 288.479 3.878 20 0 CHADHO CC(C)Cc1cccc([C@@H](C)NC[C@@H]2CCC[N@@H+](C)C2)c1 ZINC000563904459 1128484294 /nfs/dbraw/zinc/48/42/94/1128484294.db2.gz YYZPUCULLKLRSZ-AEFFLSMTSA-N 1 3 288.479 3.878 20 0 CHADHO Cc1ccccc1C(C)(C)NCCC[NH+]1CCCCC1 ZINC000565259654 1128523233 /nfs/dbraw/zinc/52/32/33/1128523233.db2.gz PRIWZTWQSOSRSB-UHFFFAOYSA-N 1 3 274.452 3.696 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H]([N@@H+]2CC[C@]3(C2)CCCNC3)C1 ZINC000566230377 1128540486 /nfs/dbraw/zinc/54/04/86/1128540486.db2.gz KMJCHXRFFNPZHQ-SLFFLAALSA-N 1 3 298.474 3.572 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H]([N@H+]2CC[C@]3(C2)CCCNC3)C1 ZINC000566230377 1128540487 /nfs/dbraw/zinc/54/04/87/1128540487.db2.gz KMJCHXRFFNPZHQ-SLFFLAALSA-N 1 3 298.474 3.572 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2cc3c(s2)CCCC3)C1 ZINC000130265190 1128575722 /nfs/dbraw/zinc/57/57/22/1128575722.db2.gz FRSUAOLFQDGFSB-KBPBESRZSA-N 1 3 292.492 3.619 20 0 CHADHO C[C@@H]1C[C@H](N)CC[N@@H+]1CC1CCC(c2ccccc2)CC1 ZINC000569706871 1128607702 /nfs/dbraw/zinc/60/77/02/1128607702.db2.gz UPIRSMBHBUIMQS-JVGQSUMCSA-N 1 3 286.463 3.772 20 0 CHADHO C[C@@H]1C[C@H](N)CC[N@H+]1CC1CCC(c2ccccc2)CC1 ZINC000569706871 1128607704 /nfs/dbraw/zinc/60/77/04/1128607704.db2.gz UPIRSMBHBUIMQS-JVGQSUMCSA-N 1 3 286.463 3.772 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCc1ccc(-c2ccccc2)s1 ZINC000570842166 1128633793 /nfs/dbraw/zinc/63/37/93/1128633793.db2.gz CAZCKUKUDTWXLV-STQMWFEESA-N 1 3 274.433 3.631 20 0 CHADHO CC[N@H+](C)C[C@@H]1CCN(Cc2cccc3ccccc32)C1 ZINC000072857771 1128634376 /nfs/dbraw/zinc/63/43/76/1128634376.db2.gz IIKFLZYYPXAWQF-INIZCTEOSA-N 1 3 282.431 3.613 20 0 CHADHO CC[N@@H+](C)C[C@@H]1CCN(Cc2cccc3ccccc32)C1 ZINC000072857771 1128634377 /nfs/dbraw/zinc/63/43/77/1128634377.db2.gz IIKFLZYYPXAWQF-INIZCTEOSA-N 1 3 282.431 3.613 20 0 CHADHO CCN(C)C[C@@H]1CC[N@H+](Cc2cccc3ccccc32)C1 ZINC000072857771 1128634380 /nfs/dbraw/zinc/63/43/80/1128634380.db2.gz IIKFLZYYPXAWQF-INIZCTEOSA-N 1 3 282.431 3.613 20 0 CHADHO CCN(C)C[C@@H]1CC[N@@H+](Cc2cccc3ccccc32)C1 ZINC000072857771 1128634382 /nfs/dbraw/zinc/63/43/82/1128634382.db2.gz IIKFLZYYPXAWQF-INIZCTEOSA-N 1 3 282.431 3.613 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]C[C@H](C)CC2CCCCC2)C1 ZINC000578401319 1128717089 /nfs/dbraw/zinc/71/70/89/1128717089.db2.gz GHWWMBRYIOEQRG-SJLPKXTDSA-N 1 3 280.500 3.913 20 0 CHADHO CCC[C@H]([NH2+][C@@H]1CCNC2(CCC2)C1)C1CCCCC1 ZINC000643547035 1117793964 /nfs/dbraw/zinc/79/39/64/1117793964.db2.gz YSOXAPRIKNNAHJ-SJORKVTESA-N 1 3 278.484 4.000 20 0 CHADHO COC(C)(C)CCC[C@@H](C)CC[NH+]1CCC(N(C)C)CC1 ZINC001208201734 1117868811 /nfs/dbraw/zinc/86/88/11/1117868811.db2.gz IHEKNKQNWWNTAD-MRXNPFEDSA-N 1 3 298.515 3.634 20 0 CHADHO COC(C)(C)CCC[C@@H](C)CCN1CCC([NH+](C)C)CC1 ZINC001208201734 1117868819 /nfs/dbraw/zinc/86/88/19/1117868819.db2.gz IHEKNKQNWWNTAD-MRXNPFEDSA-N 1 3 298.515 3.634 20 0 CHADHO CC(C)[NH+]1CCC(N[C@H](c2ccccc2)C2CCC2)CC1 ZINC000119292728 1117883207 /nfs/dbraw/zinc/88/32/07/1117883207.db2.gz UBLUBAYGHMZWGD-LJQANCHMSA-N 1 3 286.463 3.990 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N[C@H](C)c1nc(C)cs1 ZINC000623849136 1117943353 /nfs/dbraw/zinc/94/33/53/1117943353.db2.gz WUMBXTKHOIIKID-TZMCWYRMSA-N 1 3 283.485 3.613 20 0 CHADHO Cc1cc([C@@H](C)[NH2+]C[C@H]2CCCCN(C)C2)c(C)s1 ZINC000624119890 1117983372 /nfs/dbraw/zinc/98/33/72/1117983372.db2.gz LTVISMFLZXQBLL-UKRRQHHQSA-N 1 3 280.481 3.747 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccc(Cl)s1 ZINC000624120110 1117984466 /nfs/dbraw/zinc/98/44/66/1117984466.db2.gz RLJGOPDYQWZVFV-NWDGAFQWSA-N 1 3 286.872 3.784 20 0 CHADHO CC[C@@H](Cc1ccc(C)cc1)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000624121138 1117985060 /nfs/dbraw/zinc/98/50/60/1117985060.db2.gz OVKADCYYKVNVOZ-MOPGFXCFSA-N 1 3 288.479 3.638 20 0 CHADHO CN1CCCC[C@@H](C[NH2+][C@@H]2CCCc3cc(F)ccc32)C1 ZINC000624122276 1117986105 /nfs/dbraw/zinc/98/61/05/1117986105.db2.gz NPWGTFIRPJKSTN-KBXCAEBGSA-N 1 3 290.426 3.525 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)C1CCC(F)(F)CC1 ZINC000624123194 1117987414 /nfs/dbraw/zinc/98/74/14/1117987414.db2.gz HRHIOWWRYNSXON-ZIAGYGMSSA-N 1 3 288.426 3.522 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H]2CCC(C)(C)c3ccccc32)C1 ZINC000037643690 1118033305 /nfs/dbraw/zinc/03/33/05/1118033305.db2.gz PYXDVDZFWHUHCQ-MAUKXSAKSA-N 1 3 286.463 3.731 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@@H]2CCC(C)(C)c3ccccc32)C1 ZINC000037643690 1118033310 /nfs/dbraw/zinc/03/33/10/1118033310.db2.gz PYXDVDZFWHUHCQ-MAUKXSAKSA-N 1 3 286.463 3.731 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@@H]2CCC(C)(C)c3ccccc32)C1 ZINC000037643690 1118033315 /nfs/dbraw/zinc/03/33/15/1118033315.db2.gz PYXDVDZFWHUHCQ-MAUKXSAKSA-N 1 3 286.463 3.731 20 0 CHADHO CC[C@H](NC[C@H]1CC[N@H+](CC)C1)c1cccc(Cl)c1 ZINC000037644053 1118033547 /nfs/dbraw/zinc/03/35/47/1118033547.db2.gz VMJWEHDTNXYKHC-CJNGLKHVSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@H](NC[C@H]1CC[N@@H+](CC)C1)c1cccc(Cl)c1 ZINC000037644053 1118033553 /nfs/dbraw/zinc/03/35/53/1118033553.db2.gz VMJWEHDTNXYKHC-CJNGLKHVSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@H]([NH2+]C[C@H]1CCN(CC)C1)c1cccc(Cl)c1 ZINC000037644053 1118033559 /nfs/dbraw/zinc/03/35/59/1118033559.db2.gz VMJWEHDTNXYKHC-CJNGLKHVSA-N 1 3 280.843 3.723 20 0 CHADHO Cc1cccc2c1CC[C@H]2[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000125752577 1118056752 /nfs/dbraw/zinc/05/67/52/1118056752.db2.gz LDRFNBYFVLPZLI-QFBILLFUSA-N 1 3 286.463 3.692 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)c1ccccc1C(F)(F)F)CN(C)C ZINC000380422878 1118069553 /nfs/dbraw/zinc/06/95/53/1118069553.db2.gz IFPIMVFWRPDVII-NEPJUHHUSA-N 1 3 288.357 3.554 20 0 CHADHO C[C@@H](Cc1ccco1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000764773445 1118112238 /nfs/dbraw/zinc/11/22/38/1118112238.db2.gz IOUZUIFIEBCVDR-HNNXBMFYSA-N 1 3 290.451 3.597 20 0 CHADHO C[C@H](c1cccc(Cl)c1)N(C)C[C@H]1CCC[N@H+](C)C1 ZINC000247178048 1118130166 /nfs/dbraw/zinc/13/01/66/1118130166.db2.gz YWIWBGHRGGAXPR-KGLIPLIRSA-N 1 3 280.843 3.675 20 0 CHADHO C[C@H](c1cccc(Cl)c1)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000247178048 1118130168 /nfs/dbraw/zinc/13/01/68/1118130168.db2.gz YWIWBGHRGGAXPR-KGLIPLIRSA-N 1 3 280.843 3.675 20 0 CHADHO C[C@@H]1C[C@@H](C)CN(CCC[NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)C1 ZINC001648814907 1118222923 /nfs/dbraw/zinc/22/29/23/1118222923.db2.gz UIWRRQCFBNPTRT-HSFUPAIVSA-N 1 3 278.484 3.523 20 0 CHADHO C[C@H](Cc1ccc(Cl)cc1)[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000715491958 1118281222 /nfs/dbraw/zinc/28/12/22/1118281222.db2.gz RPVDTCRILOPBHK-KBRIMQKVSA-N 1 3 294.870 3.733 20 0 CHADHO C[C@H]1C[C@H](N[C@@H]2CCCc3ccc(Cl)cc32)CC[N@@H+]1C ZINC000624329089 1118284448 /nfs/dbraw/zinc/28/44/48/1118284448.db2.gz LIZKAWCPXGJDBL-XGWLTEMNSA-N 1 3 292.854 3.790 20 0 CHADHO C[C@H]1C[C@H](N[C@@H]2CCCc3ccc(Cl)cc32)CC[N@H+]1C ZINC000624329089 1118284452 /nfs/dbraw/zinc/28/44/52/1118284452.db2.gz LIZKAWCPXGJDBL-XGWLTEMNSA-N 1 3 292.854 3.790 20 0 CHADHO CC(C)c1ccc(CN(C)[C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000123577910 1118339262 /nfs/dbraw/zinc/33/92/62/1118339262.db2.gz DBFCCOLSOIVMCP-QAPCUYQASA-N 1 3 274.452 3.725 20 0 CHADHO CC(C)c1ccc(CN(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000123577910 1118339263 /nfs/dbraw/zinc/33/92/63/1118339263.db2.gz DBFCCOLSOIVMCP-QAPCUYQASA-N 1 3 274.452 3.725 20 0 CHADHO C[C@@H](CCN1CCCC2(CC2)C1)[N@@H+]1CCCC2(CC2)C1 ZINC000352279510 1118341652 /nfs/dbraw/zinc/34/16/52/1118341652.db2.gz JXGLJXSFBBRIDB-INIZCTEOSA-N 1 3 276.468 3.517 20 0 CHADHO C[C@@H](CCN1CCCC2(CC2)C1)[N@H+]1CCCC2(CC2)C1 ZINC000352279510 1118341655 /nfs/dbraw/zinc/34/16/55/1118341655.db2.gz JXGLJXSFBBRIDB-INIZCTEOSA-N 1 3 276.468 3.517 20 0 CHADHO C[C@@H](CC[N@@H+]1CCCC2(CC2)C1)N1CCCC2(CC2)C1 ZINC000352279510 1118341660 /nfs/dbraw/zinc/34/16/60/1118341660.db2.gz JXGLJXSFBBRIDB-INIZCTEOSA-N 1 3 276.468 3.517 20 0 CHADHO C[C@@H](CC[N@H+]1CCCC2(CC2)C1)N1CCCC2(CC2)C1 ZINC000352279510 1118341664 /nfs/dbraw/zinc/34/16/64/1118341664.db2.gz JXGLJXSFBBRIDB-INIZCTEOSA-N 1 3 276.468 3.517 20 0 CHADHO C[C@@H]([NH2+]C[C@H](C)CN(C)C)c1ccc(C(F)(F)F)cc1 ZINC000312656397 1118347038 /nfs/dbraw/zinc/34/70/38/1118347038.db2.gz GHAKUCGFFILWKB-NWDGAFQWSA-N 1 3 288.357 3.554 20 0 CHADHO CCCC[C@H](C)[C@@H](C)[NH2+]CCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000580120648 1118382622 /nfs/dbraw/zinc/38/26/22/1118382622.db2.gz GLMNAHSZPIPTDC-WNRNVDISSA-N 1 3 298.515 3.680 20 0 CHADHO CC(C)[C@H](N[C@H]1CC[NH2+]C[C@@H]1C)c1ccc(Cl)cc1 ZINC000261582904 1118463116 /nfs/dbraw/zinc/46/31/16/1118463116.db2.gz GVTGEANQRANKJS-RCBQFDQVSA-N 1 3 280.843 3.625 20 0 CHADHO CC[C@@H]([NH2+]CC[C@H]1CCCN1C)c1ccc(Cl)cc1 ZINC000341215230 1118624327 /nfs/dbraw/zinc/62/43/27/1118624327.db2.gz DVAHKMPLQIFBPS-HZPDHXFCSA-N 1 3 280.843 3.865 20 0 CHADHO CC(C)CCN1CCC([NH2+]C[C@H]2CCC(F)(F)C2)CC1 ZINC000926345160 1118959128 /nfs/dbraw/zinc/95/91/28/1118959128.db2.gz NTDJCVSBOGORGD-AWEZNQCLSA-N 1 3 288.426 3.522 20 0 CHADHO C[C@H](CC[NH2+][C@H]1CCC[C@H]1CCCF)N1CCCCC1 ZINC000511030650 1118962551 /nfs/dbraw/zinc/96/25/51/1118962551.db2.gz OOKGYAYKIADORC-IKGGRYGDSA-N 1 3 284.463 3.759 20 0 CHADHO CC[C@H](C[N@@H+]1CCC[C@@H]2CN(C)CC[C@H]21)c1ccccc1 ZINC000582115067 1119015116 /nfs/dbraw/zinc/01/51/16/1119015116.db2.gz WDJAFCHOAFSJAU-BHIYHBOVSA-N 1 3 286.463 3.596 20 0 CHADHO CC[C@H](C[N@H+]1CCC[C@@H]2CN(C)CC[C@H]21)c1ccccc1 ZINC000582115067 1119015120 /nfs/dbraw/zinc/01/51/20/1119015120.db2.gz WDJAFCHOAFSJAU-BHIYHBOVSA-N 1 3 286.463 3.596 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H](C)CCC(C)(C)C)C1 ZINC000582196463 1119032312 /nfs/dbraw/zinc/03/23/12/1119032312.db2.gz AGADJROJZMAWJA-GJZGRUSLSA-N 1 3 254.462 3.523 20 0 CHADHO Cc1ccc2c(c1)[C@@H](NC1CC[NH+](CC3CC3)CC1)CCC2 ZINC000582199645 1119032799 /nfs/dbraw/zinc/03/27/99/1119032799.db2.gz PSQVPQDWHDPOCC-FQEVSTJZSA-N 1 3 298.474 3.836 20 0 CHADHO C[C@@H](C[NH2+][C@@H]1CCC[C@@H](C)CC1)CN1CCCCC1 ZINC000226500515 1119052052 /nfs/dbraw/zinc/05/20/52/1119052052.db2.gz BLMYSAUQCHXVLC-IXDOHACOSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@@H](c1cccs1)N(C)Cc1cc2c(s1)CC[NH2+]C2 ZINC000688008424 1128827767 /nfs/dbraw/zinc/82/77/67/1128827767.db2.gz WMHQPDZXKAPFIF-NSHDSACASA-N 1 3 292.473 3.648 20 0 CHADHO CC(C)Cc1ccc(CNC2CC[NH+](C3CC3)CC2)cc1 ZINC000088296610 1119314504 /nfs/dbraw/zinc/31/45/04/1119314504.db2.gz VTQKYVMZJOBXPY-UHFFFAOYSA-N 1 3 286.463 3.602 20 0 CHADHO CSCCCCCCN[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000235156383 1119359825 /nfs/dbraw/zinc/35/98/25/1119359825.db2.gz IISHRQJNAYJLON-HZPDHXFCSA-N 1 3 278.465 3.644 20 0 CHADHO CCC[C@H](NCc1ccc(C[NH3+])cc1F)c1ccccc1 ZINC000650752145 1119408248 /nfs/dbraw/zinc/40/82/48/1119408248.db2.gz KGRRNOKELCMWMA-SFHVURJKSA-N 1 3 286.394 3.915 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@H]2CCCC(C)(C)CC2)C1 ZINC000250520188 1119441630 /nfs/dbraw/zinc/44/16/30/1119441630.db2.gz SJCZIOIATQCFKV-CVEARBPZSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@@H]1CC[C@@H](CN)C[N@@H+]1C1CCC2(CCCC2)CC1 ZINC000129785437 1119556797 /nfs/dbraw/zinc/55/67/97/1119556797.db2.gz PNEMRCWUWVFGAP-CABCVRRESA-N 1 3 264.457 3.549 20 0 CHADHO C[C@@H]1CC[C@@H](CN)C[N@H+]1C1CCC2(CCCC2)CC1 ZINC000129785437 1119556800 /nfs/dbraw/zinc/55/68/00/1119556800.db2.gz PNEMRCWUWVFGAP-CABCVRRESA-N 1 3 264.457 3.549 20 0 CHADHO C[C@@H](NCCCCC[NH+]1CCCCC1)c1ccc(F)cn1 ZINC000092748992 1119566616 /nfs/dbraw/zinc/56/66/16/1119566616.db2.gz XXEYWLYNIZHBKV-OAHLLOKOSA-N 1 3 293.430 3.528 20 0 CHADHO C[C@@H]1CCCC[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000132186214 1119653970 /nfs/dbraw/zinc/65/39/70/1119653970.db2.gz ZILPDEQVNLOXDW-CRAIPNDOSA-N 1 3 278.484 3.952 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)[C@H]1CC2CCC1CC2)CN1CCCC1 ZINC000381595018 1128882670 /nfs/dbraw/zinc/88/26/70/1128882670.db2.gz FGKGJMKDJRKTJN-YFVGIKETSA-N 1 3 278.484 3.523 20 0 CHADHO CC[C@H]1CCC[C@H](C[N@@H+]2CCCC23CCN(C)CC3)C1 ZINC000472595310 1119996999 /nfs/dbraw/zinc/99/69/99/1119996999.db2.gz FACKCQUKJVYBSA-IRXDYDNUSA-N 1 3 278.484 3.763 20 0 CHADHO CC[C@H]1CCC[C@H](C[N@H+]2CCCC23CCN(C)CC3)C1 ZINC000472595310 1119997001 /nfs/dbraw/zinc/99/70/01/1119997001.db2.gz FACKCQUKJVYBSA-IRXDYDNUSA-N 1 3 278.484 3.763 20 0 CHADHO Clc1ccsc1CN1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647543550 1120004723 /nfs/dbraw/zinc/00/47/23/1120004723.db2.gz PESWSYCDRSRJNB-OLZOCXBDSA-N 1 3 298.883 3.613 20 0 CHADHO Clc1sccc1CN1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647543902 1120005025 /nfs/dbraw/zinc/00/50/25/1120005025.db2.gz UGKAQBPUNSYOGZ-OLZOCXBDSA-N 1 3 298.883 3.613 20 0 CHADHO CN1CCCC[C@@H](C[NH2+][C@@H]2CCc3ccc(Cl)cc32)C1 ZINC000624121803 1120093906 /nfs/dbraw/zinc/09/39/06/1120093906.db2.gz DFAXQORYFKILPH-SUMWQHHRSA-N 1 3 292.854 3.649 20 0 CHADHO CC(C)[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccccc1 ZINC000624121934 1120101528 /nfs/dbraw/zinc/10/15/28/1120101528.db2.gz GGPKTOFOVJGJQC-SJLPKXTDSA-N 1 3 274.452 3.705 20 0 CHADHO C[C@H](NCc1cccc(F)c1)c1cccc(C[NH+](C)C)c1 ZINC000924610764 1120165235 /nfs/dbraw/zinc/16/52/35/1120165235.db2.gz RCGBNZRNBRBCJP-AWEZNQCLSA-N 1 3 286.394 3.738 20 0 CHADHO CCC(C)(C)C1CCC([N@@H+]2CC[C@H](C)[C@@H](CN)C2)CC1 ZINC000229063440 1120251609 /nfs/dbraw/zinc/25/16/09/1120251609.db2.gz XRHWAAJAOAXLQC-JUVOFCAFSA-N 1 3 280.500 3.898 20 0 CHADHO CCC(C)(C)C1CCC([N@H+]2CC[C@H](C)[C@@H](CN)C2)CC1 ZINC000229063440 1120251611 /nfs/dbraw/zinc/25/16/11/1120251611.db2.gz XRHWAAJAOAXLQC-JUVOFCAFSA-N 1 3 280.500 3.898 20 0 CHADHO CC(C)(C)CCCN1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000499556135 1120321736 /nfs/dbraw/zinc/32/17/36/1120321736.db2.gz YQCJHSPDWMHBBZ-WBVHZDCISA-N 1 3 278.484 3.761 20 0 CHADHO CC(C)(C)CCCN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000499556135 1120321741 /nfs/dbraw/zinc/32/17/41/1120321741.db2.gz YQCJHSPDWMHBBZ-WBVHZDCISA-N 1 3 278.484 3.761 20 0 CHADHO C[C@H](c1cccc2ccccc21)[N@@H+]1CC[C@@](C)(CN)C1 ZINC000312432925 1120362305 /nfs/dbraw/zinc/36/23/05/1120362305.db2.gz AUOBJOZLZONBRQ-KDOFPFPSSA-N 1 3 268.404 3.572 20 0 CHADHO C[C@H](c1cccc2ccccc21)[N@H+]1CC[C@@](C)(CN)C1 ZINC000312432925 1120362308 /nfs/dbraw/zinc/36/23/08/1120362308.db2.gz AUOBJOZLZONBRQ-KDOFPFPSSA-N 1 3 268.404 3.572 20 0 CHADHO C(CC1CCC1)CN1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000660114207 1120381252 /nfs/dbraw/zinc/38/12/52/1120381252.db2.gz GIXUJUSZQUVWQX-AEFFLSMTSA-N 1 3 276.468 3.515 20 0 CHADHO C(CC1CCC1)CN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000660114207 1120381257 /nfs/dbraw/zinc/38/12/57/1120381257.db2.gz GIXUJUSZQUVWQX-AEFFLSMTSA-N 1 3 276.468 3.515 20 0 CHADHO CN(C[C@@H]1CCC[N@H+](C)C1)[C@H]1CCc2ccc(Cl)cc21 ZINC000543203723 1120461999 /nfs/dbraw/zinc/46/19/99/1120461999.db2.gz VPTKCGWFAKFUNC-DYVFJYSZSA-N 1 3 292.854 3.601 20 0 CHADHO CN(C[C@@H]1CCC[N@@H+](C)C1)[C@H]1CCc2ccc(Cl)cc21 ZINC000543203723 1120462000 /nfs/dbraw/zinc/46/20/00/1120462000.db2.gz VPTKCGWFAKFUNC-DYVFJYSZSA-N 1 3 292.854 3.601 20 0 CHADHO C[C@H]([NH2+]CC(C)(C)CN(C)C)c1ccc(Cl)cc1 ZINC000019905757 1120490639 /nfs/dbraw/zinc/49/06/39/1120490639.db2.gz NEMFVDXMCFCSOC-LBPRGKRZSA-N 1 3 268.832 3.578 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CC[C@]2(C1)CCCNC2 ZINC001222141288 1120492887 /nfs/dbraw/zinc/49/28/87/1120492887.db2.gz JPHFZMQOIUTUMP-ZWKOTPCHSA-N 1 3 278.484 3.835 20 0 CHADHO CC(C)N(C)CCC[NH2+]C1CCC2(CCCC2)CC1 ZINC000226330687 1120536204 /nfs/dbraw/zinc/53/62/04/1120536204.db2.gz FNINXJZVLIDOJZ-UHFFFAOYSA-N 1 3 266.473 3.809 20 0 CHADHO C[NH+](C)CCCN[C@H](Cc1ccccc1)c1ccccc1 ZINC000019959403 1120552778 /nfs/dbraw/zinc/55/27/78/1120552778.db2.gz KCPLBRXLWLXBGZ-LJQANCHMSA-N 1 3 282.431 3.512 20 0 CHADHO CSCC1CCC(N[C@@H](c2ccccc2)[C@H](C)[NH3+])CC1 ZINC000925677814 1120565448 /nfs/dbraw/zinc/56/54/48/1120565448.db2.gz ABDBIJJNDPHOKG-VFNXUKNFSA-N 1 3 292.492 3.586 20 0 CHADHO CC[C@@H](c1ccccc1)N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000150758572 1120777166 /nfs/dbraw/zinc/77/71/66/1120777166.db2.gz UWNPGIRYSBHHRT-AEFFLSMTSA-N 1 3 272.436 3.555 20 0 CHADHO CC[C@@H](c1ccccc1)[N@@H+]1CC[C@H](CN2CCCC2)C1 ZINC000150758572 1120777167 /nfs/dbraw/zinc/77/71/67/1120777167.db2.gz UWNPGIRYSBHHRT-AEFFLSMTSA-N 1 3 272.436 3.555 20 0 CHADHO CC[C@@H](c1ccccc1)[N@H+]1CC[C@H](CN2CCCC2)C1 ZINC000150758572 1120777170 /nfs/dbraw/zinc/77/71/70/1120777170.db2.gz UWNPGIRYSBHHRT-AEFFLSMTSA-N 1 3 272.436 3.555 20 0 CHADHO CC[C@H]1C[N@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)CC[C@@H]1N ZINC000662273710 1120916640 /nfs/dbraw/zinc/91/66/40/1120916640.db2.gz YUSKYOVZMAFJFS-JFRXWTBNSA-N 1 3 286.463 3.630 20 0 CHADHO CC[C@H]1C[N@@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)CC[C@@H]1N ZINC000662273710 1120916643 /nfs/dbraw/zinc/91/66/43/1120916643.db2.gz YUSKYOVZMAFJFS-JFRXWTBNSA-N 1 3 286.463 3.630 20 0 CHADHO Cc1cccc(CC[C@@H](C)[NH2+]CCCN(C)C(C)C)c1 ZINC000221918107 1120938051 /nfs/dbraw/zinc/93/80/51/1120938051.db2.gz KELFIALNRTYVBW-QGZVFWFLSA-N 1 3 276.468 3.636 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2NCCC[NH+]1CCCCC1 ZINC000021020462 1120952386 /nfs/dbraw/zinc/95/23/86/1120952386.db2.gz LVHJQAWLVYLLJI-SFHVURJKSA-N 1 3 272.436 3.530 20 0 CHADHO CC1(C)[C@H]2CCC[C@H]2[C@@H]1[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663467269 1120980571 /nfs/dbraw/zinc/98/05/71/1120980571.db2.gz ZTPINUKUFKJUEA-MHORFTMASA-N 1 3 290.495 3.523 20 0 CHADHO c1ccc([C@H](NC[C@@H]2CCC[N@H+](CC3CC3)C2)C2CC2)cc1 ZINC000663467680 1120983658 /nfs/dbraw/zinc/98/36/58/1120983658.db2.gz HCMWFCXJRLIGPC-PXNSSMCTSA-N 1 3 298.474 3.849 20 0 CHADHO c1ccc([C@H](NC[C@@H]2CCC[N@@H+](CC3CC3)C2)C2CC2)cc1 ZINC000663467680 1120983661 /nfs/dbraw/zinc/98/36/61/1120983661.db2.gz HCMWFCXJRLIGPC-PXNSSMCTSA-N 1 3 298.474 3.849 20 0 CHADHO c1ccc([C@H]([NH2+]C[C@@H]2CCCN(CC3CC3)C2)C2CC2)cc1 ZINC000663467680 1120983664 /nfs/dbraw/zinc/98/36/64/1120983664.db2.gz HCMWFCXJRLIGPC-PXNSSMCTSA-N 1 3 298.474 3.849 20 0 CHADHO CC(C)[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663469598 1120984966 /nfs/dbraw/zinc/98/49/66/1120984966.db2.gz QWWQMVKWKKGAAA-SQNIBIBYSA-N 1 3 278.484 3.523 20 0 CHADHO CCCCN1CCC([NH2+]C/C=C\c2ccc(F)cc2)CC1 ZINC001648933079 1121005045 /nfs/dbraw/zinc/00/50/45/1121005045.db2.gz GTDBWDAFDBHKKI-PLNGDYQASA-N 1 3 290.426 3.693 20 0 CHADHO Cc1ccc(C[C@H]([NH2+][C@@H]2CCNC3(CCC3)C2)C2CC2)cc1 ZINC000643548175 1121011732 /nfs/dbraw/zinc/01/17/32/1121011732.db2.gz NMPDKVKYYYRQGF-MOPGFXCFSA-N 1 3 298.474 3.580 20 0 CHADHO CC(C)[C@@H](N[C@H]1CC[NH2+]C2(CCC2)C1)c1ccccc1 ZINC000643547895 1121012417 /nfs/dbraw/zinc/01/24/17/1121012417.db2.gz KMQPJIMZYXRAIR-DLBZAZTESA-N 1 3 272.436 3.648 20 0 CHADHO CC(C)[C@@H]([NH2+][C@H]1CCNC2(CCC2)C1)c1ccccc1 ZINC000643547895 1121012421 /nfs/dbraw/zinc/01/24/21/1121012421.db2.gz KMQPJIMZYXRAIR-DLBZAZTESA-N 1 3 272.436 3.648 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCc3ccc(F)cc32)C1 ZINC000344077335 1121074079 /nfs/dbraw/zinc/07/40/79/1121074079.db2.gz QHLNETKUEWSJDH-JFIYKMOQSA-N 1 3 290.426 3.666 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCCc3ccccc32)C1 ZINC000344199041 1121116881 /nfs/dbraw/zinc/11/68/81/1121116881.db2.gz LMGXSYIHJNAOJE-NUJGCVRESA-N 1 3 272.436 3.526 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCc3ccccc32)C1 ZINC000344199040 1121117617 /nfs/dbraw/zinc/11/76/17/1121117617.db2.gz LMGXSYIHJNAOJE-LZLYRXPVSA-N 1 3 272.436 3.526 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]CCCN2CCC(C)CC2)cc1 ZINC000021009085 1121142330 /nfs/dbraw/zinc/14/23/30/1121142330.db2.gz MQUAOLBTPGCENN-KRWDZBQOSA-N 1 3 274.452 3.768 20 0 CHADHO C[C@@H](c1ccc(Cl)cc1)N1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000063197555 1121201637 /nfs/dbraw/zinc/20/16/37/1121201637.db2.gz GHMVCXRETYAAIH-GUYCJALGSA-N 1 3 292.854 3.865 20 0 CHADHO C[C@H](c1cccc(Cl)c1)N1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000063197594 1121202449 /nfs/dbraw/zinc/20/24/49/1121202449.db2.gz QAJDWUCZCGNJHH-DYVFJYSZSA-N 1 3 292.854 3.865 20 0 CHADHO CC(C)c1ccc([C@H](C)[NH2+]CCCN2CCCC2)cc1 ZINC000021803167 1121217544 /nfs/dbraw/zinc/21/75/44/1121217544.db2.gz HIJVDQJDHNSFNQ-INIZCTEOSA-N 1 3 274.452 3.947 20 0 CHADHO c1ccc([C@H](CC2CC2)N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000675751885 1121351492 /nfs/dbraw/zinc/35/14/92/1121351492.db2.gz BMFLZDOJCFBGEN-OTWHNJEPSA-N 1 3 284.447 3.744 20 0 CHADHO c1ccc([C@H](CC2CC2)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000675751885 1121351501 /nfs/dbraw/zinc/35/15/01/1121351501.db2.gz BMFLZDOJCFBGEN-OTWHNJEPSA-N 1 3 284.447 3.744 20 0 CHADHO CC/C=C/CC[NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000185437137 1121385804 /nfs/dbraw/zinc/38/58/04/1121385804.db2.gz SJFIIVHANRBROK-FZZYSBJUSA-N 1 3 264.457 3.585 20 0 CHADHO CSCC[C@@H](C)[NH2+]C1CCN(C[C@@H]2CC=CCC2)CC1 ZINC001258213048 1128983774 /nfs/dbraw/zinc/98/37/74/1128983774.db2.gz NCNOLPZMCZODGZ-HZPDHXFCSA-N 1 3 296.524 3.538 20 0 CHADHO c1ccc2c(c1)cccc2CN1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000314763624 1121444918 /nfs/dbraw/zinc/44/49/18/1121444918.db2.gz RDKABHUUHFICEH-UYAOXDASSA-N 1 3 294.442 3.804 20 0 CHADHO c1ccc(CN2C[C@@H]3CCC[C@@H]([NH2+]CC4CCC4)[C@@H]3C2)cc1 ZINC000512614305 1121494623 /nfs/dbraw/zinc/49/46/23/1121494623.db2.gz VMQBSPJGUOGBMA-XUVXKRRUSA-N 1 3 298.474 3.677 20 0 CHADHO C(C1CCCCC1)N1CCC([NH+]2CCCCC2)CC1 ZINC000052003027 1121616213 /nfs/dbraw/zinc/61/62/13/1121616213.db2.gz CJUMXRVVWLSYFD-UHFFFAOYSA-N 1 3 264.457 3.517 20 0 CHADHO C(C1CCCCC1)[NH+]1CCC(N2CCCCC2)CC1 ZINC000052003027 1121616220 /nfs/dbraw/zinc/61/62/20/1121616220.db2.gz CJUMXRVVWLSYFD-UHFFFAOYSA-N 1 3 264.457 3.517 20 0 CHADHO C[C@H](c1cc(F)ccc1F)N(C)CCCCCCC[NH3+] ZINC000842471566 1121624458 /nfs/dbraw/zinc/62/44/58/1121624458.db2.gz JKQGKLOGISACTG-CYBMUJFWSA-N 1 3 284.394 3.867 20 0 CHADHO c1ccc([C@H](N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)C2CCC2)cc1 ZINC000166487608 1121629794 /nfs/dbraw/zinc/62/97/94/1121629794.db2.gz ZQCXVNPGQPAENM-OTWHNJEPSA-N 1 3 284.447 3.744 20 0 CHADHO c1ccc([C@H](N[C@H]2CC[N@H+]3CCC[C@@H]3C2)C2CCC2)cc1 ZINC000166487608 1121629796 /nfs/dbraw/zinc/62/97/96/1121629796.db2.gz ZQCXVNPGQPAENM-OTWHNJEPSA-N 1 3 284.447 3.744 20 0 CHADHO CC[N@@H+]1CCC[C@H]1CNCc1cccc(-c2ccccc2)c1 ZINC000614325612 1121642032 /nfs/dbraw/zinc/64/20/32/1121642032.db2.gz WTEUNAFDCFJUAT-FQEVSTJZSA-N 1 3 294.442 3.928 20 0 CHADHO CC[N@H+]1CCC[C@H]1CNCc1cccc(-c2ccccc2)c1 ZINC000614325612 1121642034 /nfs/dbraw/zinc/64/20/34/1121642034.db2.gz WTEUNAFDCFJUAT-FQEVSTJZSA-N 1 3 294.442 3.928 20 0 CHADHO CCCCN1CCC([NH2+][C@H]2CCc3ccc(F)cc32)CC1 ZINC000164478348 1121700593 /nfs/dbraw/zinc/70/05/93/1121700593.db2.gz WBZSMEXDJBGOJN-SFHVURJKSA-N 1 3 290.426 3.667 20 0 CHADHO CCC1CCC([NH2+]C[C@H]2CCCN(CC(C)C)C2)CC1 ZINC001178249387 1121772090 /nfs/dbraw/zinc/77/20/90/1121772090.db2.gz OKMDGZFWICSCKP-LXPRWKDFSA-N 1 3 280.500 3.913 20 0 CHADHO CCN(Cc1ccc2ccccc2c1)[C@@H]1CCC[NH2+]CC1 ZINC000345181832 1121854564 /nfs/dbraw/zinc/85/45/64/1121854564.db2.gz ROLABSWQMWPHEX-LJQANCHMSA-N 1 3 282.431 3.804 20 0 CHADHO CCCC1CCC(C[NH2+]CC[C@H](C)N(C)C)CC1 ZINC001179266884 1121865955 /nfs/dbraw/zinc/86/59/55/1121865955.db2.gz YLRBFDGDHGPUHL-FHERZECASA-N 1 3 254.462 3.523 20 0 CHADHO CCC[C@@H](C)[N@@H+]1CCC[C@H](CN2CCC(C)CC2)C1 ZINC000501152280 1121959834 /nfs/dbraw/zinc/95/98/34/1121959834.db2.gz WZLKPTFPCUJIAQ-IAGOWNOFSA-N 1 3 266.473 3.619 20 0 CHADHO CCC[C@@H](C)[N@H+]1CCC[C@H](CN2CCC(C)CC2)C1 ZINC000501152280 1121959841 /nfs/dbraw/zinc/95/98/41/1121959841.db2.gz WZLKPTFPCUJIAQ-IAGOWNOFSA-N 1 3 266.473 3.619 20 0 CHADHO Cc1cc(CN[C@H](C[NH3+])C2CCCCC2)c2ccccc2n1 ZINC000420376536 1122004241 /nfs/dbraw/zinc/00/42/41/1122004241.db2.gz VEWXTCPSISICBD-LJQANCHMSA-N 1 3 297.446 3.540 20 0 CHADHO CC(C)CCN1CCC([NH2+][C@@H](C)c2cccs2)CC1 ZINC001180916374 1122022518 /nfs/dbraw/zinc/02/25/18/1122022518.db2.gz CELRJTBMDHWICL-AWEZNQCLSA-N 1 3 280.481 3.909 20 0 CHADHO CCCCCCN1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001237360495 1129027956 /nfs/dbraw/zinc/02/79/56/1129027956.db2.gz ZLCMDVHKEIBBJA-UHFFFAOYSA-N 1 3 272.436 3.661 20 0 CHADHO CCN(CC)CCC[N@H+](CC)CC1(C)CCCC1 ZINC001181505716 1122060273 /nfs/dbraw/zinc/06/02/73/1122060273.db2.gz IRAXTGXZSREWPH-UHFFFAOYSA-N 1 3 254.462 3.621 20 0 CHADHO CCN(CC)CCC[N@@H+](CC)CC1(C)CCCC1 ZINC001181505716 1122060280 /nfs/dbraw/zinc/06/02/80/1122060280.db2.gz IRAXTGXZSREWPH-UHFFFAOYSA-N 1 3 254.462 3.621 20 0 CHADHO CC[C@@H]1C[C@]1([NH2+]CC[C@H]1CCCN1C)c1cccc(C)c1 ZINC000502479156 1122090820 /nfs/dbraw/zinc/09/08/20/1122090820.db2.gz DAPWMWPWFMNSPR-BHIYHBOVSA-N 1 3 286.463 3.694 20 0 CHADHO CC(C)[C@H](NCC[C@H]1CCC[N@@H+]1C)c1ccc(F)cc1 ZINC000502536439 1122101320 /nfs/dbraw/zinc/10/13/20/1122101320.db2.gz WPGNRACAIXHVBO-SJORKVTESA-N 1 3 278.415 3.597 20 0 CHADHO CC(C)[C@H](NCC[C@H]1CCC[N@H+]1C)c1ccc(F)cc1 ZINC000502536439 1122101322 /nfs/dbraw/zinc/10/13/22/1122101322.db2.gz WPGNRACAIXHVBO-SJORKVTESA-N 1 3 278.415 3.597 20 0 CHADHO CC(C)[C@H]([NH2+]CC[C@H]1CCCN1C)c1ccc(F)cc1 ZINC000502536439 1122101326 /nfs/dbraw/zinc/10/13/26/1122101326.db2.gz WPGNRACAIXHVBO-SJORKVTESA-N 1 3 278.415 3.597 20 0 CHADHO CN1CCC[C@H]1CC[N@@H+]1CCCC[C@H]1c1ccc(F)cc1 ZINC000502924502 1122158020 /nfs/dbraw/zinc/15/80/20/1122158020.db2.gz DSNIMYPYHQKBMV-ROUUACIJSA-N 1 3 290.426 3.837 20 0 CHADHO CN1CCC[C@H]1CC[N@H+]1CCCC[C@H]1c1ccc(F)cc1 ZINC000502924502 1122158022 /nfs/dbraw/zinc/15/80/22/1122158022.db2.gz DSNIMYPYHQKBMV-ROUUACIJSA-N 1 3 290.426 3.837 20 0 CHADHO C(CC1CCCCC1)[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC001183096101 1122205303 /nfs/dbraw/zinc/20/53/03/1122205303.db2.gz ZXNNLUYFCYMJJP-SFHVURJKSA-N 1 3 278.484 3.668 20 0 CHADHO CCC1(N2CCC2)CC[NH+](C[C@@H](C)c2ccccc2)CC1 ZINC001183865234 1122244895 /nfs/dbraw/zinc/24/48/95/1122244895.db2.gz RMZOLSQETROZOQ-QGZVFWFLSA-N 1 3 286.463 3.740 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H]2C[C@H](C)c3c2cccc3C)C1 ZINC000504895198 1122309650 /nfs/dbraw/zinc/30/96/50/1122309650.db2.gz RMHDKDKTGVHYFW-LZLYRXPVSA-N 1 3 286.463 3.865 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H]2C[C@H](C)c3c2cccc3C)C1 ZINC000504895198 1122309657 /nfs/dbraw/zinc/30/96/57/1122309657.db2.gz RMHDKDKTGVHYFW-LZLYRXPVSA-N 1 3 286.463 3.865 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000436285498 1122531305 /nfs/dbraw/zinc/53/13/05/1122531305.db2.gz PVZDDYRWWAQGSV-QRQLOZEOSA-N 1 3 286.463 3.644 20 0 CHADHO Cc1cc2c(cc1C)[C@@H]([NH2+]C[C@@H](C)CN(C)C)CCS2 ZINC000425913632 1122659184 /nfs/dbraw/zinc/65/91/84/1122659184.db2.gz AGVXCDXHUWZQNI-WBMJQRKESA-N 1 3 292.492 3.628 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)c1ccc(-c2ccncc2)cc1)CN(C)C ZINC000425941785 1122671478 /nfs/dbraw/zinc/67/14/78/1122671478.db2.gz DYYXLUIVZUCHLA-CVEARBPZSA-N 1 3 297.446 3.597 20 0 CHADHO Cc1c(F)ccc(CN2CC[C@@H](C[NH3+])[C@@H](C)CC2)c1Cl ZINC001205651581 1122742995 /nfs/dbraw/zinc/74/29/95/1122742995.db2.gz HCORUECXSGVPEV-AAEUAGOBSA-N 1 3 298.833 3.594 20 0 CHADHO C[C@@H]1CCC[C@H](C)[N@H+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167981678 1122896654 /nfs/dbraw/zinc/89/66/54/1122896654.db2.gz DXAWVZRGGNWNKI-SSAZZLEASA-N 1 3 276.468 3.655 20 0 CHADHO C[C@@H]1CCC[C@H](C)[N@@H+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167981678 1122896661 /nfs/dbraw/zinc/89/66/61/1122896661.db2.gz DXAWVZRGGNWNKI-SSAZZLEASA-N 1 3 276.468 3.655 20 0 CHADHO CCCC[N@H+](CC)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167982079 1122900459 /nfs/dbraw/zinc/90/04/59/1122900459.db2.gz VPDSREDEUCRXKG-SJPCQFCGSA-N 1 3 264.457 3.514 20 0 CHADHO CC[NH+](CC)CC1CCN(Cc2cc(C)ccc2F)CC1 ZINC000506925531 1122912562 /nfs/dbraw/zinc/91/25/62/1122912562.db2.gz GLDKFVJCVBPOGR-UHFFFAOYSA-N 1 3 292.442 3.688 20 0 CHADHO FC1(F)CCCN(C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC1 ZINC001167984745 1122938824 /nfs/dbraw/zinc/93/88/24/1122938824.db2.gz QMLIDNGLVHQVQM-XYPWUTKMSA-N 1 3 298.421 3.513 20 0 CHADHO FC1(F)CCCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CC1 ZINC001167984745 1122938827 /nfs/dbraw/zinc/93/88/27/1122938827.db2.gz QMLIDNGLVHQVQM-XYPWUTKMSA-N 1 3 298.421 3.513 20 0 CHADHO CC(C)C[C@H](CN1CC[C@H]2[NH2+]CC[C@@H]2C1)c1ccccc1 ZINC000427120192 1122945704 /nfs/dbraw/zinc/94/57/04/1122945704.db2.gz AHMZKWRLXVPXNB-GUDVDZBRSA-N 1 3 286.463 3.500 20 0 CHADHO CCN1CC[C@H](C[NH2+]CC2CCC(C(C)(C)C)CC2)C1 ZINC000129845895 1122993977 /nfs/dbraw/zinc/99/39/77/1122993977.db2.gz YCCDZBPQGOESMA-AQFXKWCLSA-N 1 3 280.500 3.770 20 0 CHADHO C[C@H](C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1)CN(C)C ZINC000380522671 1123123609 /nfs/dbraw/zinc/12/36/09/1123123609.db2.gz CGEJPEMNFFPTLK-VXGBXAGGSA-N 1 3 288.357 3.554 20 0 CHADHO C(C1CC1)N1[C@@H]2CC[C@H]1CC([N@@H+]1CCCC3(CCC3)C1)C2 ZINC001168002401 1123168407 /nfs/dbraw/zinc/16/84/07/1123168407.db2.gz RAIVSFJGPCPQLV-JWTNVVGKSA-N 1 3 288.479 3.658 20 0 CHADHO C(C1CC1)N1[C@@H]2CC[C@H]1CC([N@H+]1CCCC3(CCC3)C1)C2 ZINC001168002401 1123168408 /nfs/dbraw/zinc/16/84/08/1123168408.db2.gz RAIVSFJGPCPQLV-JWTNVVGKSA-N 1 3 288.479 3.658 20 0 CHADHO c1ccc(CN2CC3(C2)CC[NH+](CC2CCCC2)CC3)cc1 ZINC001202177921 1123181930 /nfs/dbraw/zinc/18/19/30/1123181930.db2.gz HMDOYUKCYKXKHM-UHFFFAOYSA-N 1 3 298.474 3.775 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC1C[C@@H](C)C[C@H](C)C1 ZINC000665239643 1123243615 /nfs/dbraw/zinc/24/36/15/1123243615.db2.gz WHYTXIOQZOKASO-IHRRRGAJSA-N 1 3 289.467 3.572 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@@H]1C[C@@H](c2ccccc2)C1(C)C ZINC000665282155 1123313762 /nfs/dbraw/zinc/31/37/62/1123313762.db2.gz RWCZYYCABUGOOS-GVDBMIGSSA-N 1 3 274.452 3.532 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@H](C)c1cccc(C2CC2)c1 ZINC000665281604 1123314111 /nfs/dbraw/zinc/31/41/11/1123314111.db2.gz HNTGBEGALAGNHS-CXAGYDPISA-N 1 3 260.425 3.588 20 0 CHADHO CCC[C@H](N[C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccsc1 ZINC000443086649 1123354783 /nfs/dbraw/zinc/35/47/83/1123354783.db2.gz NJUWAAKHODYPFQ-YUELXQCFSA-N 1 3 266.454 3.662 20 0 CHADHO CCC[C@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccsc1 ZINC000443086649 1123354787 /nfs/dbraw/zinc/35/47/87/1123354787.db2.gz NJUWAAKHODYPFQ-YUELXQCFSA-N 1 3 266.454 3.662 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NC2CCC(C(F)F)CC2)c2ccccc21 ZINC000335615194 1123384783 /nfs/dbraw/zinc/38/47/83/1123384783.db2.gz QPCSOXCBXUXPIC-FWFPMQDGSA-N 1 3 280.362 3.545 20 0 CHADHO CCN1CCC[C@@H](C[NH2+]C[C@@H](C)CCc2ccccc2)C1 ZINC001648959958 1123438979 /nfs/dbraw/zinc/43/89/79/1123438979.db2.gz HDVINWGIQWAXEL-HKUYNNGSSA-N 1 3 288.479 3.577 20 0 CHADHO CC[C@@H](C[NH2+]C[C@H]1CCCN(CC)C1)c1ccccc1 ZINC001648959941 1123439010 /nfs/dbraw/zinc/43/90/10/1123439010.db2.gz GEEIIJLOEOLHQE-SJORKVTESA-N 1 3 274.452 3.502 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](C[C@@H]2C(C)=CCC[C@@H]2C)C1 ZINC000443641378 1123457598 /nfs/dbraw/zinc/45/75/98/1123457598.db2.gz PHFTXZKWDVBWQH-OKZBNKHCSA-N 1 3 278.484 3.643 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](C[C@@H]2C(C)=CCC[C@@H]2C)C1 ZINC000443641378 1123457601 /nfs/dbraw/zinc/45/76/01/1123457601.db2.gz PHFTXZKWDVBWQH-OKZBNKHCSA-N 1 3 278.484 3.643 20 0 CHADHO CC(C)[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCCN(C(C)C)C2)C1 ZINC000474710303 1123575135 /nfs/dbraw/zinc/57/51/35/1123575135.db2.gz IVPZWGCTLWWHRW-RCCFBDPRSA-N 1 3 280.500 3.911 20 0 CHADHO C[NH2+]C[C@H]1CCCN(Cc2c(C)c(C)c(C)c(C)c2C)C1 ZINC001205009280 1123647177 /nfs/dbraw/zinc/64/71/77/1123647177.db2.gz MEYFBRFUHIIYMF-GOSISDBHSA-N 1 3 288.479 3.660 20 0 CHADHO C[C@@H]([NH3+])[C@H]1CCN(Cc2ccc(-c3ccccc3)s2)C1 ZINC000346694000 1123706669 /nfs/dbraw/zinc/70/66/69/1123706669.db2.gz RBFYYLJRRZIMIO-HIFRSBDPSA-N 1 3 286.444 3.584 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]CC[C@@H](C)c2ccccc2)C1 ZINC000043534255 1123820481 /nfs/dbraw/zinc/82/04/81/1123820481.db2.gz RBZPSXXIIVDTMZ-IAGOWNOFSA-N 1 3 274.452 3.500 20 0 CHADHO CC(C)[C@H](C[N@@H+]1CCC[C@H](N(C)C)CC1)c1ccccc1 ZINC000475218630 1123825117 /nfs/dbraw/zinc/82/51/17/1123825117.db2.gz ZERBOVYNGZOLCF-OALUTQOASA-N 1 3 288.479 3.842 20 0 CHADHO CC(C)[C@H](C[N@H+]1CCC[C@H](N(C)C)CC1)c1ccccc1 ZINC000475218630 1123825123 /nfs/dbraw/zinc/82/51/23/1123825123.db2.gz ZERBOVYNGZOLCF-OALUTQOASA-N 1 3 288.479 3.842 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]([NH2+][C@@H]3CCNC34CCC4)C2)cc1 ZINC000863543342 1123876154 /nfs/dbraw/zinc/87/61/54/1123876154.db2.gz YKQIDYRPBLJYHX-FGTMMUONSA-N 1 3 284.447 3.587 20 0 CHADHO Cc1cc(N2CCC[C@H]([NH+]3CCCC3)C2)c2ccccc2n1 ZINC000301236989 1123883783 /nfs/dbraw/zinc/88/37/83/1123883783.db2.gz IDUVXMQNINBFSD-INIZCTEOSA-N 1 3 295.430 3.608 20 0 CHADHO C[C@@H](CNC1CC([NH+]2CCCCC2)C1)c1ccc(F)cc1 ZINC000475566584 1124014491 /nfs/dbraw/zinc/01/44/91/1124014491.db2.gz TZKGNTWEUSODIX-NNGSBXSVSA-N 1 3 290.426 3.536 20 0 CHADHO CC(C)(C)C1=CC[N@H+](CCCN2CCCCC2)CC1 ZINC000444608296 1124045938 /nfs/dbraw/zinc/04/59/38/1124045938.db2.gz KXWSDNNDFHJSBF-UHFFFAOYSA-N 1 3 264.457 3.541 20 0 CHADHO CC(C)(C)C1=CC[N@@H+](CCCN2CCCCC2)CC1 ZINC000444608296 1124045941 /nfs/dbraw/zinc/04/59/41/1124045941.db2.gz KXWSDNNDFHJSBF-UHFFFAOYSA-N 1 3 264.457 3.541 20 0 CHADHO CCOc1ccc([C@H](C)N[C@H]2CC[NH2+]CC(C)(C)C2)cc1 ZINC000635012306 1129170565 /nfs/dbraw/zinc/17/05/65/1129170565.db2.gz SILSOCFGGHJCQF-HOCLYGCPSA-N 1 3 290.451 3.514 20 0 CHADHO CC(C)CCC[NH2+]C[C@H]1CCN(CCc2ccccc2)C1 ZINC000525870244 1124476853 /nfs/dbraw/zinc/47/68/53/1124476853.db2.gz SELUFZBZVXDIEV-LJQANCHMSA-N 1 3 288.479 3.577 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2cccc3ccoc32)C[C@@H]1C ZINC000449033238 1124636694 /nfs/dbraw/zinc/63/66/94/1124636694.db2.gz ZEIGBMOSWUASOA-WMLDXEAASA-N 1 3 286.419 3.737 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2cccc3ccoc32)C[C@@H]1C ZINC000449033238 1124636697 /nfs/dbraw/zinc/63/66/97/1124636697.db2.gz ZEIGBMOSWUASOA-WMLDXEAASA-N 1 3 286.419 3.737 20 0 CHADHO Fc1cc(C2=CCC[NH2+]CC2)ccc1CN1CCCCC1 ZINC001238950379 1131275455 /nfs/dbraw/zinc/27/54/55/1131275455.db2.gz NOECUEGGVZNREN-UHFFFAOYSA-N 1 3 288.410 3.578 20 0 CHADHO CC(C)(C)C1CCC(NC[C@@]2(F)CCCC[NH2+]C2)CC1 ZINC001246110189 1131330022 /nfs/dbraw/zinc/33/00/22/1131330022.db2.gz HNXOIRZANJNHRH-VMBOVVBDSA-N 1 3 284.463 3.663 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@H]2[NH2+][C@H]2CCNC23CCC3)cc1 ZINC000530176265 1125130120 /nfs/dbraw/zinc/13/01/20/1125130120.db2.gz AGEIQBYPQBAEKJ-KSZLIROESA-N 1 3 284.447 3.505 20 0 CHADHO C[C@@H]1CC([NH2+]C2CCC3(CCCC3)CC2)C[C@@H](C)N1 ZINC001246128837 1131344079 /nfs/dbraw/zinc/34/40/79/1131344079.db2.gz NLQACJHKMNMQSK-ZIAGYGMSSA-N 1 3 264.457 3.608 20 0 CHADHO CS[C@@H]1CCC[C@@H]([NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000129379140 1125331418 /nfs/dbraw/zinc/33/14/18/1125331418.db2.gz HDUMDHBBEKLAFB-NVXWUHKLSA-N 1 3 296.524 3.657 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+]C2CCC(C(C)(C)C)CC2)C1 ZINC000040620942 1125388893 /nfs/dbraw/zinc/38/88/93/1125388893.db2.gz GLDYCLXTOZNOIF-GTPINHCMSA-N 1 3 280.500 3.911 20 0 CHADHO CC(C)[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCN(C(C)C)C2)C1 ZINC000230992945 1125395915 /nfs/dbraw/zinc/39/59/15/1125395915.db2.gz VCHCKMSSNSFOMP-GVDBMIGSSA-N 1 3 266.473 3.521 20 0 CHADHO CCSc1ccc([C@H](C)N[C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000165379749 1129216313 /nfs/dbraw/zinc/21/63/13/1129216313.db2.gz XLNWJCIKHAXCTA-YCPHGPKFSA-N 1 3 292.492 3.932 20 0 CHADHO CCSc1ccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000165379749 1129216314 /nfs/dbraw/zinc/21/63/14/1129216314.db2.gz XLNWJCIKHAXCTA-YCPHGPKFSA-N 1 3 292.492 3.932 20 0 CHADHO Cc1cc(C)c([C@H](C)NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1C ZINC000295876243 1129219327 /nfs/dbraw/zinc/21/93/27/1129219327.db2.gz GQFVXIQCNAINIE-OOKSDGMUSA-N 1 3 286.463 3.888 20 0 CHADHO Cc1cc(C)c([C@H](C)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1C ZINC000295876243 1129219329 /nfs/dbraw/zinc/21/93/29/1129219329.db2.gz GQFVXIQCNAINIE-OOKSDGMUSA-N 1 3 286.463 3.888 20 0 CHADHO CC(C)[NH+]1CCC(N(C)Cc2cccc3ncccc23)CC1 ZINC000637888396 1129234850 /nfs/dbraw/zinc/23/48/50/1129234850.db2.gz HWXJOMVHEXBOJO-UHFFFAOYSA-N 1 3 297.446 3.539 20 0 CHADHO Cc1ccc(C[NH2+]C2CCN(C(C)(C)C)CC2)cc1C ZINC000037786463 1129270726 /nfs/dbraw/zinc/27/07/26/1129270726.db2.gz XUIDAHYVFOJMDK-UHFFFAOYSA-N 1 3 274.452 3.656 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2cccs2)C1 ZINC000639169621 1129288144 /nfs/dbraw/zinc/28/81/44/1129288144.db2.gz HNBAIEGKSPSBSN-YHUYYLMFSA-N 1 3 292.492 3.560 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NC[C@H]2CCc3ccccc3C2)c2ccccc21 ZINC000643478082 1129442282 /nfs/dbraw/zinc/44/22/82/1129442282.db2.gz WRDNBPGQVZWDBP-VHKYSDTDSA-N 1 3 292.426 3.526 20 0 CHADHO COc1ccc([C@@H](C)N[C@H]2CCC[NH2+]CC2)c2ccccc12 ZINC000643521474 1129443639 /nfs/dbraw/zinc/44/36/39/1129443639.db2.gz KOKKSWNCVUQOFE-CABCVRRESA-N 1 3 298.430 3.641 20 0 CHADHO C[C@H](N[C@@H]1CC12CC[NH2+]CC2)c1cc(Cl)ccc1Cl ZINC000643534453 1129444464 /nfs/dbraw/zinc/44/44/64/1129444464.db2.gz VLNOXIWBUGCIGL-IINYFYTJSA-N 1 3 299.245 3.786 20 0 CHADHO CC(C)C[C@H]([NH2+]CCCN1CCCCC1)c1ccncc1 ZINC000647281541 1129563258 /nfs/dbraw/zinc/56/32/58/1129563258.db2.gz UWEWNIMZMYAVCK-SFHVURJKSA-N 1 3 289.467 3.634 20 0 CHADHO C[C@@H]1CCC[C@H](N2CCC([NH2+][C@@H]3CC[C@H]4C[C@H]4C3)CC2)C1 ZINC000647355864 1129574565 /nfs/dbraw/zinc/57/45/65/1129574565.db2.gz DHUDVRUHRPRSPI-AKKLJKOSSA-N 1 3 290.495 3.808 20 0 CHADHO C[C@H]1SCC[C@H]1NC1CC[NH+]([C@H]2CCCC[C@H]2C)CC1 ZINC000647358841 1129575237 /nfs/dbraw/zinc/57/52/37/1129575237.db2.gz YNZKZQSBKZMAIF-SRABZTEZSA-N 1 3 296.524 3.513 20 0 CHADHO Clc1ccsc1CN1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647543552 1129581151 /nfs/dbraw/zinc/58/11/51/1129581151.db2.gz PESWSYCDRSRJNB-STQMWFEESA-N 1 3 298.883 3.613 20 0 CHADHO Clc1cscc1CN1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647544373 1129581268 /nfs/dbraw/zinc/58/12/68/1129581268.db2.gz ZOOAHPGAYKYUHG-OLZOCXBDSA-N 1 3 298.883 3.613 20 0 CHADHO c1ccc2cc(CC[N@H+](C3CC3)C3CCNCC3)ccc2c1 ZINC000647815033 1129585508 /nfs/dbraw/zinc/58/55/08/1129585508.db2.gz MGKQWBPILCKFLN-UHFFFAOYSA-N 1 3 294.442 3.599 20 0 CHADHO c1ccc2cc(CC[N@@H+](C3CC3)C3CCNCC3)ccc2c1 ZINC000647815033 1129585512 /nfs/dbraw/zinc/58/55/12/1129585512.db2.gz MGKQWBPILCKFLN-UHFFFAOYSA-N 1 3 294.442 3.599 20 0 CHADHO CSC1CCC(CN[C@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC000720556664 1129657743 /nfs/dbraw/zinc/65/77/43/1129657743.db2.gz JPSZCZFNSUHKDJ-SMELUJQZSA-N 1 3 290.476 3.643 20 0 CHADHO CCC[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC001169098875 1129696315 /nfs/dbraw/zinc/69/63/15/1129696315.db2.gz LXDGQVIVYCZIGQ-XMTFNYHQSA-N 1 3 272.436 3.743 20 0 CHADHO CCC[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC001169098875 1129696318 /nfs/dbraw/zinc/69/63/18/1129696318.db2.gz LXDGQVIVYCZIGQ-XMTFNYHQSA-N 1 3 272.436 3.743 20 0 CHADHO CC(C)c1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)N3C)cc1 ZINC001169092252 1129700088 /nfs/dbraw/zinc/70/00/88/1129700088.db2.gz AUFLQUJGVKIOKG-BCDXTJNWSA-N 1 3 272.436 3.525 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@H](N[C@@H](CC1CC1)c1ccccc1)C2 ZINC001169116325 1129700102 /nfs/dbraw/zinc/70/01/02/1129700102.db2.gz PXQNNQZVWLOROW-OKYOBFRVSA-N 1 3 284.447 3.743 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](N[C@@H](CC1CC1)c1ccccc1)C2 ZINC001169116325 1129700106 /nfs/dbraw/zinc/70/01/06/1129700106.db2.gz PXQNNQZVWLOROW-OKYOBFRVSA-N 1 3 284.447 3.743 20 0 CHADHO CS[C@H]1CC[C@@H]1NC1CC[NH+](CC2CCCCC2)CC1 ZINC000766602004 1129701782 /nfs/dbraw/zinc/70/17/82/1129701782.db2.gz KPKVYVABESTBAW-IRXDYDNUSA-N 1 3 296.524 3.515 20 0 CHADHO CS[C@H]1CC[C@@H]1[NH2+]C1CCN(CC2CCCCC2)CC1 ZINC000766602004 1129701783 /nfs/dbraw/zinc/70/17/83/1129701783.db2.gz KPKVYVABESTBAW-IRXDYDNUSA-N 1 3 296.524 3.515 20 0 CHADHO C[C@@H](c1ccc(Cl)cc1)N(C)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169147168 1129704258 /nfs/dbraw/zinc/70/42/58/1129704258.db2.gz SWPRZCMKHLBVHJ-SJWGOKEGSA-N 1 3 292.854 3.958 20 0 CHADHO C[C@@H](c1ccc(Cl)cc1)N(C)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169147168 1129704259 /nfs/dbraw/zinc/70/42/59/1129704259.db2.gz SWPRZCMKHLBVHJ-SJWGOKEGSA-N 1 3 292.854 3.958 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)N(C)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169147179 1129704391 /nfs/dbraw/zinc/70/43/91/1129704391.db2.gz SWPRZCMKHLBVHJ-VDNDLQMASA-N 1 3 292.854 3.958 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)N(C)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169147179 1129704393 /nfs/dbraw/zinc/70/43/93/1129704393.db2.gz SWPRZCMKHLBVHJ-VDNDLQMASA-N 1 3 292.854 3.958 20 0 CHADHO CC[C@H](NCc1ccc(C[NH3+])cc1F)c1ccc(C)cc1 ZINC000650751987 1129721331 /nfs/dbraw/zinc/72/13/31/1129721331.db2.gz GVCRDGLIXRXTLX-SFHVURJKSA-N 1 3 286.394 3.834 20 0 CHADHO CC(C)C[C@@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccc(F)cc1 ZINC000652151429 1129758473 /nfs/dbraw/zinc/75/84/73/1129758473.db2.gz SLWSAVXHLGMNOW-MAUKXSAKSA-N 1 3 292.442 3.844 20 0 CHADHO CC(C)C[C@@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccc(F)cc1 ZINC000652151429 1129758475 /nfs/dbraw/zinc/75/84/75/1129758475.db2.gz SLWSAVXHLGMNOW-MAUKXSAKSA-N 1 3 292.442 3.844 20 0 CHADHO C(C1CCCCC1)N1CCC([NH2+][C@@H]2CCCSC2)CC1 ZINC000769018121 1129889106 /nfs/dbraw/zinc/88/91/06/1129889106.db2.gz QRRWFRSTTWZVCS-QGZVFWFLSA-N 1 3 296.524 3.516 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NCC[C@@H]2CCC(F)(F)C2)c2ccccc21 ZINC000902458890 1130013708 /nfs/dbraw/zinc/01/37/08/1130013708.db2.gz ZCUUDISSIJABGQ-NILFDRSVSA-N 1 3 280.362 3.546 20 0 CHADHO [NH3+]CC1([C@@H]2CCCCN2CCCCC(F)(F)F)CCC1 ZINC000903811492 1130200649 /nfs/dbraw/zinc/20/06/49/1130200649.db2.gz KYODMNVXXWAPIZ-ZDUSSCGKSA-N 1 3 292.389 3.703 20 0 CHADHO CC(C)CCC[C@@H](C)[NH+]1CCC(N(C)C2CC2)CC1 ZINC001170088573 1130204353 /nfs/dbraw/zinc/20/43/53/1130204353.db2.gz VTQWEHYXPHJRMJ-OAHLLOKOSA-N 1 3 266.473 3.760 20 0 CHADHO CN(C)Cc1cccc(-c2ccc(C[NH2+]C(C)(C)C)cc2)n1 ZINC001240368638 1130280677 /nfs/dbraw/zinc/28/06/77/1130280677.db2.gz YJNZRHJMHABHKV-UHFFFAOYSA-N 1 3 297.446 3.698 20 0 CHADHO c1ccc([C@H](N[C@H]2CC[N@@H+]3CCC[C@H]3C2)C2CCC2)cc1 ZINC000677242386 1130297733 /nfs/dbraw/zinc/29/77/33/1130297733.db2.gz ZQCXVNPGQPAENM-FHWLQOOXSA-N 1 3 284.447 3.744 20 0 CHADHO c1ccc([C@H](N[C@H]2CC[N@H+]3CCC[C@H]3C2)C2CCC2)cc1 ZINC000677242386 1130297736 /nfs/dbraw/zinc/29/77/36/1130297736.db2.gz ZQCXVNPGQPAENM-FHWLQOOXSA-N 1 3 284.447 3.744 20 0 CHADHO C[C@@H]1CCc2ccccc2[C@@H]1N[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000678609520 1130442020 /nfs/dbraw/zinc/44/20/20/1130442020.db2.gz PAZLEKOLQZSPLU-NOCIGQNYSA-N 1 3 284.447 3.526 20 0 CHADHO C[C@@H]1CCc2ccccc2[C@@H]1N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000678609520 1130442027 /nfs/dbraw/zinc/44/20/27/1130442027.db2.gz PAZLEKOLQZSPLU-NOCIGQNYSA-N 1 3 284.447 3.526 20 0 CHADHO CCOc1ccc([C@@H](C)[NH2+]CC[C@H]2CCCCN2C)cc1 ZINC000678733862 1130448310 /nfs/dbraw/zinc/44/83/10/1130448310.db2.gz YTIXAYJPBBEWGB-NVXWUHKLSA-N 1 3 290.451 3.610 20 0 CHADHO CCOc1ccc([C@H](C)[NH2+]CC[C@@H]2CCCCN2C)cc1 ZINC000678733863 1130448620 /nfs/dbraw/zinc/44/86/20/1130448620.db2.gz YTIXAYJPBBEWGB-RDJZCZTQSA-N 1 3 290.451 3.610 20 0 CHADHO CCCCN(C)CCC[NH2+][C@@H](C)Cc1ccccc1Cl ZINC001170250651 1130473814 /nfs/dbraw/zinc/47/38/14/1130473814.db2.gz QLZXRVVWZRRBIR-HNNXBMFYSA-N 1 3 296.886 3.983 20 0 CHADHO CCCC[N@H+](C)CCCN[C@@H](C)Cc1ccccc1Cl ZINC001170250651 1130473818 /nfs/dbraw/zinc/47/38/18/1130473818.db2.gz QLZXRVVWZRRBIR-HNNXBMFYSA-N 1 3 296.886 3.983 20 0 CHADHO CCCC[N@@H+](C)CCCN[C@@H](C)Cc1ccccc1Cl ZINC001170250651 1130473821 /nfs/dbraw/zinc/47/38/21/1130473821.db2.gz QLZXRVVWZRRBIR-HNNXBMFYSA-N 1 3 296.886 3.983 20 0 CHADHO C[C@@H]1CC[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000747100244 1130517375 /nfs/dbraw/zinc/51/73/75/1130517375.db2.gz GOLGBLFDMXMCSM-GDBMZVCRSA-N 1 3 264.457 3.562 20 0 CHADHO CC/C=C\CCCCCN1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001234992209 1130700608 /nfs/dbraw/zinc/70/06/08/1130700608.db2.gz JWEANHIOUSJMIK-LIMHQNJXSA-N 1 3 264.457 3.589 20 0 CHADHO c1cc(CN2CCC[C@@]3(CCC[NH2+]3)CC2)c2c(c1)CCCC2 ZINC001235039066 1130705691 /nfs/dbraw/zinc/70/56/91/1130705691.db2.gz MUGKRIBPSYOCKW-FQEVSTJZSA-N 1 3 298.474 3.674 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@@H+]1CC[C@H]2C[C@@]2(N)C1 ZINC001235173376 1130717585 /nfs/dbraw/zinc/71/75/85/1130717585.db2.gz UAGCSHJMOXUQIE-FXAWDEMLSA-N 1 3 292.426 3.585 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@H+]1CC[C@H]2C[C@@]2(N)C1 ZINC001235173376 1130717589 /nfs/dbraw/zinc/71/75/89/1130717589.db2.gz UAGCSHJMOXUQIE-FXAWDEMLSA-N 1 3 292.426 3.585 20 0 CHADHO CC(C)c1ccc(C[C@H](C)C[N@@H+]2CCC[C@H](CN)C2)cc1 ZINC001235672846 1130763722 /nfs/dbraw/zinc/76/37/22/1130763722.db2.gz IOGXCQBDFKJLAE-FUHWJXTLSA-N 1 3 288.479 3.659 20 0 CHADHO CC(C)c1ccc(C[C@H](C)C[N@H+]2CCC[C@H](CN)C2)cc1 ZINC001235672846 1130763729 /nfs/dbraw/zinc/76/37/29/1130763729.db2.gz IOGXCQBDFKJLAE-FUHWJXTLSA-N 1 3 288.479 3.659 20 0 CHADHO [NH3+]C[C@@H]1CCCN(Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001235677021 1130766422 /nfs/dbraw/zinc/76/64/22/1130766422.db2.gz WFDCXYUNNYMUKV-HNNXBMFYSA-N 1 3 298.405 3.663 20 0 CHADHO [NH3+]Cc1ccc(CN2CCC[C@@H]2c2ccccc2F)cc1 ZINC001235718779 1130774347 /nfs/dbraw/zinc/77/43/47/1130774347.db2.gz NNRVQZLOAWQDMY-GOSISDBHSA-N 1 3 284.378 3.622 20 0 CHADHO Cc1cccc(CN2CCC([C@H]3CCC[NH2+]3)CC2)c1Cl ZINC001235889229 1130793765 /nfs/dbraw/zinc/79/37/65/1130793765.db2.gz ZKXRQADMDCRLLX-MRXNPFEDSA-N 1 3 292.854 3.612 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+](C)C[C@H]1CCCNC1 ZINC001235951963 1130815150 /nfs/dbraw/zinc/81/51/50/1130815150.db2.gz WKLDPZZMYCQVHB-IRXDYDNUSA-N 1 3 266.473 3.690 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+](C)C[C@H]1CCCNC1 ZINC001235951963 1130815152 /nfs/dbraw/zinc/81/51/52/1130815152.db2.gz WKLDPZZMYCQVHB-IRXDYDNUSA-N 1 3 266.473 3.690 20 0 CHADHO [NH3+][C@@H]1[C@@H]2CC[C@H]1CN(Cc1ccccc1-c1cccs1)C2 ZINC001235958657 1130817370 /nfs/dbraw/zinc/81/73/70/1130817370.db2.gz AHDUKAWYAFJOOA-JLVBRIDZSA-N 1 3 298.455 3.584 20 0 CHADHO Cc1ccc(-c2ccc(C[N@@H+]3C[C@H]4CC[C@@]4(N)C3)cc2)cc1 ZINC001235995470 1130824580 /nfs/dbraw/zinc/82/45/80/1130824580.db2.gz VYRWCVVVYZONEA-WOJBJXKFSA-N 1 3 292.426 3.585 20 0 CHADHO Cc1ccc(-c2ccc(C[N@H+]3C[C@H]4CC[C@@]4(N)C3)cc2)cc1 ZINC001235995470 1130824585 /nfs/dbraw/zinc/82/45/85/1130824585.db2.gz VYRWCVVVYZONEA-WOJBJXKFSA-N 1 3 292.426 3.585 20 0 CHADHO C[C@H]1C[C@H](N)C[N@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001236046411 1130837050 /nfs/dbraw/zinc/83/70/50/1130837050.db2.gz GGPOLPFVGNTJHF-YJBOKZPZSA-N 1 3 280.415 3.523 20 0 CHADHO C[C@H]1C[C@H](N)C[N@@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001236046411 1130837056 /nfs/dbraw/zinc/83/70/56/1130837056.db2.gz GGPOLPFVGNTJHF-YJBOKZPZSA-N 1 3 280.415 3.523 20 0 CHADHO C[C@@H]1C[C@H](N)C[N@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001236044877 1130837551 /nfs/dbraw/zinc/83/75/51/1130837551.db2.gz AQXQNHUZUPZECV-HIFRSBDPSA-N 1 3 294.398 3.755 20 0 CHADHO C[C@@H]1C[C@H](N)C[N@@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001236044877 1130837556 /nfs/dbraw/zinc/83/75/56/1130837556.db2.gz AQXQNHUZUPZECV-HIFRSBDPSA-N 1 3 294.398 3.755 20 0 CHADHO CC(C)N(CCCC[NH3+])Cc1ccc(Cl)cc1Cl ZINC001236092036 1130857952 /nfs/dbraw/zinc/85/79/52/1130857952.db2.gz DXMLWWSAKNFNPG-UHFFFAOYSA-N 1 3 289.250 3.943 20 0 CHADHO N[C@@H]1CC[N@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001236168352 1130878864 /nfs/dbraw/zinc/87/88/64/1130878864.db2.gz IBJITKUJLJLRNZ-CYBMUJFWSA-N 1 3 282.412 3.588 20 0 CHADHO N[C@@H]1CC[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001236168352 1130878868 /nfs/dbraw/zinc/87/88/68/1130878868.db2.gz IBJITKUJLJLRNZ-CYBMUJFWSA-N 1 3 282.412 3.588 20 0 CHADHO CCC[N@H+](Cc1cc(C)c(Cl)c(C)c1)C1CCNCC1 ZINC001236184784 1130882096 /nfs/dbraw/zinc/88/20/96/1130882096.db2.gz PCBWLBMSTCVYTP-UHFFFAOYSA-N 1 3 294.870 3.921 20 0 CHADHO CCC[N@@H+](Cc1cc(C)c(Cl)c(C)c1)C1CCNCC1 ZINC001236184784 1130882102 /nfs/dbraw/zinc/88/21/02/1130882102.db2.gz PCBWLBMSTCVYTP-UHFFFAOYSA-N 1 3 294.870 3.921 20 0 CHADHO CCCN(Cc1cc(C)c(Cl)c(C)c1)C1CC[NH2+]CC1 ZINC001236184784 1130882106 /nfs/dbraw/zinc/88/21/06/1130882106.db2.gz PCBWLBMSTCVYTP-UHFFFAOYSA-N 1 3 294.870 3.921 20 0 CHADHO CCC[N@H+](Cc1cccc(C(C)C)c1)C1CCNCC1 ZINC001236185176 1130882668 /nfs/dbraw/zinc/88/26/68/1130882668.db2.gz ZHOUPUDMZLMCRY-UHFFFAOYSA-N 1 3 274.452 3.774 20 0 CHADHO CCC[N@@H+](Cc1cccc(C(C)C)c1)C1CCNCC1 ZINC001236185176 1130882674 /nfs/dbraw/zinc/88/26/74/1130882674.db2.gz ZHOUPUDMZLMCRY-UHFFFAOYSA-N 1 3 274.452 3.774 20 0 CHADHO CCCN(Cc1cccc(C(C)C)c1)C1CC[NH2+]CC1 ZINC001236185176 1130882680 /nfs/dbraw/zinc/88/26/80/1130882680.db2.gz ZHOUPUDMZLMCRY-UHFFFAOYSA-N 1 3 274.452 3.774 20 0 CHADHO Cc1c2ccccc2sc1C[N@@H+](C)[C@H]1CCCC[C@@H]1N ZINC001236218189 1130892049 /nfs/dbraw/zinc/89/20/49/1130892049.db2.gz RNANEDGEKBVAPA-GJZGRUSLSA-N 1 3 288.460 3.911 20 0 CHADHO Cc1c2ccccc2sc1C[N@H+](C)[C@H]1CCCC[C@@H]1N ZINC001236218189 1130892052 /nfs/dbraw/zinc/89/20/52/1130892052.db2.gz RNANEDGEKBVAPA-GJZGRUSLSA-N 1 3 288.460 3.911 20 0 CHADHO C[N@H+](Cc1ccc(C2CCC2)cc1)[C@H]1CCCC[C@@H]1N ZINC001236217003 1130892193 /nfs/dbraw/zinc/89/21/93/1130892193.db2.gz MKBMSPILPZBVRQ-ROUUACIJSA-N 1 3 272.436 3.656 20 0 CHADHO C[N@@H+](Cc1ccc(C2CCC2)cc1)[C@H]1CCCC[C@@H]1N ZINC001236217003 1130892199 /nfs/dbraw/zinc/89/21/99/1130892199.db2.gz MKBMSPILPZBVRQ-ROUUACIJSA-N 1 3 272.436 3.656 20 0 CHADHO CC(C)Cc1ccc(C[N@H+](C)[C@@H]2CCCC[C@H]2N)cc1 ZINC001236218026 1130893712 /nfs/dbraw/zinc/89/37/12/1130893712.db2.gz RANWRIJYTBYGOH-QZTJIDSGSA-N 1 3 274.452 3.587 20 0 CHADHO CC(C)Cc1ccc(C[N@@H+](C)[C@@H]2CCCC[C@H]2N)cc1 ZINC001236218026 1130893716 /nfs/dbraw/zinc/89/37/16/1130893716.db2.gz RANWRIJYTBYGOH-QZTJIDSGSA-N 1 3 274.452 3.587 20 0 CHADHO C[N@H+](Cc1ccc(F)c2ccccc12)[C@@H]1CCCC[C@@H]1N ZINC001236220641 1130894835 /nfs/dbraw/zinc/89/48/35/1130894835.db2.gz ZCCSGZBJBALBQD-ZWKOTPCHSA-N 1 3 286.394 3.681 20 0 CHADHO C[N@@H+](Cc1ccc(F)c2ccccc12)[C@@H]1CCCC[C@@H]1N ZINC001236220641 1130894839 /nfs/dbraw/zinc/89/48/39/1130894839.db2.gz ZCCSGZBJBALBQD-ZWKOTPCHSA-N 1 3 286.394 3.681 20 0 CHADHO Cc1ccccc1C[N@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236372790 1130922395 /nfs/dbraw/zinc/92/23/95/1130922395.db2.gz DMECJPZOTWTJQD-QGZVFWFLSA-N 1 3 286.463 3.739 20 0 CHADHO Cc1ccccc1C[N@@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236372790 1130922399 /nfs/dbraw/zinc/92/23/99/1130922399.db2.gz DMECJPZOTWTJQD-QGZVFWFLSA-N 1 3 286.463 3.739 20 0 CHADHO C1=CC[C@H](C[N@@H+](C[C@H]2CCCNC2)C2CCCC2)CC1 ZINC001236371703 1130922488 /nfs/dbraw/zinc/92/24/88/1130922488.db2.gz MEZFNZYRMSBYRR-IRXDYDNUSA-N 1 3 276.468 3.587 20 0 CHADHO C1=CC[C@H](C[N@H+](C[C@H]2CCCNC2)C2CCCC2)CC1 ZINC001236371703 1130922492 /nfs/dbraw/zinc/92/24/92/1130922492.db2.gz MEZFNZYRMSBYRR-IRXDYDNUSA-N 1 3 276.468 3.587 20 0 CHADHO CC1(c2ccccc2)CCN(CC[C@H]2CCCC[NH2+]2)CC1 ZINC001236434701 1130941322 /nfs/dbraw/zinc/94/13/22/1130941322.db2.gz UWFGNJNMUVDXTL-GOSISDBHSA-N 1 3 286.463 3.572 20 0 CHADHO CC[C@H](C)C[N@H+](Cc1cc(F)ccc1C)C1CCNCC1 ZINC001236510248 1130960118 /nfs/dbraw/zinc/96/01/18/1130960118.db2.gz ZBEFVEAHZMURMQ-AWEZNQCLSA-N 1 3 292.442 3.734 20 0 CHADHO CC[C@H](C)C[N@@H+](Cc1cc(F)ccc1C)C1CCNCC1 ZINC001236510248 1130960125 /nfs/dbraw/zinc/96/01/25/1130960125.db2.gz ZBEFVEAHZMURMQ-AWEZNQCLSA-N 1 3 292.442 3.734 20 0 CHADHO CC[C@H](C)CN(Cc1cc(F)ccc1C)C1CC[NH2+]CC1 ZINC001236510248 1130960129 /nfs/dbraw/zinc/96/01/29/1130960129.db2.gz ZBEFVEAHZMURMQ-AWEZNQCLSA-N 1 3 292.442 3.734 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@H+](C[C@@H]1CCCNC1)C1CC1 ZINC001236584859 1130980918 /nfs/dbraw/zinc/98/09/18/1130980918.db2.gz XKYXBPYHPWJYTK-IAGOWNOFSA-N 1 3 278.484 3.833 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@@H+](C[C@@H]1CCCNC1)C1CC1 ZINC001236584859 1130980922 /nfs/dbraw/zinc/98/09/22/1130980922.db2.gz XKYXBPYHPWJYTK-IAGOWNOFSA-N 1 3 278.484 3.833 20 0 CHADHO CC[NH+]1C[C@@H]2CN(Cc3ccc(C)c4ccccc34)C[C@H]2C1 ZINC001138017987 1131026598 /nfs/dbraw/zinc/02/65/98/1131026598.db2.gz DOVZLDMIWBYUPH-QZTJIDSGSA-N 1 3 294.442 3.532 20 0 CHADHO [NH3+]CC1C[C@H]2CC[C@@H](C1)N2Cc1cc(Cl)ccc1Cl ZINC001237082484 1131046956 /nfs/dbraw/zinc/04/69/56/1131046956.db2.gz QDMXWZZUTIWKBO-FTNCPSPGSA-N 1 3 299.245 3.695 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+]3CC[C@@H](C)C3)cc21 ZINC001237880960 1131147417 /nfs/dbraw/zinc/14/74/17/1131147417.db2.gz LBSSCCIIKSTMCR-CQSZACIVSA-N 1 3 270.420 3.530 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+]3CC[C@@H](C)C3)cc21 ZINC001237880960 1131147421 /nfs/dbraw/zinc/14/74/21/1131147421.db2.gz LBSSCCIIKSTMCR-CQSZACIVSA-N 1 3 270.420 3.530 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+](C)CC3CC3)cc21 ZINC001237875959 1131147747 /nfs/dbraw/zinc/14/77/47/1131147747.db2.gz BECVSTDMOGKYTB-UHFFFAOYSA-N 1 3 270.420 3.530 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+](C)CC3CC3)cc21 ZINC001237875959 1131147751 /nfs/dbraw/zinc/14/77/51/1131147751.db2.gz BECVSTDMOGKYTB-UHFFFAOYSA-N 1 3 270.420 3.530 20 0 CHADHO CCN(CC)Cc1cc([C@H](C)[NH2+]C2(C)CC2)ccc1OC ZINC001116494577 1131151446 /nfs/dbraw/zinc/15/14/46/1131151446.db2.gz GFTYFUMMTNGFCW-AWEZNQCLSA-N 1 3 290.451 3.740 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C1CCCCCCC1 ZINC000817893990 1131187048 /nfs/dbraw/zinc/18/70/48/1131187048.db2.gz VSTZMLWTOZQLJZ-ZDUSSCGKSA-N 1 3 275.440 3.612 20 0 CHADHO CCCCC[C@H]([NH2+][C@H]1CCNC[C@H]1C)C(C)(C)C ZINC000817969952 1131193625 /nfs/dbraw/zinc/19/36/25/1131193625.db2.gz IMKHPYHLMZEPFF-ILXRZTDVSA-N 1 3 254.462 3.569 20 0 CHADHO COc1c(C)cc([C@H](C)N[C@H]2CCC[C@@H]([NH3+])C2)cc1Cl ZINC000817970356 1131193713 /nfs/dbraw/zinc/19/37/13/1131193713.db2.gz RZSNGJAEPQYWCU-YUTCNCBUSA-N 1 3 296.842 3.578 20 0 CHADHO C[NH2+][C@H](C)CCN[C@H](c1cccs1)C1CCCC1 ZINC001118121862 1131211632 /nfs/dbraw/zinc/21/16/32/1131211632.db2.gz KCMURVMZGJTQPY-DOMZBBRYSA-N 1 3 266.454 3.567 20 0 CHADHO CCN(CC)CCC[N@H+](C)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC001171018913 1131429482 /nfs/dbraw/zinc/42/94/82/1131429482.db2.gz UAGUMUGEEBVRBW-RTBURBONSA-N 1 3 288.479 3.986 20 0 CHADHO CCN(CC)CCC[N@@H+](C)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC001171018913 1131429485 /nfs/dbraw/zinc/42/94/85/1131429485.db2.gz UAGUMUGEEBVRBW-RTBURBONSA-N 1 3 288.479 3.986 20 0 CHADHO CC[NH+](CC)CCCN(C)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC001171018913 1131429487 /nfs/dbraw/zinc/42/94/87/1131429487.db2.gz UAGUMUGEEBVRBW-RTBURBONSA-N 1 3 288.479 3.986 20 0 CHADHO C(C1CCCCC1)N1CCC([NH2+]C2CC3(CCC3)C2)CC1 ZINC000772875066 1131440422 /nfs/dbraw/zinc/44/04/22/1131440422.db2.gz ISBWICONGJGAMO-UHFFFAOYSA-N 1 3 290.495 3.953 20 0 CHADHO CCCC[C@@H]1C[C@@H](N[C@H]2CC23CCCCC3)CC[NH2+]1 ZINC001246334722 1131475271 /nfs/dbraw/zinc/47/52/71/1131475271.db2.gz PNKZNMGZEBJQOD-PMPSAXMXSA-N 1 3 264.457 3.610 20 0 CHADHO CCCCc1ccc(C[NH+]2CCC3(CN(C)C3)CC2)s1 ZINC001138755018 1131547698 /nfs/dbraw/zinc/54/76/98/1131547698.db2.gz LAAZVKALIJGLDY-UHFFFAOYSA-N 1 3 292.492 3.618 20 0 CHADHO CCC[N@H+](CCCN(C)C)Cc1cc(C)ccc1OCC ZINC001139607633 1131621361 /nfs/dbraw/zinc/62/13/61/1131621361.db2.gz YLDNCDASWXKGCW-UHFFFAOYSA-N 1 3 292.467 3.557 20 0 CHADHO CCC[N@@H+](CCCN(C)C)Cc1cc(C)ccc1OCC ZINC001139607633 1131621363 /nfs/dbraw/zinc/62/13/63/1131621363.db2.gz YLDNCDASWXKGCW-UHFFFAOYSA-N 1 3 292.467 3.557 20 0 CHADHO C[C@@H]1CCC[N@@H+]([C@@H]2CCN[C@@H](C(C)(C)C)C2)C[C@H]1C ZINC001246574950 1131660865 /nfs/dbraw/zinc/66/08/65/1131660865.db2.gz OZKVDFHKJLEFOX-KLHDSHLOSA-N 1 3 266.473 3.521 20 0 CHADHO C[C@@H]1CCC[N@H+]([C@@H]2CCN[C@@H](C(C)(C)C)C2)C[C@H]1C ZINC001246574950 1131660866 /nfs/dbraw/zinc/66/08/66/1131660866.db2.gz OZKVDFHKJLEFOX-KLHDSHLOSA-N 1 3 266.473 3.521 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@@H+]2CCC[C@H](C)[C@H](C)C2)CCN1 ZINC001246577089 1131667398 /nfs/dbraw/zinc/66/73/98/1131667398.db2.gz VEKADWLTWPZCNZ-YLFCFFPRSA-N 1 3 266.473 3.665 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@H](C)[C@H](C)C2)CCN1 ZINC001246577089 1131667401 /nfs/dbraw/zinc/66/74/01/1131667401.db2.gz VEKADWLTWPZCNZ-YLFCFFPRSA-N 1 3 266.473 3.665 20 0 CHADHO CCCCCC[C@@H](CC)[N@@H+]1CC[C@@]2(C1)CCCNC2 ZINC001246598947 1131711988 /nfs/dbraw/zinc/71/19/88/1131711988.db2.gz AAVDBZMTZMBEPN-SJORKVTESA-N 1 3 266.473 3.811 20 0 CHADHO CCCCCC[C@@H](CC)[N@H+]1CC[C@@]2(C1)CCCNC2 ZINC001246598947 1131711991 /nfs/dbraw/zinc/71/19/91/1131711991.db2.gz AAVDBZMTZMBEPN-SJORKVTESA-N 1 3 266.473 3.811 20 0 CHADHO CCCCC[C@@H](CC)[N@@H+]1CCC[C@]2(CCCNC2)C1 ZINC001246607499 1131716644 /nfs/dbraw/zinc/71/66/44/1131716644.db2.gz FDKYUDMSPANEJT-SJORKVTESA-N 1 3 266.473 3.811 20 0 CHADHO CCCCC[C@@H](CC)[N@H+]1CCC[C@]2(CCCNC2)C1 ZINC001246607499 1131716648 /nfs/dbraw/zinc/71/66/48/1131716648.db2.gz FDKYUDMSPANEJT-SJORKVTESA-N 1 3 266.473 3.811 20 0 CHADHO CCCCC(CCCC)N1CCC[C@]12CC[NH2+]C2 ZINC001246650267 1131778122 /nfs/dbraw/zinc/77/81/22/1131778122.db2.gz SILJEIVBMYYBSU-MRXNPFEDSA-N 1 3 252.446 3.563 20 0 CHADHO CCCC[C@@H]1C[C@@H]([N@@H+]2CCCCC[C@H]2C)CCN1 ZINC001246771595 1131781632 /nfs/dbraw/zinc/78/16/32/1131781632.db2.gz ZEVKZHOQGFSANA-OAGGEKHMSA-N 1 3 252.446 3.562 20 0 CHADHO C[C@H]1CC[C@H]([N@H+](C)[C@@H]2CCNC3(CCCCC3)C2)CC1 ZINC001247003201 1131840723 /nfs/dbraw/zinc/84/07/23/1131840723.db2.gz MARDVBVTRHZXOC-BRWVUGGUSA-N 1 3 278.484 3.952 20 0 CHADHO C[C@H]1CC[C@H]([N@@H+](C)[C@@H]2CCNC3(CCCCC3)C2)CC1 ZINC001247003201 1131840728 /nfs/dbraw/zinc/84/07/28/1131840728.db2.gz MARDVBVTRHZXOC-BRWVUGGUSA-N 1 3 278.484 3.952 20 0 CHADHO C[C@@H]([NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)C1CCC1 ZINC000716634471 1132028058 /nfs/dbraw/zinc/02/80/58/1132028058.db2.gz BDVIMWUFTWKQQP-VUBSUSDNSA-N 1 3 298.474 3.818 20 0 CHADHO c1ccc(CN2C[C@@H]3C[C@H]2C[C@H]([NH2+][C@@H]2CC=CCC2)C3)cc1 ZINC000716627725 1132028378 /nfs/dbraw/zinc/02/83/78/1132028378.db2.gz UAEDTMCYAWTRGH-NMLBUPMWSA-N 1 3 296.458 3.738 20 0 CHADHO CCCC[C@@H](C)[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001171630331 1132062306 /nfs/dbraw/zinc/06/23/06/1132062306.db2.gz MRSIEVTUFZZYGZ-CYBMUJFWSA-N 1 3 254.462 3.806 20 0 CHADHO C[C@@H]1CCN1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172070356 1132121003 /nfs/dbraw/zinc/12/10/03/1132121003.db2.gz ZNTOODNQLPJTFK-OQIJWPOYSA-N 1 3 284.447 3.666 20 0 CHADHO C[C@@H]1CCN1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172070356 1132121006 /nfs/dbraw/zinc/12/10/06/1132121006.db2.gz ZNTOODNQLPJTFK-OQIJWPOYSA-N 1 3 284.447 3.666 20 0 CHADHO CC[C@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001172101627 1132122327 /nfs/dbraw/zinc/12/23/27/1132122327.db2.gz GNWNGZXDABSILH-FJIDUMEYSA-N 1 3 290.426 3.882 20 0 CHADHO CC[C@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001172101627 1132122329 /nfs/dbraw/zinc/12/23/29/1132122329.db2.gz GNWNGZXDABSILH-FJIDUMEYSA-N 1 3 290.426 3.882 20 0 CHADHO CC[C@@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001172101629 1132122950 /nfs/dbraw/zinc/12/29/50/1132122950.db2.gz GNWNGZXDABSILH-XMTFNYHQSA-N 1 3 290.426 3.882 20 0 CHADHO CC[C@@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001172101629 1132122955 /nfs/dbraw/zinc/12/29/55/1132122955.db2.gz GNWNGZXDABSILH-XMTFNYHQSA-N 1 3 290.426 3.882 20 0 CHADHO Cc1ccccc1[C@H](C)N[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172110753 1132129099 /nfs/dbraw/zinc/12/90/99/1132129099.db2.gz ONNXRUGQLAPQTR-NXOAAHMSSA-N 1 3 272.436 3.661 20 0 CHADHO Cc1ccccc1[C@H](C)N[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172110753 1132129102 /nfs/dbraw/zinc/12/91/02/1132129102.db2.gz ONNXRUGQLAPQTR-NXOAAHMSSA-N 1 3 272.436 3.661 20 0 CHADHO CC[C@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001172107590 1132130956 /nfs/dbraw/zinc/13/09/56/1132130956.db2.gz FPFSCUJUAXIAIS-MHORFTMASA-N 1 3 290.426 3.882 20 0 CHADHO CC[C@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001172107590 1132130959 /nfs/dbraw/zinc/13/09/59/1132130959.db2.gz FPFSCUJUAXIAIS-MHORFTMASA-N 1 3 290.426 3.882 20 0 CHADHO C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H](NC(C)(C)c1ccc(F)cc1)C2 ZINC001172114771 1132132442 /nfs/dbraw/zinc/13/24/42/1132132442.db2.gz QADTYRULSDEWLH-BJWYYQGGSA-N 1 3 290.426 3.666 20 0 CHADHO C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H](NC(C)(C)c1ccc(F)cc1)C2 ZINC001172114771 1132132445 /nfs/dbraw/zinc/13/24/45/1132132445.db2.gz QADTYRULSDEWLH-BJWYYQGGSA-N 1 3 290.426 3.666 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC3(CC(F)(F)C3)CC1)C2 ZINC001172116893 1132133543 /nfs/dbraw/zinc/13/35/43/1132133543.db2.gz DPEXTJUWFZEENA-QDMKHBRRSA-N 1 3 298.421 3.513 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@H]3CCCC[C@H]31)C2 ZINC001172123501 1132135757 /nfs/dbraw/zinc/13/57/57/1132135757.db2.gz GNFDJNPAYOPJTF-DFBDCSAJSA-N 1 3 276.468 3.656 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@H]3CCCC[C@H]31)C2 ZINC001172123501 1132135761 /nfs/dbraw/zinc/13/57/61/1132135761.db2.gz GNFDJNPAYOPJTF-DFBDCSAJSA-N 1 3 276.468 3.656 20 0 CHADHO CC[C@@H](C)OCC[C@H](C)[NH+]1C(C)(C)CC(N)CC1(C)C ZINC001172320712 1132158489 /nfs/dbraw/zinc/15/84/89/1132158489.db2.gz ZSAQFWQHGLRDSP-UONOGXRCSA-N 1 3 284.488 3.560 20 0 CHADHO CC(C)OCC[C@@H](C)[N@@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001172450801 1132237402 /nfs/dbraw/zinc/23/74/02/1132237402.db2.gz KQQHUNVGTGSNGO-QZTJIDSGSA-N 1 3 296.499 3.530 20 0 CHADHO CC(C)OCC[C@@H](C)[N@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001172450801 1132237406 /nfs/dbraw/zinc/23/74/06/1132237406.db2.gz KQQHUNVGTGSNGO-QZTJIDSGSA-N 1 3 296.499 3.530 20 0 CHADHO CC(C)COCC[C@@H](C)[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001172461318 1132241680 /nfs/dbraw/zinc/24/16/80/1132241680.db2.gz FNHQVHRRVHPWKI-OAHLLOKOSA-N 1 3 298.515 3.679 20 0 CHADHO CCCN1C[C@@H]2C[NH+]([C@H]3CC[C@@H](c4ccccc4)C3)C[C@H]2C1 ZINC001172570831 1132273227 /nfs/dbraw/zinc/27/32/27/1132273227.db2.gz XTHOEDAACKOKHX-WTGUMLROSA-N 1 3 298.474 3.596 20 0 CHADHO CCCN1C[C@H]2C[NH+](C3CCC4(CCCC4)CC3)C[C@@H]2C1 ZINC001172730293 1132303869 /nfs/dbraw/zinc/30/38/69/1132303869.db2.gz CNDDVJIDXZHYKY-IRXDYDNUSA-N 1 3 290.495 3.763 20 0 CHADHO Fc1ccc([C@H]2CC[N@H+](Cc3cc4cnccc4[nH]3)C2)cc1 ZINC001232016563 1132411696 /nfs/dbraw/zinc/41/16/96/1132411696.db2.gz ZMBAEMRZGIDLAV-AWEZNQCLSA-N 1 3 295.361 3.692 20 0 CHADHO Fc1ccc([C@H]2CC[N@@H+](Cc3cc4cnccc4[nH]3)C2)cc1 ZINC001232016563 1132411700 /nfs/dbraw/zinc/41/17/00/1132411700.db2.gz ZMBAEMRZGIDLAV-AWEZNQCLSA-N 1 3 295.361 3.692 20 0 CHADHO CCC(CC)[N@H+](CC)Cc1cc(F)cc(CN(C)C)c1 ZINC001232146646 1132428063 /nfs/dbraw/zinc/42/80/63/1132428063.db2.gz XAKNKQIAWNZEKA-UHFFFAOYSA-N 1 3 280.431 3.898 20 0 CHADHO CCC(CC)[N@@H+](CC)Cc1cc(F)cc(CN(C)C)c1 ZINC001232146646 1132428067 /nfs/dbraw/zinc/42/80/67/1132428067.db2.gz XAKNKQIAWNZEKA-UHFFFAOYSA-N 1 3 280.431 3.898 20 0 CHADHO C[C@H]1C[N@@H+](Cc2cc(F)cc(CN(C)C)c2)CCC[C@@H]1C ZINC001232144347 1132428384 /nfs/dbraw/zinc/42/83/84/1132428384.db2.gz IYUODTKZBWVXMF-GJZGRUSLSA-N 1 3 292.442 3.755 20 0 CHADHO C[C@H]1C[N@H+](Cc2cc(F)cc(CN(C)C)c2)CCC[C@@H]1C ZINC001232144347 1132428388 /nfs/dbraw/zinc/42/83/88/1132428388.db2.gz IYUODTKZBWVXMF-GJZGRUSLSA-N 1 3 292.442 3.755 20 0 CHADHO CN(C)Cc1cc(F)cc(C[NH+]2CCCCCCC2)c1 ZINC001232146496 1132428696 /nfs/dbraw/zinc/42/86/96/1132428696.db2.gz QNKKSEBCOGPCRM-UHFFFAOYSA-N 1 3 278.415 3.653 20 0 CHADHO CC[C@H]1CC[C@H]([NH+]2C(C)(C)CC(N)CC2(C)C)C1 ZINC001173261856 1132429176 /nfs/dbraw/zinc/42/91/76/1132429176.db2.gz DGINHYKBYWIJSO-JSGCOSHPSA-N 1 3 252.446 3.545 20 0 CHADHO CC[C@H]1CC[C@@H]([NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC001173266465 1132433149 /nfs/dbraw/zinc/43/31/49/1132433149.db2.gz FSMKRSAKZKJQPS-GOEBONIOSA-N 1 3 264.457 3.562 20 0 CHADHO CCc1ccc(C[C@H](C)[NH2+][C@H]2CCC[C@@H](N(C)C)C2)cc1 ZINC001173240906 1132441217 /nfs/dbraw/zinc/44/12/17/1132441217.db2.gz KOACAUYCXXZJMB-ZYSHUDEJSA-N 1 3 288.479 3.642 20 0 CHADHO C(C[NH2+][C@H]1CCCC2(CCCCC2)C1)CN1CCCC1 ZINC001173338291 1132466229 /nfs/dbraw/zinc/46/62/29/1132466229.db2.gz HHCCEXWPAACBHL-KRWDZBQOSA-N 1 3 278.484 3.955 20 0 CHADHO CN1CC[C@@H]2C[N@@H+]([C@H]3CCCC4(CCCCC4)C3)C[C@@H]2C1 ZINC001173343867 1132468268 /nfs/dbraw/zinc/46/82/68/1132468268.db2.gz KLZCDEJXXQCSFP-SQNIBIBYSA-N 1 3 290.495 3.763 20 0 CHADHO CN1CC[C@@H]2C[N@H+]([C@H]3CCCC4(CCCCC4)C3)C[C@@H]2C1 ZINC001173343867 1132468270 /nfs/dbraw/zinc/46/82/70/1132468270.db2.gz KLZCDEJXXQCSFP-SQNIBIBYSA-N 1 3 290.495 3.763 20 0 CHADHO C[C@@H]([NH3+])c1ccc2c(ccn2-c2c[nH]cc3ccnc2-3)c1 ZINC001162907885 1133120732 /nfs/dbraw/zinc/12/07/32/1133120732.db2.gz AAALWCKSKGJIEH-LLVKDONJSA-N 1 3 276.343 3.527 20 0 CHADHO C[C@@H]([NH3+])c1ccc2c(ccn2-c2cncc3cc[nH]c32)c1 ZINC001162907885 1133120736 /nfs/dbraw/zinc/12/07/36/1133120736.db2.gz AAALWCKSKGJIEH-LLVKDONJSA-N 1 3 276.343 3.527 20 0 CHADHO C[C@H]([NH3+])c1ccc2c(ccn2-c2c[nH]cc3ccnc2-3)c1 ZINC001162907889 1133121341 /nfs/dbraw/zinc/12/13/41/1133121341.db2.gz AAALWCKSKGJIEH-NSHDSACASA-N 1 3 276.343 3.527 20 0 CHADHO C[C@H]([NH3+])c1ccc2c(ccn2-c2cncc3cc[nH]c32)c1 ZINC001162907889 1133121342 /nfs/dbraw/zinc/12/13/42/1133121342.db2.gz AAALWCKSKGJIEH-NSHDSACASA-N 1 3 276.343 3.527 20 0 CHADHO Cc1ccc2c(N[C@H]3CNCc4ccsc43)cc[nH+]c2c1 ZINC001163235463 1133139635 /nfs/dbraw/zinc/13/96/35/1133139635.db2.gz BLRHGEUEXITFFJ-INIZCTEOSA-N 1 3 295.411 3.861 20 0 CHADHO Cc1c(C)n(-c2c[nH]cc3ccnc2-3)c2ccc(C[NH3+])cc12 ZINC001163761823 1133172939 /nfs/dbraw/zinc/17/29/39/1133172939.db2.gz VTBHERXNEDZYCF-UHFFFAOYSA-N 1 3 290.370 3.582 20 0 CHADHO Cc1c(C)n(-c2cncc3cc[nH]c32)c2ccc(C[NH3+])cc12 ZINC001163761823 1133172942 /nfs/dbraw/zinc/17/29/42/1133172942.db2.gz VTBHERXNEDZYCF-UHFFFAOYSA-N 1 3 290.370 3.582 20 0 CHADHO C[NH2+]C[C@H]1CCCN(C[C@@H](C)c2cccc3ccccc32)C1 ZINC001205002079 1133516205 /nfs/dbraw/zinc/51/62/05/1133516205.db2.gz YXFPUYVITYWACA-IAGOWNOFSA-N 1 3 296.458 3.875 20 0 CHADHO CCCCc1ccc(CN2CC[C@@H](C)[C@@H](C[NH3+])C2)s1 ZINC001205306334 1133557811 /nfs/dbraw/zinc/55/78/11/1133557811.db2.gz VNYGXDFBGMFUCB-KGLIPLIRSA-N 1 3 280.481 3.507 20 0 CHADHO Cc1ccc2ccccc2c1C[N@H+]1CC[C@H](C)[C@@H](CN)C1 ZINC001205305958 1133558513 /nfs/dbraw/zinc/55/85/13/1133558513.db2.gz USISBSITRAFKHO-YOEHRIQHSA-N 1 3 282.431 3.565 20 0 CHADHO Cc1ccc2ccccc2c1C[N@@H+]1CC[C@H](C)[C@@H](CN)C1 ZINC001205305958 1133558518 /nfs/dbraw/zinc/55/85/18/1133558518.db2.gz USISBSITRAFKHO-YOEHRIQHSA-N 1 3 282.431 3.565 20 0 CHADHO Cc1cc(CN2CC[C@@H](C)[C@H](C[NH3+])CC2)c(F)cc1Cl ZINC001205655158 1133599877 /nfs/dbraw/zinc/59/98/77/1133599877.db2.gz YWUNKUZPALJATG-YPMHNXCESA-N 1 3 298.833 3.594 20 0 CHADHO CCN(CC)CCC[N@H+](CC)C[C@@H](C)C(C)(C)C ZINC001205684555 1133602440 /nfs/dbraw/zinc/60/24/40/1133602440.db2.gz HZXQZMWRPZIOKE-OAHLLOKOSA-N 1 3 256.478 3.722 20 0 CHADHO CCN(CC)CCC[N@@H+](CC)C[C@@H](C)C(C)(C)C ZINC001205684555 1133602444 /nfs/dbraw/zinc/60/24/44/1133602444.db2.gz HZXQZMWRPZIOKE-OAHLLOKOSA-N 1 3 256.478 3.722 20 0 CHADHO Cc1ccc(Cl)c(CN2CCC[C@H](C[NH3+])[C@@H](C)C2)c1F ZINC001205996565 1133639201 /nfs/dbraw/zinc/63/92/01/1133639201.db2.gz XHMVOSPLNGEWBR-QWHCGFSZSA-N 1 3 298.833 3.594 20 0 CHADHO CCSc1ccccc1CN1CCCC[C@@](C)(C[NH3+])C1 ZINC001206580503 1133722626 /nfs/dbraw/zinc/72/26/26/1133722626.db2.gz DCCMLXIVUZCBHD-KRWDZBQOSA-N 1 3 292.492 3.750 20 0 CHADHO CSc1ccccc1CN(C(C)C)[C@H]1CCC[NH2+]CC1 ZINC001206591353 1133723649 /nfs/dbraw/zinc/72/36/49/1133723649.db2.gz SBSKATZRKMEROE-INIZCTEOSA-N 1 3 292.492 3.761 20 0 CHADHO Cc1ccc2ccccc2c1C[N@H+]1C[C@H](CN)CC[C@H]1C ZINC001206770178 1133745633 /nfs/dbraw/zinc/74/56/33/1133745633.db2.gz RWFSEBMDSUIROU-CVEARBPZSA-N 1 3 282.431 3.707 20 0 CHADHO Cc1ccc2ccccc2c1C[N@@H+]1C[C@H](CN)CC[C@H]1C ZINC001206770178 1133745638 /nfs/dbraw/zinc/74/56/38/1133745638.db2.gz RWFSEBMDSUIROU-CVEARBPZSA-N 1 3 282.431 3.707 20 0 CHADHO CCCCc1ccc(CN2C[C@@H](C[NH3+])CC[C@H]2C)cc1 ZINC001206769378 1133745841 /nfs/dbraw/zinc/74/58/41/1133745841.db2.gz OXNNFGIHVSDIRQ-CRAIPNDOSA-N 1 3 274.452 3.588 20 0 CHADHO CN(C)CC(C)(C)C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001207285363 1133788123 /nfs/dbraw/zinc/78/81/23/1133788123.db2.gz HXYVBSOYQZUKDU-MRXNPFEDSA-N 1 3 278.415 3.550 20 0 CHADHO CN(C)CC(C)(C)C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001207285363 1133788128 /nfs/dbraw/zinc/78/81/28/1133788128.db2.gz HXYVBSOYQZUKDU-MRXNPFEDSA-N 1 3 278.415 3.550 20 0 CHADHO CCCC[NH+]1CCC(N(C)CCCc2ccc(C)o2)CC1 ZINC001207949714 1133869406 /nfs/dbraw/zinc/86/94/06/1133869406.db2.gz NMFVWMQKJDETGY-UHFFFAOYSA-N 1 3 292.467 3.717 20 0 CHADHO CCN(C)C1CC[NH+](CCC(C)(C)c2ccccc2)CC1 ZINC001208669139 1133925354 /nfs/dbraw/zinc/92/53/54/1133925354.db2.gz HIBKDJHDQHOWTD-UHFFFAOYSA-N 1 3 288.479 3.770 20 0 CHADHO CC(C)CCC[N@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001208735907 1133937875 /nfs/dbraw/zinc/93/78/75/1133937875.db2.gz RGCOGWUKRWERAF-KRWDZBQOSA-N 1 3 266.473 3.763 20 0 CHADHO CC(C)CCC[N@@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001208735907 1133937872 /nfs/dbraw/zinc/93/78/72/1133937872.db2.gz RGCOGWUKRWERAF-KRWDZBQOSA-N 1 3 266.473 3.763 20 0 CHADHO CCN(Cc1ccccc1)C1CC[NH+](C[C@H]2C[C@@H]2C)CC1 ZINC001209420356 1134015141 /nfs/dbraw/zinc/01/51/41/1134015141.db2.gz HZPZAWJPSRFECO-FUHWJXTLSA-N 1 3 286.463 3.629 20 0 CHADHO Cc1cc(Nc2cccc(CN3CCCCC3)c2F)cc[nH+]1 ZINC001215675856 1134659019 /nfs/dbraw/zinc/65/90/19/1134659019.db2.gz IZOGHDYTUYKULN-UHFFFAOYSA-N 1 3 299.393 3.681 20 0 CHADHO C[N@@H+]1CC[C@H](N[C@@H]2CCCc3ccccc32)[C@@H]2CCC[C@H]21 ZINC000353453213 529806905 /nfs/dbraw/zinc/80/69/05/529806905.db2.gz FDMPLUIJUZJSGG-ZSYWTGECSA-N 1 3 284.447 3.526 20 0 CHADHO C[N@H+]1CC[C@H](N[C@@H]2CCCc3ccccc32)[C@@H]2CCC[C@H]21 ZINC000353453213 529806907 /nfs/dbraw/zinc/80/69/07/529806907.db2.gz FDMPLUIJUZJSGG-ZSYWTGECSA-N 1 3 284.447 3.526 20 0 CHADHO CCC[NH+]1CCC(NCc2cccc3ccccc32)CC1 ZINC000020189514 171055717 /nfs/dbraw/zinc/05/57/17/171055717.db2.gz AHJIXSNZCUUAKE-UHFFFAOYSA-N 1 3 282.431 3.804 20 0 CHADHO C[C@H](C[NH2+]CCCN1CCCC[C@@H]1C)c1ccccc1 ZINC000021812529 171330217 /nfs/dbraw/zinc/33/02/17/171330217.db2.gz UOYWQACWGYAADK-SJORKVTESA-N 1 3 274.452 3.644 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)[NH2+]CC1=CCN(C)CC1 ZINC000344300785 225021645 /nfs/dbraw/zinc/02/16/45/225021645.db2.gz QMIXOOKKONPRAJ-IBGZPJMESA-N 1 3 286.463 3.934 20 0 CHADHO Cc1oc2ccccc2c1CN[C@@H]1CC[N@@H+](C)[C@@H]2CCC[C@H]21 ZINC000353679004 228143672 /nfs/dbraw/zinc/14/36/72/228143672.db2.gz FRHKATPLFHUVEH-CGTJXYLNSA-N 1 3 298.430 3.704 20 0 CHADHO Cc1oc2ccccc2c1CN[C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21 ZINC000353679004 228143673 /nfs/dbraw/zinc/14/36/73/228143673.db2.gz FRHKATPLFHUVEH-CGTJXYLNSA-N 1 3 298.430 3.704 20 0 CHADHO Cc1oc2ccccc2c1C[NH2+][C@@H]1CCN(C)[C@@H]2CCC[C@H]21 ZINC000353679004 228143674 /nfs/dbraw/zinc/14/36/74/228143674.db2.gz FRHKATPLFHUVEH-CGTJXYLNSA-N 1 3 298.430 3.704 20 0 CHADHO CC[C@@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc(Cl)c1 ZINC000037649102 260115306 /nfs/dbraw/zinc/11/53/06/260115306.db2.gz CPWICGKPQTUAFJ-SUMWQHHRSA-N 1 3 292.854 3.865 20 0 CHADHO CC[C@@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1cccc(Cl)c1 ZINC000037649102 260115307 /nfs/dbraw/zinc/11/53/07/260115307.db2.gz CPWICGKPQTUAFJ-SUMWQHHRSA-N 1 3 292.854 3.865 20 0 CHADHO C[C@H](C[NH2+][C@H](C)Cc1ccc(Cl)cc1)CN1CCCC1 ZINC000223034003 260260303 /nfs/dbraw/zinc/26/03/03/260260303.db2.gz AYTRKHLKUKLMEQ-HUUCEWRRSA-N 1 3 294.870 3.593 20 0 CHADHO Cc1ccc([C@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c(C)c1 ZINC000088163969 260280582 /nfs/dbraw/zinc/28/05/82/260280582.db2.gz QAIPJTKUGXBJGW-OOKSDGMUSA-N 1 3 286.463 3.969 20 0 CHADHO Cc1ccc([C@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c(C)c1 ZINC000088163969 260280584 /nfs/dbraw/zinc/28/05/84/260280584.db2.gz QAIPJTKUGXBJGW-OOKSDGMUSA-N 1 3 286.463 3.969 20 0 CHADHO CC(C)(C)[C@H](N[C@@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000129011649 260380662 /nfs/dbraw/zinc/38/06/62/260380662.db2.gz AZRFESRJHKCIDK-HZPDHXFCSA-N 1 3 260.425 3.506 20 0 CHADHO COc1cccc([C@@H](C)[NH2+]CCCN2CCCC[C@@H]2C)c1 ZINC000019913094 262205952 /nfs/dbraw/zinc/20/59/52/262205952.db2.gz FDXRLHVYSHFSOA-JKSUJKDBSA-N 1 3 290.451 3.610 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H]1C[C@H](C)c2ccccc21 ZINC000311903388 262344058 /nfs/dbraw/zinc/34/40/58/262344058.db2.gz QVHKQONYPQSKRE-WMLDXEAASA-N 1 3 260.425 3.556 20 0 CHADHO Cc1cc(C)c([C@@H](C)[NH2+]CCCN2CCCC2)cc1C ZINC000021049753 262375498 /nfs/dbraw/zinc/37/54/98/262375498.db2.gz KIZIIKCVPYVTIT-QGZVFWFLSA-N 1 3 274.452 3.748 20 0 CHADHO C[C@@H]1C[C@H](CN)C[N@@H+]1CC1CCC(c2ccccc2)CC1 ZINC000414661607 263023747 /nfs/dbraw/zinc/02/37/47/263023747.db2.gz OXVFWZMKFASTBX-FXQQTDPRSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@@H]1C[C@H](CN)C[N@H+]1CC1CCC(c2ccccc2)CC1 ZINC000414661607 263023748 /nfs/dbraw/zinc/02/37/48/263023748.db2.gz OXVFWZMKFASTBX-FXQQTDPRSA-N 1 3 286.463 3.630 20 0 CHADHO [NH3+]C[C@H]1CCCC[C@H]1NCc1cc2ccccc2s1 ZINC000414795723 263050137 /nfs/dbraw/zinc/05/01/37/263050137.db2.gz HACJDQFFWKPUSF-UKRRQHHQSA-N 1 3 274.433 3.508 20 0 CHADHO NC[C@H]1CCCC[C@H]1[NH2+]Cc1cc2ccccc2s1 ZINC000414795723 263050138 /nfs/dbraw/zinc/05/01/38/263050138.db2.gz HACJDQFFWKPUSF-UKRRQHHQSA-N 1 3 274.433 3.508 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H]([NH2+][C@H]2CCCC[C@@H]2CN)C1 ZINC000414803396 263051541 /nfs/dbraw/zinc/05/15/41/263051541.db2.gz NUSNOUACSVVXGH-BVBHFADKSA-N 1 3 286.463 3.604 20 0 CHADHO Cc1cc(Cl)ccc1CNCc1ccc([C@H](C)[NH3+])cc1 ZINC000414803932 263051581 /nfs/dbraw/zinc/05/15/81/263051581.db2.gz DHMMLQUUSJVYAR-ZDUSSCGKSA-N 1 3 288.822 3.958 20 0 CHADHO CCCc1cccc(CNCc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000414805808 263051862 /nfs/dbraw/zinc/05/18/62/263051862.db2.gz AWYWMJOSFWCBOR-OAHLLOKOSA-N 1 3 282.431 3.949 20 0 CHADHO NC[C@H]1CCCC[C@H]1[NH2+]CCCc1c(F)cccc1Cl ZINC000414811457 263053167 /nfs/dbraw/zinc/05/31/67/263053167.db2.gz WJBRQPVZGNKSIB-MLGOLLRUSA-N 1 3 298.833 3.519 20 0 CHADHO CCC[C@H](CCc1ccccc1)NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414820577 263054745 /nfs/dbraw/zinc/05/47/45/263054745.db2.gz AGAGNMZTIGYMGH-KAKFPZCNSA-N 1 3 286.463 3.661 20 0 CHADHO CC(C)C[C@H](C[NH2+][C@H](C)[C@H]1CCCNC1)c1ccccc1 ZINC000414828036 263055981 /nfs/dbraw/zinc/05/59/81/263055981.db2.gz YTWMZKMZBIQMQA-NZSAHSFTSA-N 1 3 288.479 3.794 20 0 CHADHO Clc1oc2ccccc2c1CNCC[C@@H]1CCC[NH2+]C1 ZINC000414846734 263062453 /nfs/dbraw/zinc/06/24/53/263062453.db2.gz VAHDCQQLNQQWFV-LBPRGKRZSA-N 1 3 292.810 3.566 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000282997865 263080271 /nfs/dbraw/zinc/08/02/71/263080271.db2.gz GAAOFOSRQFDAPP-CAMMJAKZSA-N 1 3 286.463 3.500 20 0 CHADHO C[C@@H](CN)C[NH2+]CCCCc1ccc(Cl)c(Cl)c1 ZINC000414872089 263086453 /nfs/dbraw/zinc/08/64/53/263086453.db2.gz FEOUNPNUBHKROC-NSHDSACASA-N 1 3 289.250 3.501 20 0 CHADHO Cc1ccc(-c2ccc(CN[C@H](C)CC[NH3+])s2)cc1 ZINC000414887572 263100683 /nfs/dbraw/zinc/10/06/83/263100683.db2.gz QSJKCCFGAMFCKP-CYBMUJFWSA-N 1 3 274.433 3.550 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H](N)C2)C[C@@H](c2ccccc2)C1 ZINC000414925130 263129622 /nfs/dbraw/zinc/12/96/22/263129622.db2.gz LAPAMEMQCHYMHW-HZZCBIDNSA-N 1 3 286.463 3.818 20 0 CHADHO C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@@H]1CCC[C@@H](N)C1 ZINC000414925099 263129704 /nfs/dbraw/zinc/12/97/04/263129704.db2.gz KZWPNQPHAAAKKZ-DJIMGWMZSA-N 1 3 274.452 3.602 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2c2ccc(Cl)cc2)CCN1 ZINC000414953862 263159434 /nfs/dbraw/zinc/15/94/34/263159434.db2.gz RZVZEXFXHYFZNJ-VZEFYGNVSA-N 1 3 292.854 3.706 20 0 CHADHO CC(C)C[C@H](C)[NH2+]C[C@@H]1CNCC[C@@H]1c1ccc(F)cc1 ZINC000414997643 263196368 /nfs/dbraw/zinc/19/63/68/263196368.db2.gz HQKCNKRYKOEVBJ-QILLFSRXSA-N 1 3 292.442 3.543 20 0 CHADHO CCn1c2ccccc2c2cc(C[NH2+][C@@H](C)[C@@H](C)N)ccc21 ZINC000415006645 263218521 /nfs/dbraw/zinc/21/85/21/263218521.db2.gz KUFHYLQQAPKPCE-KGLIPLIRSA-N 1 3 295.430 3.640 20 0 CHADHO CC[C@H](Cc1ccc(Cl)cc1Cl)N[C@@H](C)[C@H](C)[NH3+] ZINC000415007241 263220815 /nfs/dbraw/zinc/22/08/15/263220815.db2.gz CLPYUDLEGNKJGP-OUJBWJOFSA-N 1 3 289.250 3.640 20 0 CHADHO C[C@@H](CCCC[NH3+])NCc1csc(Cl)c1Cl ZINC000415017552 263255565 /nfs/dbraw/zinc/25/55/65/263255565.db2.gz SJNPTUMYGQOMEB-QMMMGPOBSA-N 1 3 281.252 3.662 20 0 CHADHO FC(F)c1ccc(CN2CCCC[C@H]2[C@@H]2CC[NH2+]C2)cc1 ZINC000415034768 263257149 /nfs/dbraw/zinc/25/71/49/263257149.db2.gz DBMGOTMTJCXNAY-CVEARBPZSA-N 1 3 294.389 3.588 20 0 CHADHO c1cc(C2CC2)ccc1CN1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000415041071 263257410 /nfs/dbraw/zinc/25/74/10/263257410.db2.gz KVFUGSVVCPMQFV-RBUKOAKNSA-N 1 3 284.447 3.528 20 0 CHADHO C[C@H]([NH2+]C1CCNCC1)C(c1ccccc1)c1ccccc1 ZINC000415076350 263266368 /nfs/dbraw/zinc/26/63/68/263266368.db2.gz AVRLOMANSHPPLX-INIZCTEOSA-N 1 3 294.442 3.549 20 0 CHADHO C[C@H](NC1CC[NH2+]CC1)C(c1ccccc1)c1ccccc1 ZINC000415076350 263266371 /nfs/dbraw/zinc/26/63/71/263266371.db2.gz AVRLOMANSHPPLX-INIZCTEOSA-N 1 3 294.442 3.549 20 0 CHADHO C[C@@H](C[C@H]1CCC[NH2+]1)NCCc1csc2ccccc12 ZINC000415090733 263272403 /nfs/dbraw/zinc/27/24/03/263272403.db2.gz ZKPHAYJELKZCKO-DZGCQCFKSA-N 1 3 288.460 3.564 20 0 CHADHO CS[C@@H]1CC[C@@H]1NCc1ccccc1C[N@H+](C)C(C)C ZINC000425365381 264210872 /nfs/dbraw/zinc/21/08/72/264210872.db2.gz YDHGACBZNLSCMM-DLBZAZTESA-N 1 3 292.492 3.510 20 0 CHADHO CS[C@@H]1CC[C@@H]1NCc1ccccc1C[N@@H+](C)C(C)C ZINC000425365381 264210873 /nfs/dbraw/zinc/21/08/73/264210873.db2.gz YDHGACBZNLSCMM-DLBZAZTESA-N 1 3 292.492 3.510 20 0 CHADHO CC[C@H](N[C@@H]1CCC[C@H]1C[NH3+])c1cccc(Cl)c1 ZINC000251301310 264281607 /nfs/dbraw/zinc/28/16/07/264281607.db2.gz TWKYFGAVNGAJMQ-AEGPPILISA-N 1 3 266.816 3.508 20 0 CHADHO CC[C@H](N[C@@H]1CCC[NH2+]CC1)c1cccc(Cl)c1 ZINC000128965372 264313067 /nfs/dbraw/zinc/31/30/67/264313067.db2.gz ZLIRQICGGLWRHV-CABCVRRESA-N 1 3 266.816 3.523 20 0 CHADHO C[C@H]([NH2+]CC1CCN(Cc2cccs2)CC1)C(C)(C)C ZINC000125510727 327643150 /nfs/dbraw/zinc/64/31/50/327643150.db2.gz KOHDHMULTNYGGJ-AWEZNQCLSA-N 1 3 294.508 3.984 20 0 CHADHO C[C@@H](CN[C@H](c1ccccc1)C1CC1)C[NH+]1CCCCC1 ZINC000041075779 328026546 /nfs/dbraw/zinc/02/65/46/328026546.db2.gz VTOQODKQPKJNRK-QFBILLFUSA-N 1 3 286.463 3.849 20 0 CHADHO C[C@@H](C[NH2+][C@H](c1ccccc1)C1CC1)CN1CCCCC1 ZINC000041075779 328026547 /nfs/dbraw/zinc/02/65/47/328026547.db2.gz VTOQODKQPKJNRK-QFBILLFUSA-N 1 3 286.463 3.849 20 0 CHADHO CN1CCC[C@H]1CC[NH2+][C@H](c1ccccc1)C(C)(C)C ZINC000534019178 328033133 /nfs/dbraw/zinc/03/31/33/328033133.db2.gz LHIMOLRRRIFXSE-DLBZAZTESA-N 1 3 274.452 3.848 20 0 CHADHO C[N@@H+]1CCC[C@H]1CCN[C@H](c1ccccc1)C(C)(C)C ZINC000534019178 328033135 /nfs/dbraw/zinc/03/31/35/328033135.db2.gz LHIMOLRRRIFXSE-DLBZAZTESA-N 1 3 274.452 3.848 20 0 CHADHO C[N@H+]1CCC[C@H]1CCN[C@H](c1ccccc1)C(C)(C)C ZINC000534019178 328033136 /nfs/dbraw/zinc/03/31/36/328033136.db2.gz LHIMOLRRRIFXSE-DLBZAZTESA-N 1 3 274.452 3.848 20 0 CHADHO C[C@H](NC[C@H]1CCC[N@H+](C)C1)c1ccccc1C(C)(C)C ZINC000534353150 328048377 /nfs/dbraw/zinc/04/83/77/328048377.db2.gz PNKIVLVYJXORCQ-JKSUJKDBSA-N 1 3 288.479 3.977 20 0 CHADHO C[C@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccccc1C(C)(C)C ZINC000534353150 328048378 /nfs/dbraw/zinc/04/83/78/328048378.db2.gz PNKIVLVYJXORCQ-JKSUJKDBSA-N 1 3 288.479 3.977 20 0 CHADHO CC[N@@H+](C/C=C/c1ccc(F)cc1)CCCN1CCCC1 ZINC000571091297 328085918 /nfs/dbraw/zinc/08/59/18/328085918.db2.gz RMOMQPDGGDVWIF-FNORWQNLSA-N 1 3 290.426 3.647 20 0 CHADHO CC[N@H+](C/C=C/c1ccc(F)cc1)CCCN1CCCC1 ZINC000571091297 328085920 /nfs/dbraw/zinc/08/59/20/328085920.db2.gz RMOMQPDGGDVWIF-FNORWQNLSA-N 1 3 290.426 3.647 20 0 CHADHO CCCC[N@H+](C)CC1CCN(Cc2ccoc2C)CC1 ZINC000414366402 328155902 /nfs/dbraw/zinc/15/59/02/328155902.db2.gz BQBAICBFGZBGPT-UHFFFAOYSA-N 1 3 278.440 3.532 20 0 CHADHO CCCC[N@@H+](C)CC1CCN(Cc2ccoc2C)CC1 ZINC000414366402 328155903 /nfs/dbraw/zinc/15/59/03/328155903.db2.gz BQBAICBFGZBGPT-UHFFFAOYSA-N 1 3 278.440 3.532 20 0 CHADHO Cc1ccc2c(c1)[C@@H](NC1CC[NH+](C3CCC3)CC1)CC2 ZINC000268812602 328186028 /nfs/dbraw/zinc/18/60/28/328186028.db2.gz BGHLTXQHEDXMEX-IBGZPJMESA-N 1 3 284.447 3.589 20 0 CHADHO [NH3+]C[C@@H]1CCCC[C@@H]1NCc1csc2ccccc12 ZINC000414791120 328226533 /nfs/dbraw/zinc/22/65/33/328226533.db2.gz AYCRQXHQDXISAU-WFASDCNBSA-N 1 3 274.433 3.508 20 0 CHADHO NC1(C[NH2+]Cc2ccc(-c3ccc(F)cc3)s2)CCC1 ZINC000414873969 328246643 /nfs/dbraw/zinc/24/66/43/328246643.db2.gz AHFVDXHGVCVTTN-UHFFFAOYSA-N 1 3 290.407 3.525 20 0 CHADHO CC(C)CC[C@@H]([NH2+][C@H]1CCCNCC1)C(C)(C)C ZINC000415083530 328302594 /nfs/dbraw/zinc/30/25/94/328302594.db2.gz NOSRDBFHPBFIAS-LSDHHAIUSA-N 1 3 254.462 3.569 20 0 CHADHO Cc1cccc(C[NH2+]CCCN2CCC(C)CC2)c1C ZINC000048580255 328317333 /nfs/dbraw/zinc/31/73/33/328317333.db2.gz JLUGNEAVLBUZAA-UHFFFAOYSA-N 1 3 274.452 3.515 20 0 CHADHO C[C@@H](CC[NH+](C)C)N[C@@H](C)c1ccc2ccccc2c1 ZINC000049553117 328371693 /nfs/dbraw/zinc/37/16/93/328371693.db2.gz JDANMSWZDBQRLH-GJZGRUSLSA-N 1 3 270.420 3.831 20 0 CHADHO CC1CCC([NH2+]CCCN2C[C@@H](C)C[C@H](C)C2)CC1 ZINC000568930673 327024186 /nfs/dbraw/zinc/02/41/86/327024186.db2.gz ACVOWLPDUFCBIU-YZUHTNEWSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)[N@@H+]1CC[C@@](C)(CN)C1 ZINC000261719420 327028039 /nfs/dbraw/zinc/02/80/39/327028039.db2.gz KBBHSVLPYREGSH-KDOFPFPSSA-N 1 3 268.404 3.572 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)[N@H+]1CC[C@@](C)(CN)C1 ZINC000261719420 327028040 /nfs/dbraw/zinc/02/80/40/327028040.db2.gz KBBHSVLPYREGSH-KDOFPFPSSA-N 1 3 268.404 3.572 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)N1CC[C@@](C)(C[NH3+])C1 ZINC000261719420 327028042 /nfs/dbraw/zinc/02/80/42/327028042.db2.gz KBBHSVLPYREGSH-KDOFPFPSSA-N 1 3 268.404 3.572 20 0 CHADHO C1=C(CC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCCN2)CCCC1 ZINC000093488361 327123567 /nfs/dbraw/zinc/12/35/67/327123567.db2.gz YPZCODHOTFPPOF-OKZBNKHCSA-N 1 3 276.468 3.777 20 0 CHADHO C[C@H](c1ccccc1Cl)N(C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000261567165 327142422 /nfs/dbraw/zinc/14/24/22/327142422.db2.gz HPUOHNFHOKPNHY-MCIONIFRSA-N 1 3 280.843 3.721 20 0 CHADHO CC(C)(C[NH2+]C(C1CCC1)C1CCC1)CN1CCCC1 ZINC000584295834 327225341 /nfs/dbraw/zinc/22/53/41/327225341.db2.gz RVQOKDKQVKCDJA-UHFFFAOYSA-N 1 3 278.484 3.667 20 0 CHADHO Cc1ccccc1[C@@H](C)[NH+]1CCC2(CCCN2C)CC1 ZINC000374612300 327237374 /nfs/dbraw/zinc/23/73/74/327237374.db2.gz LYNCAMQHADXSNS-MRXNPFEDSA-N 1 3 272.436 3.616 20 0 CHADHO CN1CC[C@H]2[C@H](CCC[N@@H+]2Cc2cccc3ccccc32)C1 ZINC000559504527 327251246 /nfs/dbraw/zinc/25/12/46/327251246.db2.gz FOECVVVSBUZJJK-QUCCMNQESA-N 1 3 294.442 3.756 20 0 CHADHO CN1CC[C@H]2[C@H](CCC[N@H+]2Cc2cccc3ccccc32)C1 ZINC000559504527 327251247 /nfs/dbraw/zinc/25/12/47/327251247.db2.gz FOECVVVSBUZJJK-QUCCMNQESA-N 1 3 294.442 3.756 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)c1ccc(F)c2ccccc21)CN(C)C ZINC000559859997 327265512 /nfs/dbraw/zinc/26/55/12/327265512.db2.gz VYBNDWCJZDMRLR-KBPBESRZSA-N 1 3 288.410 3.827 20 0 CHADHO C[C@@H](CN[C@@H](C)c1ccc(F)c2ccccc21)C[NH+](C)C ZINC000559859997 327265513 /nfs/dbraw/zinc/26/55/13/327265513.db2.gz VYBNDWCJZDMRLR-KBPBESRZSA-N 1 3 288.410 3.827 20 0 CHADHO CC1(C)CC[C@@H]1[NH2+]CC1CCN(Cc2cccs2)CC1 ZINC000560245689 327293009 /nfs/dbraw/zinc/29/30/09/327293009.db2.gz HUCQHLDWPCAHLH-INIZCTEOSA-N 1 3 292.492 3.738 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CC[C@@](C)(C[NH3+])C2)cc1 ZINC000261617665 327359603 /nfs/dbraw/zinc/35/96/03/327359603.db2.gz UFYLVRFYPWAYJS-YOEHRIQHSA-N 1 3 260.425 3.542 20 0 CHADHO CC(C)c1ccc([C@H](C)[N@@H+]2CC[C@@](C)(CN)C2)cc1 ZINC000261617665 327359604 /nfs/dbraw/zinc/35/96/04/327359604.db2.gz UFYLVRFYPWAYJS-YOEHRIQHSA-N 1 3 260.425 3.542 20 0 CHADHO CC(C)c1ccc([C@H](C)[N@H+]2CC[C@@](C)(CN)C2)cc1 ZINC000261617665 327359605 /nfs/dbraw/zinc/35/96/05/327359605.db2.gz UFYLVRFYPWAYJS-YOEHRIQHSA-N 1 3 260.425 3.542 20 0 CHADHO CC(C)[C@@H]1C[C@@H](C[NH2+][C@@H]2CCC[C@H](N)C2)c2ccccc21 ZINC000566484063 327394088 /nfs/dbraw/zinc/39/40/88/327394088.db2.gz ZOQFEMXJGAFIBW-GGXPGOJBSA-N 1 3 286.463 3.773 20 0 CHADHO CC[C@H]1CCC[C@H]1[NH2+]CCCN(C(C)C)C(C)C ZINC000532235228 328709634 /nfs/dbraw/zinc/70/96/34/328709634.db2.gz RMCUHAVAOIVVDK-JKSUJKDBSA-N 1 3 254.462 3.664 20 0 CHADHO FCCC[C@@H]1CCC[C@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000374603637 328994747 /nfs/dbraw/zinc/99/47/47/328994747.db2.gz NGAPDLURNCUBII-MAUKXSAKSA-N 1 3 296.474 3.901 20 0 CHADHO C[C@@H](NCCCC[NH+]1CCC(C)CC1)c1ccsc1 ZINC000178106350 329196048 /nfs/dbraw/zinc/19/60/48/329196048.db2.gz GQVJETWIODXVPR-OAHLLOKOSA-N 1 3 280.481 3.911 20 0 CHADHO CCc1nc(C)c([C@@H](C)[NH2+]CCCN2CCCCC2)s1 ZINC000178409203 329199708 /nfs/dbraw/zinc/19/97/08/329199708.db2.gz DIASZVKZGWIPAB-CYBMUJFWSA-N 1 3 295.496 3.541 20 0 CHADHO CCc1nc(C)c([C@H](C)[NH2+]CCCN2CCCCC2)s1 ZINC000178409212 329199818 /nfs/dbraw/zinc/19/98/18/329199818.db2.gz DIASZVKZGWIPAB-ZDUSSCGKSA-N 1 3 295.496 3.541 20 0 CHADHO C[C@H](NCC[C@H]1CC[NH2+]C1)c1ccc(Cl)cc1Cl ZINC000420364426 329762298 /nfs/dbraw/zinc/76/22/98/329762298.db2.gz CVUSBCULXZZLFX-WDEREUQCSA-N 1 3 287.234 3.644 20 0 CHADHO CCN(Cc1cccc(C2CC2)c1)[C@H]1CCC[NH2+]CC1 ZINC000422551178 330148971 /nfs/dbraw/zinc/14/89/71/330148971.db2.gz CYYTUGILBWPQNJ-SFHVURJKSA-N 1 3 272.436 3.528 20 0 CHADHO C[C@H](CCCC[NH3+])N[C@H](CC(F)(F)F)c1ccccc1 ZINC000422707286 330151063 /nfs/dbraw/zinc/15/10/63/330151063.db2.gz HEQWJMQJMSABBO-TZMCWYRMSA-N 1 3 288.357 3.787 20 0 CHADHO C[C@H]1CCNCC[C@H]1[NH2+]CC(C)(C)c1ccccc1Cl ZINC000422714025 330151808 /nfs/dbraw/zinc/15/18/08/330151808.db2.gz QONWDAYTDIXVCJ-XJKSGUPXSA-N 1 3 294.870 3.595 20 0 CHADHO C[C@H]1CC[NH2+]CC[C@H]1NCC(C)(C)c1ccccc1Cl ZINC000422714025 330151810 /nfs/dbraw/zinc/15/18/10/330151810.db2.gz QONWDAYTDIXVCJ-XJKSGUPXSA-N 1 3 294.870 3.595 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H](C)CCc1ccccc1 ZINC000422725603 330152396 /nfs/dbraw/zinc/15/23/96/330152396.db2.gz BYMSHIPFOLZMEE-CABCVRRESA-N 1 3 297.446 3.521 20 0 CHADHO CC[C@H](N[C@H](C)C[C@@H](C)[NH3+])c1ccc(Cl)s1 ZINC000422730323 330152464 /nfs/dbraw/zinc/15/24/64/330152464.db2.gz LZTIPJCZROWZSV-BBBLOLIVSA-N 1 3 260.834 3.568 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]CCC(c1ccccc1)c1ccccc1 ZINC000422734688 330152667 /nfs/dbraw/zinc/15/26/67/330152667.db2.gz STZILEMZZHEERK-IRXDYDNUSA-N 1 3 296.458 3.924 20 0 CHADHO Clc1ccc([C@H]([NH2+]C2CCNCC2)C2CCCC2)cc1 ZINC000422741140 330152947 /nfs/dbraw/zinc/15/29/47/330152947.db2.gz OFKVVYMIOJZWKS-QGZVFWFLSA-N 1 3 292.854 3.913 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H](C)CCC(C)(C)C ZINC000422749882 330153243 /nfs/dbraw/zinc/15/32/43/330153243.db2.gz BHZYQFRUYOMGIK-OLZOCXBDSA-N 1 3 277.456 3.714 20 0 CHADHO N[C@@H]1CCCCC[C@@H]1[NH2+]Cc1csc2ccccc12 ZINC000422752362 330153398 /nfs/dbraw/zinc/15/33/98/330153398.db2.gz DYARFAJJHVTURQ-CABCVRRESA-N 1 3 274.433 3.651 20 0 CHADHO C[C@H](N[C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1cccs1 ZINC000422766236 330153831 /nfs/dbraw/zinc/15/38/31/330153831.db2.gz RBCPHVJAWONDDL-BPUTZDHNSA-N 1 3 286.444 3.892 20 0 CHADHO CC[C@H](NCC[C@H](C)[NH3+])c1ccc(Cl)c(Cl)c1 ZINC000423231505 330180650 /nfs/dbraw/zinc/18/06/50/330180650.db2.gz LJOSPXXWKXNESM-ZANVPECISA-N 1 3 275.223 3.771 20 0 CHADHO C[C@H](CN[C@@H]1C[C@@H]([NH3+])c2ccccc21)Cc1cccs1 ZINC000422775682 330154602 /nfs/dbraw/zinc/15/46/02/330154602.db2.gz BEELQQJTJSGLTC-JCURWCKSSA-N 1 3 286.444 3.661 20 0 CHADHO C[C@@H](CCC[NH3+])N[C@@H](C)c1cc(Cl)ccc1Cl ZINC000422780586 330155027 /nfs/dbraw/zinc/15/50/27/330155027.db2.gz KKOJTZUHKNSGDQ-UWVGGRQHSA-N 1 3 275.223 3.771 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](c1ccc(F)cc1)C(C)(C)C ZINC000422787280 330155285 /nfs/dbraw/zinc/15/52/85/330155285.db2.gz UMWMPFCXKQQTIJ-HUBLWGQQSA-N 1 3 266.404 3.628 20 0 CHADHO c1ccc(C2(CN[C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)CCC2)cc1 ZINC000422802460 330155919 /nfs/dbraw/zinc/15/59/19/330155919.db2.gz BNLBVJGYWCZBIS-GUDVDZBRSA-N 1 3 298.474 3.619 20 0 CHADHO c1ccc(C2(CN[C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)CC2)cc1 ZINC000422814827 330156192 /nfs/dbraw/zinc/15/61/92/330156192.db2.gz WFAZWHDBOXHPQF-CEXWTWQISA-N 1 3 298.474 3.619 20 0 CHADHO Cc1cccc([C@H](NC2C[C@H]3CC[C@@H](C2)[NH2+]3)C(C)(C)C)c1 ZINC000422836925 330156819 /nfs/dbraw/zinc/15/68/19/330156819.db2.gz KZHVCFMZICLLIW-WFFDWFOESA-N 1 3 286.463 3.955 20 0 CHADHO CCC(CC)(CN[C@@H](C)C1C[NH2+]C1)c1ccc(Cl)cc1 ZINC000422880540 330158884 /nfs/dbraw/zinc/15/88/84/330158884.db2.gz OHIDVLMMJNOMTE-ZDUSSCGKSA-N 1 3 294.870 3.595 20 0 CHADHO CCC(CC)(C[NH2+][C@@H](C)C1CNC1)c1ccc(Cl)cc1 ZINC000422880540 330158886 /nfs/dbraw/zinc/15/88/86/330158886.db2.gz OHIDVLMMJNOMTE-ZDUSSCGKSA-N 1 3 294.870 3.595 20 0 CHADHO COc1ccc(-c2ccc(CN[C@H](C)C[C@@H](C)[NH3+])cc2)cc1 ZINC000422917559 330160257 /nfs/dbraw/zinc/16/02/57/330160257.db2.gz GHTHFJSKEILJHF-HUUCEWRRSA-N 1 3 298.430 3.578 20 0 CHADHO C[C@@H](N[C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccccc1 ZINC000422986455 330163031 /nfs/dbraw/zinc/16/30/31/330163031.db2.gz GVLNCSFTFZLYJS-MNEFBYGVSA-N 1 3 280.415 3.831 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CC1(C)CCCCCC1 ZINC000423021946 330165618 /nfs/dbraw/zinc/16/56/18/330165618.db2.gz DBEJNTKSYZSORP-CQSZACIVSA-N 1 3 289.467 3.860 20 0 CHADHO CC[C@H](CC(F)(F)F)N[C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000423037586 330166673 /nfs/dbraw/zinc/16/66/73/330166673.db2.gz MZTXQBGSVDGBEU-XQQFMLRXSA-N 1 3 280.378 3.618 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@@H]1N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423095424 330169472 /nfs/dbraw/zinc/16/94/72/330169472.db2.gz MBPDTCFRKAJCTQ-DZUCGIPZSA-N 1 3 292.854 3.836 20 0 CHADHO C[C@H](C[C@H]1CCCCC[NH2+]1)NCCc1ccc2[nH]ccc2c1 ZINC000423096653 330169740 /nfs/dbraw/zinc/16/97/40/330169740.db2.gz HXCLIBGKTHLOSW-CRAIPNDOSA-N 1 3 299.462 3.611 20 0 CHADHO CC(C)[C@@H](C[NH2+][C@H](C)C[C@H](C)N)c1ccc(Cl)cc1 ZINC000423099074 330170068 /nfs/dbraw/zinc/17/00/68/330170068.db2.gz AGAJPGMJBCBPHB-WOSRLPQWSA-N 1 3 282.859 3.795 20 0 CHADHO [NH3+][C@@H]1CCC[C@H]1N[C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000423100592 330170185 /nfs/dbraw/zinc/17/01/85/330170185.db2.gz MYUBHDWBKQKRKO-YIKOMLBNSA-N 1 3 299.245 3.709 20 0 CHADHO Cc1c2cc(Cl)ccc2sc1C[NH2+]C1CCNCC1 ZINC000423113611 330170951 /nfs/dbraw/zinc/17/09/51/330170951.db2.gz YRTDVMBIWRREDN-UHFFFAOYSA-N 1 3 294.851 3.705 20 0 CHADHO Cc1csc(CN[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC000423146390 330172441 /nfs/dbraw/zinc/17/24/41/330172441.db2.gz AMBNJBKTVVJMPK-WBVHZDCISA-N 1 3 286.444 3.639 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NCC[C@H]2CCc3ccccc32)c2ccccc21 ZINC000423146257 330172469 /nfs/dbraw/zinc/17/24/69/330172469.db2.gz OWPWDSBTCTUNKV-CDHQVMDDSA-N 1 3 292.426 3.841 20 0 CHADHO Cc1csc(CN[C@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC000423146389 330172507 /nfs/dbraw/zinc/17/25/07/330172507.db2.gz AMBNJBKTVVJMPK-RDJZCZTQSA-N 1 3 286.444 3.639 20 0 CHADHO CC(C)=CCC[C@H](C)N[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423150604 330172795 /nfs/dbraw/zinc/17/27/95/330172795.db2.gz BLKSXMAKTMGSFD-JQFCIGGWSA-N 1 3 258.409 3.856 20 0 CHADHO [NH3+][C@@H]1C[C@H](NCC2(C3CCC3)CCC2)c2ccccc21 ZINC000423162351 330173763 /nfs/dbraw/zinc/17/37/63/330173763.db2.gz KQWVDMLCBVYMQU-SJORKVTESA-N 1 3 270.420 3.691 20 0 CHADHO Clc1cccc([C@@H]2CC[C@@H]([NH2+][C@H]3CCCNCC3)C2)c1 ZINC000423165816 330173851 /nfs/dbraw/zinc/17/38/51/330173851.db2.gz QJVMJPYPRYTHHE-HYVNUMGLSA-N 1 3 292.854 3.708 20 0 CHADHO CC[C@@H]1CCCC[C@H]1C[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000423166534 330174186 /nfs/dbraw/zinc/17/41/86/330174186.db2.gz ZKKFDOHFQYFMAO-IMJJTQAJSA-N 1 3 289.467 3.716 20 0 CHADHO Clc1cccc([C@@H]2CCC[C@@H]([NH2+]C3CCNCC3)C2)c1 ZINC000423171157 330174428 /nfs/dbraw/zinc/17/44/28/330174428.db2.gz ZNNQMAWIYKTMJY-RHSMWYFYSA-N 1 3 292.854 3.708 20 0 CHADHO C[C@H](CCCc1cccnc1)N[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423171749 330174509 /nfs/dbraw/zinc/17/45/09/330174509.db2.gz PVZPFEOLTXBXDA-NIKGAXFTSA-N 1 3 295.430 3.527 20 0 CHADHO NC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000423177305 330175023 /nfs/dbraw/zinc/17/50/23/330175023.db2.gz HBSVXEHRKXKYCJ-WTTBNOFXSA-N 1 3 292.854 3.693 20 0 CHADHO Clc1cccc([C@@H]2CC[C@@H]([NH2+]C[C@@H]3CCCNC3)C2)c1 ZINC000423208249 330177449 /nfs/dbraw/zinc/17/74/49/330177449.db2.gz HOXMLRJQOBRBHF-FRFSOERESA-N 1 3 292.854 3.565 20 0 CHADHO c1ccc([C@H](NC[C@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC000423210044 330177704 /nfs/dbraw/zinc/17/77/04/330177704.db2.gz JMCOXPDMVFPEIC-YJBOKZPZSA-N 1 3 272.436 3.507 20 0 CHADHO c1ccc([C@H]([NH2+]C[C@H]2CCCNC2)C2CCCC2)cc1 ZINC000423210044 330177705 /nfs/dbraw/zinc/17/77/05/330177705.db2.gz JMCOXPDMVFPEIC-YJBOKZPZSA-N 1 3 272.436 3.507 20 0 CHADHO C[C@H](N)CC[NH2+][C@@H](Cc1ccccc1)C1CCCCC1 ZINC000423223060 330179684 /nfs/dbraw/zinc/17/96/84/330179684.db2.gz DQKQHMKTAPJWEL-YJBOKZPZSA-N 1 3 274.452 3.505 20 0 CHADHO C[C@H]([NH3+])CCN[C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423224631 330179986 /nfs/dbraw/zinc/17/99/86/330179986.db2.gz JQHLXEASRDPOKZ-XHDPSFHLSA-N 1 3 266.816 3.508 20 0 CHADHO C[C@H]([NH3+])CCN[C@@H](c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000423227289 330180425 /nfs/dbraw/zinc/18/04/25/330180425.db2.gz VEOSDHXRQISSQH-LKFCYVNXSA-N 1 3 287.234 3.771 20 0 CHADHO C[C@H]([NH3+])CCN[C@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000423227987 330180500 /nfs/dbraw/zinc/18/05/00/330180500.db2.gz XUKXRDLJNGQSKP-SWLSCSKDSA-N 1 3 266.404 3.630 20 0 CHADHO CCCCCOc1ccc([C@@H](C)NCC[C@H](C)[NH3+])cc1 ZINC000423232468 330180786 /nfs/dbraw/zinc/18/07/86/330180786.db2.gz MRTRUYLPNGAJMK-LSDHHAIUSA-N 1 3 278.440 3.644 20 0 CHADHO C[C@H](NCC[C@@H]1CC[NH2+]C1)c1cc(Cl)ccc1Cl ZINC000423249617 330182585 /nfs/dbraw/zinc/18/25/85/330182585.db2.gz PAIVBGVLWKEHBB-QWRGUYRKSA-N 1 3 287.234 3.644 20 0 CHADHO C[C@@H](NCC[C@@H]1CC[NH2+]C1)c1cc(Cl)sc1Cl ZINC000423254507 330183124 /nfs/dbraw/zinc/18/31/24/330183124.db2.gz YGWOSMNXERRBQN-BDAKNGLRSA-N 1 3 293.263 3.705 20 0 CHADHO CSc1ccccc1[C@H](C)N[C@H]1CCCC[C@@H]1C[NH3+] ZINC000423275017 330184642 /nfs/dbraw/zinc/18/46/42/330184642.db2.gz LHGFBAOIWPAIFU-GUTXKFCHSA-N 1 3 278.465 3.577 20 0 CHADHO CC[C@@H](N[C@@H](C[NH3+])C1CC1)c1ccc2cc(OC)ccc2c1 ZINC000423275882 330185175 /nfs/dbraw/zinc/18/51/75/330185175.db2.gz MGEBIRIFYCMULV-MOPGFXCFSA-N 1 3 298.430 3.626 20 0 CHADHO C[C@H](N[C@@H]1CCCC[C@H]1C[NH3+])c1csc(Cl)c1 ZINC000423278977 330185346 /nfs/dbraw/zinc/18/53/46/330185346.db2.gz QPRYHENTJQROJB-JBLDHEPKSA-N 1 3 272.845 3.570 20 0 CHADHO CC(C)[C@H]([NH3+])CN[C@H]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000423279546 330185418 /nfs/dbraw/zinc/18/54/18/330185418.db2.gz SGWSRHMTUPRFRY-VNQPRFMTSA-N 1 3 280.843 3.549 20 0 CHADHO CCC[C@@H]([NH2+]CC(C)(C)N)c1ccc(Cl)cc1 ZINC000423287913 330185968 /nfs/dbraw/zinc/18/59/68/330185968.db2.gz PHLBMPRPMMQAJA-CYBMUJFWSA-N 1 3 254.805 3.508 20 0 CHADHO CCC(N)(CC)C[NH2+][C@H](C)c1cccc(-c2ccncc2)c1 ZINC000423287227 330186135 /nfs/dbraw/zinc/18/61/35/330186135.db2.gz KYPYXPZHNKYHIB-OAHLLOKOSA-N 1 3 297.446 3.917 20 0 CHADHO Cc1cc([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)cs1 ZINC000423290963 330187254 /nfs/dbraw/zinc/18/72/54/330187254.db2.gz GBSWXXBQBRDTKB-OLZOCXBDSA-N 1 3 274.433 3.927 20 0 CHADHO CC[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccccc1 ZINC000423291691 330187473 /nfs/dbraw/zinc/18/74/73/330187473.db2.gz JLFXYRIAWFGLIW-KBXCAEBGSA-N 1 3 268.404 3.947 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2CCCc3c(O)cccc32)cc1 ZINC000423293108 330187697 /nfs/dbraw/zinc/18/76/97/330187697.db2.gz PSTVWYWNZXYSKH-SCLBCKFNSA-N 1 3 296.414 3.579 20 0 CHADHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1cc(F)cc(F)c1 ZINC000423293154 330187774 /nfs/dbraw/zinc/18/77/74/330187774.db2.gz PZWKKVQIQGNNJK-NWDGAFQWSA-N 1 3 290.357 3.835 20 0 CHADHO CCC([NH3+])(CC)CN[C@H]1CCC[C@H](c2ncccc2C)C1 ZINC000423293523 330187946 /nfs/dbraw/zinc/18/79/46/330187946.db2.gz RPROMUGPLCMDNO-HOTGVXAUSA-N 1 3 289.467 3.523 20 0 CHADHO Cc1cccc([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000423293976 330188006 /nfs/dbraw/zinc/18/80/06/330188006.db2.gz STEKPIHGFJNNLV-GJZGRUSLSA-N 1 3 268.404 3.866 20 0 CHADHO Cc1cccc([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000423293978 330188057 /nfs/dbraw/zinc/18/80/57/330188057.db2.gz STEKPIHGFJNNLV-LSDHHAIUSA-N 1 3 268.404 3.866 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@H](c2ccccc2)C2CC2)cc1 ZINC000423293415 330188109 /nfs/dbraw/zinc/18/81/09/330188109.db2.gz RHMHAMLCFWAYGL-IFXJQAMLSA-N 1 3 280.415 3.947 20 0 CHADHO C[C@@H](C[NH3+])CN[C@@H](C)c1ccc(-c2cccs2)cc1 ZINC000423304395 330189252 /nfs/dbraw/zinc/18/92/52/330189252.db2.gz YPZFAIQQMCMXDE-STQMWFEESA-N 1 3 274.433 3.661 20 0 CHADHO CC[C@@H]([NH2+]C[C@H](N)C1CC1)c1ccc(Cl)c(Cl)c1 ZINC000423312262 330189501 /nfs/dbraw/zinc/18/95/01/330189501.db2.gz DBCHQZOMPMEGQW-UONOGXRCSA-N 1 3 287.234 3.771 20 0 CHADHO C[C@H](NCC1(C)CC[NH2+]CC1)c1ccc(F)cc1Cl ZINC000423317464 330190124 /nfs/dbraw/zinc/19/01/24/330190124.db2.gz BMHYRACWSWFUGV-NSHDSACASA-N 1 3 284.806 3.519 20 0 CHADHO NC1(C[NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2)CCC1 ZINC000423324551 330190541 /nfs/dbraw/zinc/19/05/41/330190541.db2.gz KMOHMBALNJOFCY-GOSISDBHSA-N 1 3 298.405 3.581 20 0 CHADHO Fc1ccccc1[C@@H](NCC1=CC[NH2+]CC1)C1CCCC1 ZINC000423348392 330192624 /nfs/dbraw/zinc/19/26/24/330192624.db2.gz SVUKMRZVJAHNCF-SFHVURJKSA-N 1 3 288.410 3.566 20 0 CHADHO Clc1cccc([C@@H]2CCC[C@@H](NC[C@H]3CC[NH2+]C3)C2)c1 ZINC000423351872 330192761 /nfs/dbraw/zinc/19/27/61/330192761.db2.gz ZSLITBMRCFPXSN-YSVLISHTSA-N 1 3 292.854 3.565 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H](CC2CCC2)c2ccccc2)CCN1 ZINC000423362909 330193865 /nfs/dbraw/zinc/19/38/65/330193865.db2.gz ABJFTNIAMMHJLE-ZTFGCOKTSA-N 1 3 272.436 3.648 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1ccccc1C(C)(C)C ZINC000423363000 330193988 /nfs/dbraw/zinc/19/39/88/330193988.db2.gz AEFDIHZLLXPAIZ-QLFBSQMISA-N 1 3 274.452 3.775 20 0 CHADHO C[C@H]([NH2+][C@H]1CCN[C@H](C)C1)c1ccc2ccccc2c1 ZINC000423372761 330195275 /nfs/dbraw/zinc/19/52/75/330195275.db2.gz ITGJSFDGAYFCKR-GLJUWKHASA-N 1 3 268.404 3.631 20 0 CHADHO Cc1ccccc1[C@H](N[C@H]1CC[NH2+][C@@H](C)C1)C1CCCC1 ZINC000423372418 330195377 /nfs/dbraw/zinc/19/53/77/330195377.db2.gz GGVXGZXTJYURQE-VDZJLULYSA-N 1 3 286.463 3.956 20 0 CHADHO Cc1ccccc1[C@H]([NH2+][C@H]1CCN[C@@H](C)C1)C1CCCC1 ZINC000423372418 330195378 /nfs/dbraw/zinc/19/53/78/330195378.db2.gz GGVXGZXTJYURQE-VDZJLULYSA-N 1 3 286.463 3.956 20 0 CHADHO CC(C)Cc1cccc([C@H](C)[NH2+][C@H]2CCN[C@@H](C)C2)c1 ZINC000423372978 330195405 /nfs/dbraw/zinc/19/54/05/330195405.db2.gz GMUPCYMBSPODKK-MPGHIAIKSA-N 1 3 274.452 3.676 20 0 CHADHO CC1(C)Cc2occc2[C@H](NCc2ccc3c(c2)C[NH2+]C3)C1 ZINC000423401163 330196305 /nfs/dbraw/zinc/19/63/05/330196305.db2.gz VUXOJBHYWFIQIY-QGZVFWFLSA-N 1 3 296.414 3.686 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1cc2c(s1)CCCC2 ZINC000423402984 330196312 /nfs/dbraw/zinc/19/63/12/330196312.db2.gz WWSJCJJYOIPZPQ-FPMFFAJLSA-N 1 3 278.465 3.547 20 0 CHADHO CC[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1ccc(OC(F)F)cc1 ZINC000423406083 330196591 /nfs/dbraw/zinc/19/65/91/330196591.db2.gz YKTQIASOKDGXLI-YDHLFZDLSA-N 1 3 298.377 3.599 20 0 CHADHO C[C@H](NC[C@H]1CC[C@H](C[NH3+])CC1)c1ccc(F)cc1Cl ZINC000423415815 330197537 /nfs/dbraw/zinc/19/75/37/330197537.db2.gz BGWGMTACJGOIJR-AVGNSLFASA-N 1 3 298.833 3.895 20 0 CHADHO CSc1ccc([C@H](C)NCc2ccc3c(c2)C[NH2+]C3)cc1 ZINC000423375864 330198604 /nfs/dbraw/zinc/19/86/04/330198604.db2.gz IXNAZISGVHJVOU-ZDUSSCGKSA-N 1 3 298.455 3.863 20 0 CHADHO c1csc([C@@H](NCC[C@H]2CCC[NH2+]2)C2CCCC2)c1 ZINC000423375103 330198717 /nfs/dbraw/zinc/19/87/17/330198717.db2.gz XKSLIBURAKVMQQ-ZBFHGGJFSA-N 1 3 278.465 3.711 20 0 CHADHO CCc1ccc([C@H](N[C@@H]2CC[NH2+][C@@H](C)C2)C(C)C)cc1 ZINC000423378616 330199077 /nfs/dbraw/zinc/19/90/77/330199077.db2.gz MIEAGSSLVZDOHO-BMGDILEWSA-N 1 3 274.452 3.676 20 0 CHADHO CCc1ccc([C@H]([NH2+][C@@H]2CCN[C@@H](C)C2)C(C)C)cc1 ZINC000423378616 330199079 /nfs/dbraw/zinc/19/90/79/330199079.db2.gz MIEAGSSLVZDOHO-BMGDILEWSA-N 1 3 274.452 3.676 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2NCc1ccc2c(c1)C[NH2+]C2 ZINC000423382994 330199348 /nfs/dbraw/zinc/19/93/48/330199348.db2.gz KCVRQOJSWSVQAN-KUHUBIRLSA-N 1 3 292.426 3.936 20 0 CHADHO C[C@H]1CC(C)(C)CC[C@@H]1[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423381972 330199315 /nfs/dbraw/zinc/19/93/15/330199315.db2.gz JQIXWSXGMMZJCB-GUYCJALGSA-N 1 3 272.436 3.594 20 0 CHADHO C[C@H]([NH2+]Cc1ccc2c(c1)CNC2)[C@H]1CCCC[C@H]1C ZINC000423382906 330199368 /nfs/dbraw/zinc/19/93/68/330199368.db2.gz KAWWQNYOKDURPX-GLJUWKHASA-N 1 3 272.436 3.594 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)C1(c2ccccc2)CCCC1 ZINC000423383453 330199387 /nfs/dbraw/zinc/19/93/87/330199387.db2.gz PDRJRUWTOBXJEC-SOLBZPMBSA-N 1 3 286.463 3.617 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](N[C@@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000423388968 330199967 /nfs/dbraw/zinc/19/99/67/330199967.db2.gz NUVWEDFOJOTVEV-BZUAXINKSA-N 1 3 278.827 3.651 20 0 CHADHO FC(F)(F)[C@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CNC3)C1 ZINC000423389097 330200043 /nfs/dbraw/zinc/20/00/43/330200043.db2.gz NYMWIGFCMJTEEG-GJZGRUSLSA-N 1 3 298.352 3.501 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)N[C@H]1CC[NH2+][C@H](C)C1 ZINC000423387376 330200117 /nfs/dbraw/zinc/20/01/17/330200117.db2.gz SBSBFOOAMSLIAH-RYRKJORJSA-N 1 3 274.452 3.812 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)[NH2+][C@H]1CCN[C@H](C)C1 ZINC000423387376 330200118 /nfs/dbraw/zinc/20/01/18/330200118.db2.gz SBSBFOOAMSLIAH-RYRKJORJSA-N 1 3 274.452 3.812 20 0 CHADHO CCC[C@H](C)[C@H](CC)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423392294 330200210 /nfs/dbraw/zinc/20/02/10/330200210.db2.gz PXZRGWKUFSEXIT-GUYCJALGSA-N 1 3 260.425 3.594 20 0 CHADHO CC(C)[C@@H]1C[C@@H]([NH2+][C@@H]2CCN[C@H](C)C2)c2ccccc21 ZINC000423394087 330200581 /nfs/dbraw/zinc/20/05/81/330200581.db2.gz ZLYSBKLKACQZIM-KJWYOANISA-N 1 3 272.436 3.601 20 0 CHADHO C[C@@H]([NH2+]Cc1ccc2c(c1)CNC2)C1CCCCCC1 ZINC000423394321 330200648 /nfs/dbraw/zinc/20/06/48/330200648.db2.gz RELGOVUAKHUYQX-CQSZACIVSA-N 1 3 272.436 3.738 20 0 CHADHO CC[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccccc1OC ZINC000423395014 330200773 /nfs/dbraw/zinc/20/07/73/330200773.db2.gz ROECXMPCTUAPLG-SFHVURJKSA-N 1 3 296.414 3.539 20 0 CHADHO CC(C)[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1cc2ccccc2o1 ZINC000423395155 330200866 /nfs/dbraw/zinc/20/08/66/330200866.db2.gz RTHQZLVHUIAJHX-DAYGRLMNSA-N 1 3 286.419 3.989 20 0 CHADHO C[C@H](CCC[NH3+])N[C@@H](C)c1ccc(Oc2ccccc2)cn1 ZINC000423445078 330202019 /nfs/dbraw/zinc/20/20/19/330202019.db2.gz BOYSUMRUDFPUET-CABCVRRESA-N 1 3 299.418 3.652 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)c1ccc(-c2ccc(F)cc2)s1)[C@H](C)N ZINC000423449787 330202830 /nfs/dbraw/zinc/20/28/30/330202830.db2.gz SDELTIGUQTVCPK-TUAOUCFPSA-N 1 3 292.423 3.941 20 0 CHADHO C[C@@H]([NH2+][C@@H](CC1CC1)c1ccc(Cl)cc1)[C@H](C)N ZINC000423468579 330204882 /nfs/dbraw/zinc/20/48/82/330204882.db2.gz ONTPAOMUJRKMFI-RWSFTLGLSA-N 1 3 266.816 3.507 20 0 CHADHO CC[C@@H](NCCC[C@H]1CCC[NH2+]1)c1ccc(F)cc1F ZINC000423476195 330205624 /nfs/dbraw/zinc/20/56/24/330205624.db2.gz IOUKIFJHROYYSE-CZUORRHYSA-N 1 3 282.378 3.538 20 0 CHADHO C[C@H](N[C@H]1CC[C@@H](C[NH3+])C1)c1ccc(Cl)cc1Cl ZINC000423485291 330206810 /nfs/dbraw/zinc/20/68/10/330206810.db2.gz AZJXGJWJPLALGN-UMNHJUIQSA-N 1 3 287.234 3.771 20 0 CHADHO [NH3+]CCC[C@H](N[C@H]1CCc2ccccc21)c1ccccc1 ZINC000423495305 330207756 /nfs/dbraw/zinc/20/77/56/330207756.db2.gz BQFSQRIUHQTGJL-OALUTQOASA-N 1 3 280.415 3.744 20 0 CHADHO C[C@H](N[C@@H](CCC[NH3+])c1ccccc1)c1cccs1 ZINC000423510048 330209221 /nfs/dbraw/zinc/20/92/21/330209221.db2.gz RWHUHCBEVYBSEO-ZFWWWQNUSA-N 1 3 274.433 3.879 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]CCCNC1CC1 ZINC000423550950 330211702 /nfs/dbraw/zinc/21/17/02/330211702.db2.gz IUJYRCSAIRSTPX-STQMWFEESA-N 1 3 280.843 3.564 20 0 CHADHO C[C@H](C[NH2+]C[C@@H](C)c1ccc(F)cc1)CN1CCCCC1 ZINC000527116443 330223338 /nfs/dbraw/zinc/22/33/38/330223338.db2.gz JWLSFHUYUIGEIC-HZPDHXFCSA-N 1 3 292.442 3.641 20 0 CHADHO CCC(F)(F)C(C)(C)C[NH2+][C@H]1CCC[C@H](N(C)C)C1 ZINC000527670300 330269799 /nfs/dbraw/zinc/26/97/99/330269799.db2.gz NFDIDDDRGPRPKF-STQMWFEESA-N 1 3 276.415 3.520 20 0 CHADHO C[C@H]([NH2+]C1CCN(C2CCCCC2)CC1)[C@H]1CC12CC2 ZINC000527868945 330285964 /nfs/dbraw/zinc/28/59/64/330285964.db2.gz VGKPNVFRTABWEY-WMLDXEAASA-N 1 3 276.468 3.562 20 0 CHADHO C[C@@H]([NH2+]C1CCN(C2CCCCC2)CC1)[C@@H]1CC12CC2 ZINC000527868938 330285972 /nfs/dbraw/zinc/28/59/72/330285972.db2.gz VGKPNVFRTABWEY-PBHICJAKSA-N 1 3 276.468 3.562 20 0 CHADHO CC(C)[C@@H](CNC1CC(c2ccccc2)C1)[NH+]1CCCC1 ZINC000036840563 330292007 /nfs/dbraw/zinc/29/20/07/330292007.db2.gz DSCMULOFFIYQMG-CTWPCTMYSA-N 1 3 286.463 3.643 20 0 CHADHO CC(C)Cc1ccccc1CNC1CC[NH+](C2CC2)CC1 ZINC000527922592 330295893 /nfs/dbraw/zinc/29/58/93/330295893.db2.gz ZQMWBVAUYLRMQK-UHFFFAOYSA-N 1 3 286.463 3.602 20 0 CHADHO CCN(C)C[C@@H]1CC[N@@H+]([C@H](C)c2c(C)cc(C)cc2C)C1 ZINC000533011141 330324096 /nfs/dbraw/zinc/32/40/96/330324096.db2.gz TWAFCQHHZPFREM-MSOLQXFVSA-N 1 3 288.479 3.946 20 0 CHADHO CCN(C)C[C@@H]1CC[N@H+]([C@H](C)c2c(C)cc(C)cc2C)C1 ZINC000533011141 330324097 /nfs/dbraw/zinc/32/40/97/330324097.db2.gz TWAFCQHHZPFREM-MSOLQXFVSA-N 1 3 288.479 3.946 20 0 CHADHO CC[N@H+](C)C[C@@H]1CCN([C@H](C)c2c(C)cc(C)cc2C)C1 ZINC000533011141 330324098 /nfs/dbraw/zinc/32/40/98/330324098.db2.gz TWAFCQHHZPFREM-MSOLQXFVSA-N 1 3 288.479 3.946 20 0 CHADHO CC[N@@H+](C)C[C@@H]1CCN([C@H](C)c2c(C)cc(C)cc2C)C1 ZINC000533011141 330324099 /nfs/dbraw/zinc/32/40/99/330324099.db2.gz TWAFCQHHZPFREM-MSOLQXFVSA-N 1 3 288.479 3.946 20 0 CHADHO CC[C@@H](NC[C@H]1CCC[N@H+](C)C1)c1cccc(Cl)c1 ZINC000044534442 330329775 /nfs/dbraw/zinc/32/97/75/330329775.db2.gz IJKIHVIUJMJNFI-CZUORRHYSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@@H](NC[C@H]1CCC[N@@H+](C)C1)c1cccc(Cl)c1 ZINC000044534442 330329776 /nfs/dbraw/zinc/32/97/76/330329776.db2.gz IJKIHVIUJMJNFI-CZUORRHYSA-N 1 3 280.843 3.723 20 0 CHADHO CC(C)c1ccc([C@@H](C)NC[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000044535651 330329986 /nfs/dbraw/zinc/32/99/86/330329986.db2.gz JAXUZRCCVSXJBF-CVEARBPZSA-N 1 3 274.452 3.802 20 0 CHADHO CC(C)c1ccc([C@@H](C)NC[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000044535651 330329987 /nfs/dbraw/zinc/32/99/87/330329987.db2.gz JAXUZRCCVSXJBF-CVEARBPZSA-N 1 3 274.452 3.802 20 0 CHADHO C[C@H](NC[C@H]1CCC[N@H+](C)C1)c1ccc2ccccc2c1 ZINC000044535109 330330085 /nfs/dbraw/zinc/33/00/85/330330085.db2.gz GVFPGJWSLLOYAZ-JKSUJKDBSA-N 1 3 282.431 3.832 20 0 CHADHO C[C@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccc2ccccc2c1 ZINC000044535109 330330086 /nfs/dbraw/zinc/33/00/86/330330086.db2.gz GVFPGJWSLLOYAZ-JKSUJKDBSA-N 1 3 282.431 3.832 20 0 CHADHO CN1CC=C(C[NH2+][C@H](C2CCC2)C2CCCCC2)CC1 ZINC000424285668 330334098 /nfs/dbraw/zinc/33/40/98/330334098.db2.gz PEXDSRZQOSVVIN-SFHVURJKSA-N 1 3 276.468 3.587 20 0 CHADHO CC(C)(C)C1CCC([NH2+][C@@H]2CCN3CCC[C@@H]3C2)CC1 ZINC000106868908 330341441 /nfs/dbraw/zinc/34/14/41/330341441.db2.gz LZTKVVINMWYDFB-BHUNQDJPSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)[N@@H+]1CC[C@H]2[C@@H](CCCN2C)C1 ZINC000445438177 330347755 /nfs/dbraw/zinc/34/77/55/330347755.db2.gz FCSCDFJSSWCHEI-XPGWFJOJSA-N 1 3 298.474 3.652 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)[N@H+]1CC[C@H]2[C@@H](CCCN2C)C1 ZINC000445438177 330347756 /nfs/dbraw/zinc/34/77/56/330347756.db2.gz FCSCDFJSSWCHEI-XPGWFJOJSA-N 1 3 298.474 3.652 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)N1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000445438177 330347757 /nfs/dbraw/zinc/34/77/57/330347757.db2.gz FCSCDFJSSWCHEI-XPGWFJOJSA-N 1 3 298.474 3.652 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)N1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000445438177 330347758 /nfs/dbraw/zinc/34/77/58/330347758.db2.gz FCSCDFJSSWCHEI-XPGWFJOJSA-N 1 3 298.474 3.652 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)[N@@H+]1CC[C@H]2[C@H](CCCN2C)C1 ZINC000445438178 330347852 /nfs/dbraw/zinc/34/78/52/330347852.db2.gz FCSCDFJSSWCHEI-YSGRDPCXSA-N 1 3 298.474 3.652 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)[N@H+]1CC[C@H]2[C@H](CCCN2C)C1 ZINC000445438178 330347853 /nfs/dbraw/zinc/34/78/53/330347853.db2.gz FCSCDFJSSWCHEI-YSGRDPCXSA-N 1 3 298.474 3.652 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)N1CC[C@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000445438178 330347854 /nfs/dbraw/zinc/34/78/54/330347854.db2.gz FCSCDFJSSWCHEI-YSGRDPCXSA-N 1 3 298.474 3.652 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)N1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000445438178 330347855 /nfs/dbraw/zinc/34/78/55/330347855.db2.gz FCSCDFJSSWCHEI-YSGRDPCXSA-N 1 3 298.474 3.652 20 0 CHADHO CCSc1ccc([C@@H](C)[NH2+][C@@H]2CCCC[C@H]2N)cc1 ZINC000424373944 330348329 /nfs/dbraw/zinc/34/83/29/330348329.db2.gz KJCCJIHGJCSBCW-DAXOMENPSA-N 1 3 278.465 3.719 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)NCc1cc(C)ccc1F ZINC000116911903 330361268 /nfs/dbraw/zinc/36/12/68/330361268.db2.gz JDZQCDRHCCHJFE-OAHLLOKOSA-N 1 3 280.431 3.734 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](c2ccc(F)c(C)c2)C2CC2)C1 ZINC000536948472 330373202 /nfs/dbraw/zinc/37/32/02/330373202.db2.gz UMGWULUHYFZVDP-RDTXWAMCSA-N 1 3 290.426 3.517 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H](c2ccc(F)c(C)c2)C2CC2)C1 ZINC000536948472 330373203 /nfs/dbraw/zinc/37/32/03/330373203.db2.gz UMGWULUHYFZVDP-RDTXWAMCSA-N 1 3 290.426 3.517 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H](c2ccc(F)c(C)c2)C2CC2)C1 ZINC000536948472 330373204 /nfs/dbraw/zinc/37/32/04/330373204.db2.gz UMGWULUHYFZVDP-RDTXWAMCSA-N 1 3 290.426 3.517 20 0 CHADHO CC1(C)CC[C@@H]([NH2+]C2CCN(CC3CCCC3)CC2)C1 ZINC000514756939 330464195 /nfs/dbraw/zinc/46/41/95/330464195.db2.gz WUDAGSDCVXAOMK-QGZVFWFLSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@H]1CC[C@@H](C)c2ccsc21 ZINC000453083311 331087543 /nfs/dbraw/zinc/08/75/43/331087543.db2.gz IDHOQTXFPCPBOV-BZPMIXESSA-N 1 3 266.454 3.616 20 0 CHADHO CC[C@@H](NCCCC[N@H+](C)C1CC1)c1ccc(F)cc1F ZINC000453419384 331130524 /nfs/dbraw/zinc/13/05/24/331130524.db2.gz ZAVZMXLISXUYKZ-QGZVFWFLSA-N 1 3 296.405 3.880 20 0 CHADHO CC[C@@H](NCCCC[N@@H+](C)C1CC1)c1ccc(F)cc1F ZINC000453419384 331130525 /nfs/dbraw/zinc/13/05/25/331130525.db2.gz ZAVZMXLISXUYKZ-QGZVFWFLSA-N 1 3 296.405 3.880 20 0 CHADHO C[N@H+](CCCCNCc1ccc(-c2ccccc2)o1)C1CC1 ZINC000453598630 331135685 /nfs/dbraw/zinc/13/56/85/331135685.db2.gz PVVUGCAOWOOYCD-UHFFFAOYSA-N 1 3 298.430 3.911 20 0 CHADHO C[N@@H+](CCCCNCc1ccc(-c2ccccc2)o1)C1CC1 ZINC000453598630 331135686 /nfs/dbraw/zinc/13/56/86/331135686.db2.gz PVVUGCAOWOOYCD-UHFFFAOYSA-N 1 3 298.430 3.911 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)CCc2cccc(Cl)c2)C[C@@H]1C ZINC000459385503 331279362 /nfs/dbraw/zinc/27/93/62/331279362.db2.gz YPNDSKUYMQCEET-WMLDXEAASA-N 1 3 294.870 3.687 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)CCc2cccc(Cl)c2)C[C@@H]1C ZINC000459385503 331279363 /nfs/dbraw/zinc/27/93/63/331279363.db2.gz YPNDSKUYMQCEET-WMLDXEAASA-N 1 3 294.870 3.687 20 0 CHADHO CCCC[NH+]1CCC(NCCc2cccc(Cl)c2)CC1 ZINC000459401856 331280083 /nfs/dbraw/zinc/28/00/83/331280083.db2.gz YNURAISXLMVIDB-UHFFFAOYSA-N 1 3 294.870 3.737 20 0 CHADHO c1cc(N2CCC([NH2+][C@@H]3CC[C@@H]4CCC[C@@H]4C3)CC2)ccn1 ZINC000459419799 331280506 /nfs/dbraw/zinc/28/05/06/331280506.db2.gz XJQOFCNJEVNXJD-LZLYRXPVSA-N 1 3 299.462 3.609 20 0 CHADHO CC1(C)[C@@H](CN[C@@H]2CC[N@@H+]3CCC[C@H]3C2)[C@@H]1c1ccccc1 ZINC000459724449 331295872 /nfs/dbraw/zinc/29/58/72/331295872.db2.gz YSLFIJXYYHYBQG-XWSJACJDSA-N 1 3 298.474 3.643 20 0 CHADHO CC1(C)[C@@H](CN[C@@H]2CC[N@H+]3CCC[C@H]3C2)[C@@H]1c1ccccc1 ZINC000459724449 331295873 /nfs/dbraw/zinc/29/58/73/331295873.db2.gz YSLFIJXYYHYBQG-XWSJACJDSA-N 1 3 298.474 3.643 20 0 CHADHO C[C@@H]([NH3+])C1CCN(Cc2ccc(C(C)(C)C)s2)CC1 ZINC000166172734 331306675 /nfs/dbraw/zinc/30/66/75/331306675.db2.gz JMOIOLIMWGOSEB-GFCCVEGCSA-N 1 3 280.481 3.605 20 0 CHADHO Cc1cccc2c1ncc(C)c2NC1CC[NH+](C(C)C)CC1 ZINC000462443022 331322133 /nfs/dbraw/zinc/32/21/33/331322133.db2.gz WMHKEWITPBZRSZ-UHFFFAOYSA-N 1 3 297.446 3.558 20 0 CHADHO CC[NH+](CC)CC1CCN(c2ccnc3ccccc32)CC1 ZINC000462789639 331329267 /nfs/dbraw/zinc/32/92/67/331329267.db2.gz KNMVAEQQUKWXLD-UHFFFAOYSA-N 1 3 297.446 3.793 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)C(C)(C)c1ccccc1 ZINC000484485114 331899758 /nfs/dbraw/zinc/89/97/58/331899758.db2.gz IWMPBTGSFNZQNY-JQHSSLGASA-N 1 3 288.479 3.815 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]([NH2+][C@H]3CCN4CCC[C@H]4C3)C2)cc1 ZINC000488364964 332002149 /nfs/dbraw/zinc/00/21/49/332002149.db2.gz ICXIXLMEUNXKON-FYQPLNBISA-N 1 3 298.474 3.929 20 0 CHADHO c1ccc([C@@H]2CCC[C@H](N[C@H]3CC[N@@H+]4CCC[C@H]4C3)C2)cc1 ZINC000488364964 332002150 /nfs/dbraw/zinc/00/21/50/332002150.db2.gz ICXIXLMEUNXKON-FYQPLNBISA-N 1 3 298.474 3.929 20 0 CHADHO c1ccc([C@@H]2CCC[C@H](N[C@H]3CC[N@H+]4CCC[C@H]4C3)C2)cc1 ZINC000488364964 332002151 /nfs/dbraw/zinc/00/21/51/332002151.db2.gz ICXIXLMEUNXKON-FYQPLNBISA-N 1 3 298.474 3.929 20 0 CHADHO C[NH+](C)CC1CCN([C@H]2CCc3c2cccc3Cl)CC1 ZINC000488453719 332010969 /nfs/dbraw/zinc/01/09/69/332010969.db2.gz XIJDZQXOTJMYRR-KRWDZBQOSA-N 1 3 292.854 3.601 20 0 CHADHO CN(C[C@H]1CCC[N@H+](C)C1)[C@H]1CCc2c1cccc2Cl ZINC000489839740 332069825 /nfs/dbraw/zinc/06/98/25/332069825.db2.gz UWZBWUQRUGSDPK-GUYCJALGSA-N 1 3 292.854 3.601 20 0 CHADHO CN(C[C@H]1CCC[N@@H+](C)C1)[C@H]1CCc2c1cccc2Cl ZINC000489839740 332069826 /nfs/dbraw/zinc/06/98/26/332069826.db2.gz UWZBWUQRUGSDPK-GUYCJALGSA-N 1 3 292.854 3.601 20 0 CHADHO CC[N@@H+]1CC[C@@H](N[C@H]2CCCc3ccc(C)cc32)[C@@H](C)C1 ZINC000490399495 332088258 /nfs/dbraw/zinc/08/82/58/332088258.db2.gz KNWOXNDLGGOMIV-IPELMVKDSA-N 1 3 286.463 3.692 20 0 CHADHO CC[N@H+]1CC[C@@H](N[C@H]2CCCc3ccc(C)cc32)[C@@H](C)C1 ZINC000490399495 332088260 /nfs/dbraw/zinc/08/82/60/332088260.db2.gz KNWOXNDLGGOMIV-IPELMVKDSA-N 1 3 286.463 3.692 20 0 CHADHO C[C@H](CC[NH2+][C@H]1CC[C@@H]1C(C)(C)C)N1CCCCC1 ZINC000566382216 334645715 /nfs/dbraw/zinc/64/57/15/334645715.db2.gz IRZKOXBLXLTGIH-PMPSAXMXSA-N 1 3 266.473 3.665 20 0 CHADHO C/C(=C/c1ccc(Cl)cc1)CN[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000513525196 333024037 /nfs/dbraw/zinc/02/40/37/333024037.db2.gz JWUDVCSDMFTHDG-URPBKQNGSA-N 1 3 292.854 3.816 20 0 CHADHO C/C(=C/c1ccc(Cl)cc1)CN[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000513525196 333024038 /nfs/dbraw/zinc/02/40/38/333024038.db2.gz JWUDVCSDMFTHDG-URPBKQNGSA-N 1 3 292.854 3.816 20 0 CHADHO c1ccc(CN2C[C@@H]3CCCC[C@H]([NH2+]C4CCC4)[C@H]3C2)cc1 ZINC000513656743 333029800 /nfs/dbraw/zinc/02/98/00/333029800.db2.gz XBWNRRMEQNUSPT-IHPCNDPISA-N 1 3 298.474 3.819 20 0 CHADHO CC[C@H](C)C[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000309878674 333050581 /nfs/dbraw/zinc/05/05/81/333050581.db2.gz VDLVGKRSNXWFRE-PKOBYXMFSA-N 1 3 288.479 3.924 20 0 CHADHO CN(C)C1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000513969936 333056573 /nfs/dbraw/zinc/05/65/73/333056573.db2.gz GUSCPMTWHQWVCI-UHFFFAOYSA-N 1 3 294.442 3.802 20 0 CHADHO CC(C)[C@H]1C[C@@H](N[C@H](C)CC[NH+](C)C)c2ccccc21 ZINC000516906725 333086031 /nfs/dbraw/zinc/08/60/31/333086031.db2.gz QEWYSCPVCVPZTI-ZTFGCOKTSA-N 1 3 274.452 3.801 20 0 CHADHO CC(C)C[C@H](C[NH2+][C@H](C)C[C@H](C)N)c1ccccc1 ZINC000517371886 333098150 /nfs/dbraw/zinc/09/81/50/333098150.db2.gz JWZYDMXITKDJRG-ZMSDIMECSA-N 1 3 262.441 3.532 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@H](C)C2CCCCCC2)C1 ZINC000517439398 333099463 /nfs/dbraw/zinc/09/94/63/333099463.db2.gz WVHFOVUHAAVWAL-CVEARBPZSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)(C)[NH+]1CCC(NC2(Cc3ccccc3)CC2)CC1 ZINC000186584757 333163358 /nfs/dbraw/zinc/16/33/58/333163358.db2.gz XXIJRXPYCOWGDL-UHFFFAOYSA-N 1 3 286.463 3.614 20 0 CHADHO C[C@H]([NH2+]CCCN(C)C1CCCCC1)C1CCSCC1 ZINC000186961143 333166859 /nfs/dbraw/zinc/16/68/59/333166859.db2.gz QRJROJLNIANKNL-HNNXBMFYSA-N 1 3 298.540 3.762 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](N[C@@H]2CCSc3ccc(Cl)cc32)C1 ZINC000222947683 333202844 /nfs/dbraw/zinc/20/28/44/333202844.db2.gz JUWYTVCXPPRVCT-MBNYWOFBSA-N 1 3 296.867 3.736 20 0 CHADHO C[C@H](CC1CCCCC1)[NH2+][C@@H]1CCN2CCC[C@@H]2C1 ZINC000194251891 333267820 /nfs/dbraw/zinc/26/78/20/333267820.db2.gz UROLOEPFRDYNNB-DJIMGWMZSA-N 1 3 264.457 3.562 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](N[C@H](c2cccs2)C2CCCC2)C1 ZINC000227474847 333283474 /nfs/dbraw/zinc/28/34/74/333283474.db2.gz MEGUKERRJXGUAX-FMKPAKJESA-N 1 3 278.465 3.839 20 0 CHADHO C[C@H](CCN[C@H]1C[C@@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000227540570 333285612 /nfs/dbraw/zinc/28/56/12/333285612.db2.gz HSFJZLSDYLZSLM-ZMYBRWDISA-N 1 3 280.415 3.915 20 0 CHADHO [NH3+]C[C@@H]1CCC[C@H]1N[C@H]1CCSc2ccc(Cl)cc21 ZINC000250041957 333301688 /nfs/dbraw/zinc/30/16/88/333301688.db2.gz YCFNZGPQHDLEKD-GDLCADMTSA-N 1 3 296.867 3.594 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](C)c2cc3c(s2)CCCC3)C1 ZINC000250227642 333303583 /nfs/dbraw/zinc/30/35/83/333303583.db2.gz FRSUAOLFQDGFSB-ZIAGYGMSSA-N 1 3 292.492 3.619 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](C)c2cc3c(s2)CCCC3)C1 ZINC000250227642 333303585 /nfs/dbraw/zinc/30/35/85/333303585.db2.gz FRSUAOLFQDGFSB-ZIAGYGMSSA-N 1 3 292.492 3.619 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](C)c2cc3c(s2)CCCC3)C1 ZINC000250227642 333303586 /nfs/dbraw/zinc/30/35/86/333303586.db2.gz FRSUAOLFQDGFSB-ZIAGYGMSSA-N 1 3 292.492 3.619 20 0 CHADHO C[C@H](Cc1ccccc1F)[NH2+]CCCN1CCCC[C@@H]1C ZINC000229555574 333306154 /nfs/dbraw/zinc/30/61/54/333306154.db2.gz DQIXJTBJPUEBKE-CVEARBPZSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@H](Cc1ccccc1F)NCCC[N@@H+]1CCCC[C@@H]1C ZINC000229555574 333306155 /nfs/dbraw/zinc/30/61/55/333306155.db2.gz DQIXJTBJPUEBKE-CVEARBPZSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@H](Cc1ccccc1F)NCCC[N@H+]1CCCC[C@@H]1C ZINC000229555574 333306156 /nfs/dbraw/zinc/30/61/56/333306156.db2.gz DQIXJTBJPUEBKE-CVEARBPZSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@H]1CC(C)(C)C[C@H]1[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000235573984 333370961 /nfs/dbraw/zinc/37/09/61/333370961.db2.gz IAFRWLKTRUUBAS-GXTWGEPZSA-N 1 3 266.473 3.710 20 0 CHADHO CCN(C)C[C@H]1CC[N@H+](Cc2ccc3ccccc3c2)C1 ZINC000173898151 335142935 /nfs/dbraw/zinc/14/29/35/335142935.db2.gz JIGAXFJXUIQXKY-QGZVFWFLSA-N 1 3 282.431 3.613 20 0 CHADHO CCN(C)C[C@H]1CC[N@@H+](Cc2ccc3ccccc3c2)C1 ZINC000173898151 335142936 /nfs/dbraw/zinc/14/29/36/335142936.db2.gz JIGAXFJXUIQXKY-QGZVFWFLSA-N 1 3 282.431 3.613 20 0 CHADHO CC(C)C[C@@H](C)[NH2+][C@@H](C)c1ccc(OCCN(C)C)cc1 ZINC000539048964 333651305 /nfs/dbraw/zinc/65/13/05/333651305.db2.gz HOJVQLUKYNKEDQ-CVEARBPZSA-N 1 3 292.467 3.712 20 0 CHADHO C[C@H](C[NH2+]Cc1cccc(CN(C)C)c1)Cc1ccccc1 ZINC000541588896 333782609 /nfs/dbraw/zinc/78/26/09/333782609.db2.gz ZUSKHZMEWUOMHR-KRWDZBQOSA-N 1 3 296.458 3.717 20 0 CHADHO Cc1ccc(-c2cccc(CNC3CC[NH+](C)CC3)c2)cc1 ZINC000133647198 334048938 /nfs/dbraw/zinc/04/89/38/334048938.db2.gz DWORMWUBZOKEHQ-UHFFFAOYSA-N 1 3 294.442 3.846 20 0 CHADHO CCCC[C@H](CC)C[N@@H+]1CC[C@H]2[C@H](CCCN2C)C1 ZINC000546930628 334055726 /nfs/dbraw/zinc/05/57/26/334055726.db2.gz KQYQNGCBZOSJPC-BBWFWOEESA-N 1 3 266.473 3.619 20 0 CHADHO CCCC[C@H](CC)C[N@H+]1CC[C@H]2[C@H](CCCN2C)C1 ZINC000546930628 334055728 /nfs/dbraw/zinc/05/57/28/334055728.db2.gz KQYQNGCBZOSJPC-BBWFWOEESA-N 1 3 266.473 3.619 20 0 CHADHO CC1=CCC[C@@H](C)[C@@H]1C[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000134015153 334077707 /nfs/dbraw/zinc/07/77/07/334077707.db2.gz JXCXAJMUPYGMHK-NVXWUHKLSA-N 1 3 278.484 3.831 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN([C@@H](CC)c2ccccc2)C1 ZINC000081570262 334197370 /nfs/dbraw/zinc/19/73/70/334197370.db2.gz GBMQPWYONNCEER-WMZOPIPTSA-N 1 3 274.452 3.801 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN([C@@H](CC)c2ccccc2)C1 ZINC000081570262 334197371 /nfs/dbraw/zinc/19/73/71/334197371.db2.gz GBMQPWYONNCEER-WMZOPIPTSA-N 1 3 274.452 3.801 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+]([C@@H](CC)c2ccccc2)C1 ZINC000081570262 334197373 /nfs/dbraw/zinc/19/73/73/334197373.db2.gz GBMQPWYONNCEER-WMZOPIPTSA-N 1 3 274.452 3.801 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+]([C@@H](CC)c2ccccc2)C1 ZINC000081570262 334197374 /nfs/dbraw/zinc/19/73/74/334197374.db2.gz GBMQPWYONNCEER-WMZOPIPTSA-N 1 3 274.452 3.801 20 0 CHADHO C[C@@H](NC[C@H]1CCC[N@H+](C)C1)c1cccc(C2CC2)c1 ZINC000551050628 334237192 /nfs/dbraw/zinc/23/71/92/334237192.db2.gz JKAHUXPTOMLHHN-HUUCEWRRSA-N 1 3 272.436 3.556 20 0 CHADHO C[C@@H](NC[C@H]1CCC[N@@H+](C)C1)c1cccc(C2CC2)c1 ZINC000551050628 334237193 /nfs/dbraw/zinc/23/71/93/334237193.db2.gz JKAHUXPTOMLHHN-HUUCEWRRSA-N 1 3 272.436 3.556 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+]([C@H](C)c2cccc(C)c2)C1 ZINC000246222456 334242164 /nfs/dbraw/zinc/24/21/64/334242164.db2.gz PGBSUJGQNUZRHL-IAGOWNOFSA-N 1 3 274.452 3.720 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+]([C@H](C)c2cccc(C)c2)C1 ZINC000246222456 334242165 /nfs/dbraw/zinc/24/21/65/334242165.db2.gz PGBSUJGQNUZRHL-IAGOWNOFSA-N 1 3 274.452 3.720 20 0 CHADHO C[C@@H]1C[C@H](N[C@H](c2ccc(F)cc2)C2CCC2)CC[N@@H+]1C ZINC000247129760 334276273 /nfs/dbraw/zinc/27/62/73/334276273.db2.gz VJGSYXYIDXRCRA-XWIAVFTESA-N 1 3 290.426 3.739 20 0 CHADHO C[C@@H]1C[C@H](N[C@H](c2ccc(F)cc2)C2CCC2)CC[N@H+]1C ZINC000247129760 334276275 /nfs/dbraw/zinc/27/62/75/334276275.db2.gz VJGSYXYIDXRCRA-XWIAVFTESA-N 1 3 290.426 3.739 20 0 CHADHO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)cc1 ZINC000246837894 334270358 /nfs/dbraw/zinc/27/03/58/334270358.db2.gz BKSRYIRGCOMKHI-USXIJHARSA-N 1 3 290.451 3.609 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H]2[C@H](C)CCC[C@@H]2C)C1 ZINC000246890632 334271419 /nfs/dbraw/zinc/27/14/19/334271419.db2.gz DSBLMZVARJDDFT-VVLHAWIVSA-N 1 3 266.473 3.521 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H](C)c2cccc(C)c2C)C1 ZINC000247196173 334277453 /nfs/dbraw/zinc/27/74/53/334277453.db2.gz WBFDNUFEZKKSKL-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H](C)c2cccc(C)c2C)C1 ZINC000247196173 334277455 /nfs/dbraw/zinc/27/74/55/334277455.db2.gz WBFDNUFEZKKSKL-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](C)c2cccc(C)c2C)C1 ZINC000247196173 334277456 /nfs/dbraw/zinc/27/74/56/334277456.db2.gz WBFDNUFEZKKSKL-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO C[C@H](c1cc2ccccc2o1)[N@H+](C)CC[C@H]1CCCN1C ZINC000247446547 334281614 /nfs/dbraw/zinc/28/16/14/334281614.db2.gz YFYOXQADFFOHCO-GDBMZVCRSA-N 1 3 286.419 3.910 20 0 CHADHO C[C@H](c1cc2ccccc2o1)[N@@H+](C)CC[C@H]1CCCN1C ZINC000247446547 334281616 /nfs/dbraw/zinc/28/16/16/334281616.db2.gz YFYOXQADFFOHCO-GDBMZVCRSA-N 1 3 286.419 3.910 20 0 CHADHO CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1C=CCCC1 ZINC000247529787 334284396 /nfs/dbraw/zinc/28/43/96/334284396.db2.gz OCOMCFQUCYFCEC-RTBURBONSA-N 1 3 284.447 3.549 20 0 CHADHO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1C=CCCC1 ZINC000247529787 334284397 /nfs/dbraw/zinc/28/43/97/334284397.db2.gz OCOMCFQUCYFCEC-RTBURBONSA-N 1 3 284.447 3.549 20 0 CHADHO CC(C)c1ccc(CN[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@@H]32)cc1 ZINC000552247720 334308153 /nfs/dbraw/zinc/30/81/53/334308153.db2.gz YGDQLFSZYRNRKZ-GUDVDZBRSA-N 1 3 286.463 3.772 20 0 CHADHO CC(C)c1ccc(CN[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@@H]32)cc1 ZINC000552247720 334308155 /nfs/dbraw/zinc/30/81/55/334308155.db2.gz YGDQLFSZYRNRKZ-GUDVDZBRSA-N 1 3 286.463 3.772 20 0 CHADHO CC(C)CN1CCC[C@@H](C[NH2+][C@H](C)CCC2CC2)C1 ZINC000248992148 334323923 /nfs/dbraw/zinc/32/39/23/334323923.db2.gz LHCAPZSCEDURTJ-WBVHZDCISA-N 1 3 266.473 3.523 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](C)c2cc(C)c(C)cc2C)C1 ZINC000249382060 334332841 /nfs/dbraw/zinc/33/28/41/334332841.db2.gz TXXDJRJBDZNRTP-SJORKVTESA-N 1 3 274.452 3.604 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](C)c2cc(C)c(C)cc2C)C1 ZINC000249382060 334332842 /nfs/dbraw/zinc/33/28/42/334332842.db2.gz TXXDJRJBDZNRTP-SJORKVTESA-N 1 3 274.452 3.604 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](C)c2cc(C)c(C)cc2C)C1 ZINC000249382060 334332843 /nfs/dbraw/zinc/33/28/43/334332843.db2.gz TXXDJRJBDZNRTP-SJORKVTESA-N 1 3 274.452 3.604 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](C)c2ccc(C(C)C)cc2)C1 ZINC000249383002 334332897 /nfs/dbraw/zinc/33/28/97/334332897.db2.gz VKYOMCKVEQZLCI-HZPDHXFCSA-N 1 3 274.452 3.802 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](C)c2ccc(C(C)C)cc2)C1 ZINC000249383002 334332899 /nfs/dbraw/zinc/33/28/99/334332899.db2.gz VKYOMCKVEQZLCI-HZPDHXFCSA-N 1 3 274.452 3.802 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](C)c2ccc(C(C)C)cc2)C1 ZINC000249383002 334332900 /nfs/dbraw/zinc/33/29/00/334332900.db2.gz VKYOMCKVEQZLCI-HZPDHXFCSA-N 1 3 274.452 3.802 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](C)c2ccc(C(C)C)cc2)C1 ZINC000249382999 334332971 /nfs/dbraw/zinc/33/29/71/334332971.db2.gz VKYOMCKVEQZLCI-CVEARBPZSA-N 1 3 274.452 3.802 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](C)c2ccc(C(C)C)cc2)C1 ZINC000249382999 334332972 /nfs/dbraw/zinc/33/29/72/334332972.db2.gz VKYOMCKVEQZLCI-CVEARBPZSA-N 1 3 274.452 3.802 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](C)c2ccc(C(C)C)cc2)C1 ZINC000249382999 334332974 /nfs/dbraw/zinc/33/29/74/334332974.db2.gz VKYOMCKVEQZLCI-CVEARBPZSA-N 1 3 274.452 3.802 20 0 CHADHO CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCN2CCC[C@H]2C1 ZINC000250689121 334348681 /nfs/dbraw/zinc/34/86/81/334348681.db2.gz INPYPYTZPSAZOS-NXOAAHMSSA-N 1 3 278.484 3.808 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCN2CCC[C@H]2C1)C1CCCCC1 ZINC000251296229 334359538 /nfs/dbraw/zinc/35/95/38/334359538.db2.gz AQMYUEGIVPUNSN-ULQDDVLXSA-N 1 3 264.457 3.562 20 0 CHADHO C[C@H](N[C@@H]1CCCC[C@H]1C[NH3+])c1cc2ccccc2o1 ZINC000251495528 334362340 /nfs/dbraw/zinc/36/23/40/334362340.db2.gz JVMHEHHAKIOWMS-AEGPPILISA-N 1 3 272.392 3.601 20 0 CHADHO C[C@@H](c1ccc(C(C)(C)C)cc1)N1CC[C@@H]([NH3+])[C@H](C)C1 ZINC000251538947 334363712 /nfs/dbraw/zinc/36/37/12/334363712.db2.gz ARIDXTVOXOLPDO-JKIFEVAISA-N 1 3 274.452 3.714 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](C)CC(C)(C)c2ccccc2)C1 ZINC000252440251 334379949 /nfs/dbraw/zinc/37/99/49/334379949.db2.gz YYVXTJHGSQVJDT-SJORKVTESA-N 1 3 288.479 3.674 20 0 CHADHO CC(C)(C[NH2+][C@@H]1CCC[C@@H](N)C1)Cc1cccc(Cl)c1 ZINC000568249313 334808606 /nfs/dbraw/zinc/80/86/06/334808606.db2.gz NLPFKLZMDNSYIY-HZPDHXFCSA-N 1 3 294.870 3.768 20 0 CHADHO CN(C)C[C@H]1CC[N@H+](Cc2ccc(C3CCCC3)cc2)C1 ZINC000577676396 335387734 /nfs/dbraw/zinc/38/77/34/335387734.db2.gz CPCBZQARKPLPKP-QGZVFWFLSA-N 1 3 286.463 3.728 20 0 CHADHO CN(C)C[C@H]1CC[N@@H+](Cc2ccc(C3CCCC3)cc2)C1 ZINC000577676396 335387735 /nfs/dbraw/zinc/38/77/35/335387735.db2.gz CPCBZQARKPLPKP-QGZVFWFLSA-N 1 3 286.463 3.728 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCc1ccc(-c2cccc(F)c2)s1 ZINC000579121823 335712545 /nfs/dbraw/zinc/71/25/45/335712545.db2.gz FQNNEAFJUBZGOK-NWDGAFQWSA-N 1 3 292.423 3.770 20 0 CHADHO C[C@@H](NCc1ccc(C[NH3+])cc1)c1cccc(C2CC2)c1 ZINC000580774710 335965410 /nfs/dbraw/zinc/96/54/10/335965410.db2.gz DCWBZXBZZDCFRI-CQSZACIVSA-N 1 3 280.415 3.874 20 0 CHADHO Cc1cc([C@@H](C)[NH2+]C[C@H](C)CN2CCCCC2)cs1 ZINC000381358967 336060224 /nfs/dbraw/zinc/06/02/24/336060224.db2.gz JVQQHNWSMZDFAK-DZGCQCFKSA-N 1 3 280.481 3.829 20 0 CHADHO CC(C)(C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCCN1)C1CCC1 ZINC000385029570 336135965 /nfs/dbraw/zinc/13/59/65/336135965.db2.gz KFSYCGIAXSQPKJ-GVDBMIGSSA-N 1 3 278.484 3.713 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H](C)c2cccc(F)c2)C1 ZINC000125944429 519678080 /nfs/dbraw/zinc/67/80/80/519678080.db2.gz DAAMAGIQCOKUIR-LSDHHAIUSA-N 1 3 278.415 3.597 20 0 CHADHO Cc1ccc2c(c1)[C@H](NC1CC[NH+](C(C)C)CC1)CCC2 ZINC000352612034 534448900 /nfs/dbraw/zinc/44/89/00/534448900.db2.gz MAKKCBJTXWVLEG-LJQANCHMSA-N 1 3 286.463 3.835 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N[C@@H](C)c1cccnc1Cl ZINC000131278084 520637212 /nfs/dbraw/zinc/63/72/12/520637212.db2.gz WVVMVMNHVVZDNB-KBPBESRZSA-N 1 3 297.874 3.896 20 0 CHADHO CC[NH+](CC)Cc1ccccc1CNCc1ccsc1 ZINC000020129478 520760392 /nfs/dbraw/zinc/76/03/92/520760392.db2.gz IHXJOGJEDXHIDY-UHFFFAOYSA-N 1 3 288.460 3.880 20 0 CHADHO CC[NH+](CC)Cc1ccccc1CN[C@@H](C)c1cccnc1 ZINC000120446224 520760697 /nfs/dbraw/zinc/76/06/97/520760697.db2.gz DOJJUHXMEUTVER-INIZCTEOSA-N 1 3 297.446 3.774 20 0 CHADHO CC[C@H](N[C@@H](C)CC[NH+](C)C)c1ccc(Cl)cc1 ZINC000049553195 522687072 /nfs/dbraw/zinc/68/70/72/522687072.db2.gz NPGCBGOBYVFACL-WFASDCNBSA-N 1 3 268.832 3.721 20 0 CHADHO CC[C@H](c1ccccc1)[N@@H+]1CCC[C@H](N(C)C)CC1 ZINC000277099004 522944387 /nfs/dbraw/zinc/94/43/87/522944387.db2.gz GIZWALAZHMFSLN-DLBZAZTESA-N 1 3 260.425 3.554 20 0 CHADHO CC[C@H](c1ccccc1)[N@H+]1CCC[C@H](N(C)C)CC1 ZINC000277099004 522944392 /nfs/dbraw/zinc/94/43/92/522944392.db2.gz GIZWALAZHMFSLN-DLBZAZTESA-N 1 3 260.425 3.554 20 0 CHADHO CC[C@H](c1ccccc1)N1CCC[C@H]([NH+](C)C)CC1 ZINC000277099004 522944398 /nfs/dbraw/zinc/94/43/98/522944398.db2.gz GIZWALAZHMFSLN-DLBZAZTESA-N 1 3 260.425 3.554 20 0 CHADHO C[C@H](CN[C@H]1C[C@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000157274846 524506219 /nfs/dbraw/zinc/50/62/19/524506219.db2.gz QWNBHUWNJIZEIK-BVGQSLNGSA-N 1 3 266.388 3.525 20 0 CHADHO C[C@@H]([NH2+]C/C=C/c1ccccc1)[C@@H]1CCCN(C2CCC2)C1 ZINC000299105761 525392703 /nfs/dbraw/zinc/39/27/03/525392703.db2.gz VCMVFYMPGZATAM-LVJUENIKSA-N 1 3 298.474 3.942 20 0 CHADHO c1cc(N2CCC([NH2+]C3CCCCCCC3)CC2)ccn1 ZINC000037374137 526431065 /nfs/dbraw/zinc/43/10/65/526431065.db2.gz WKDYYZAYSVDPFT-UHFFFAOYSA-N 1 3 287.451 3.753 20 0 CHADHO c1ccc2c(c1)CCCC[C@H]2NC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000037649276 526501291 /nfs/dbraw/zinc/50/12/91/526501291.db2.gz VUVJMDHBDMLYCS-HNAYVOBHSA-N 1 3 284.447 3.528 20 0 CHADHO c1ccc2c(c1)CCCC[C@H]2NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000037649276 526501295 /nfs/dbraw/zinc/50/12/95/526501295.db2.gz VUVJMDHBDMLYCS-HNAYVOBHSA-N 1 3 284.447 3.528 20 0 CHADHO c1ccc2c(c1)CCCC[C@@H]2NC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000037649277 526501359 /nfs/dbraw/zinc/50/13/59/526501359.db2.gz VUVJMDHBDMLYCS-BEFAXECRSA-N 1 3 284.447 3.528 20 0 CHADHO c1ccc2c(c1)CCCC[C@@H]2NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000037649277 526501365 /nfs/dbraw/zinc/50/13/65/526501365.db2.gz VUVJMDHBDMLYCS-BEFAXECRSA-N 1 3 284.447 3.528 20 0 CHADHO N[C@H]1C[C@H]([NH2+]CCc2ccc(Cl)s2)c2ccccc21 ZINC000226344409 527418684 /nfs/dbraw/zinc/41/86/84/527418684.db2.gz JUBFIKAMAGJTDX-KBPBESRZSA-N 1 3 292.835 3.678 20 0 CHADHO C(N1CCC([NH+]2CCCCC2)CC1)C12CCC(CC1)C2 ZINC000347734890 527488995 /nfs/dbraw/zinc/48/89/95/527488995.db2.gz IRNPOZBABGTOCZ-UHFFFAOYSA-N 1 3 276.468 3.517 20 0 CHADHO C([NH+]1CCC(N2CCCCC2)CC1)C12CCC(CC1)C2 ZINC000347734890 527489000 /nfs/dbraw/zinc/48/90/00/527489000.db2.gz IRNPOZBABGTOCZ-UHFFFAOYSA-N 1 3 276.468 3.517 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2ccc3occc3c2)[C@H](C)C1 ZINC000347862863 527755413 /nfs/dbraw/zinc/75/54/13/527755413.db2.gz WVRFIPOJNSEWCG-RHSMWYFYSA-N 1 3 286.419 3.595 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2ccc3occc3c2)[C@H](C)C1 ZINC000347862863 527755420 /nfs/dbraw/zinc/75/54/20/527755420.db2.gz WVRFIPOJNSEWCG-RHSMWYFYSA-N 1 3 286.419 3.595 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1cccc(Cl)c1 ZINC000624119844 1117984038 /nfs/dbraw/zinc/98/40/38/1117984038.db2.gz KVUBKYNHKHFSEE-KBPBESRZSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccsc1 ZINC000624123556 1117986842 /nfs/dbraw/zinc/98/68/42/1117986842.db2.gz NZNWQVHZNACVSP-UKRRQHHQSA-N 1 3 266.454 3.521 20 0 CHADHO CN1CCCC[C@H]1CC[N@H+](C)Cc1ccc2ncccc2c1 ZINC000130882505 1125486411 /nfs/dbraw/zinc/48/64/11/1125486411.db2.gz OENIJWXDCZOIQA-SFHVURJKSA-N 1 3 297.446 3.541 20 0 CHADHO CN1CCCC[C@H]1CC[N@@H+](C)Cc1ccc2ncccc2c1 ZINC000130882505 1125486414 /nfs/dbraw/zinc/48/64/14/1125486414.db2.gz OENIJWXDCZOIQA-SFHVURJKSA-N 1 3 297.446 3.541 20 0 CHADHO CC1(C)C[C@]1(C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000657761652 1119358290 /nfs/dbraw/zinc/35/82/90/1119358290.db2.gz QKVWCPGJTREEMP-KRWDZBQOSA-N 1 3 264.457 3.562 20 0 CHADHO CCC(C)(C)[C@H](C)[NH2+]C1CCN(C2CCCC2)CC1 ZINC000584035353 1119464321 /nfs/dbraw/zinc/46/43/21/1119464321.db2.gz CNHCHKPYXGPIKD-AWEZNQCLSA-N 1 3 266.473 3.808 20 0 CHADHO C[C@@H](NCCC[N@@H+](C)C1CCCCC1)C(C)(C)C(F)F ZINC000657829768 1119478280 /nfs/dbraw/zinc/47/82/80/1119478280.db2.gz HZIANESCIFCFPF-CYBMUJFWSA-N 1 3 290.442 3.910 20 0 CHADHO CC(C)CCC[C@H](C)[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000685455216 1119610478 /nfs/dbraw/zinc/61/04/78/1119610478.db2.gz KXMFLCVIAMZXSL-HOTGVXAUSA-N 1 3 254.462 3.521 20 0 CHADHO CC(C)[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCN(C(C)C)C2)C1 ZINC000300316684 1119696544 /nfs/dbraw/zinc/69/65/44/1119696544.db2.gz VCHCKMSSNSFOMP-BRWVUGGUSA-N 1 3 266.473 3.521 20 0 CHADHO Clc1cscc1CN1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647544372 1120003625 /nfs/dbraw/zinc/00/36/25/1120003625.db2.gz ZOOAHPGAYKYUHG-CHWSQXEVSA-N 1 3 298.883 3.613 20 0 CHADHO CCCCCC[C@H](CC)[N@@H+]1CC[C@@]2(C1)CCCNC2 ZINC001246598929 1131712238 /nfs/dbraw/zinc/71/22/38/1131712238.db2.gz AAVDBZMTZMBEPN-IRXDYDNUSA-N 1 3 266.473 3.811 20 0 CHADHO CCCCCC[C@H](CC)[N@H+]1CC[C@@]2(C1)CCCNC2 ZINC001246598929 1131712243 /nfs/dbraw/zinc/71/22/43/1131712243.db2.gz AAVDBZMTZMBEPN-IRXDYDNUSA-N 1 3 266.473 3.811 20 0 CHADHO CCCC[C@H]1C[C@H]([N@@H+](C)[C@H]2CC[C@H](C)CC2)CCN1 ZINC001246995022 1131838476 /nfs/dbraw/zinc/83/84/76/1131838476.db2.gz FELLKIDXSUHQBZ-LUKYLMHMSA-N 1 3 266.473 3.808 20 0 CHADHO CN1C(C)(C)CC([NH2+]C2(CC3CC3)CC2)CC1(C)C ZINC001171630079 1132062267 /nfs/dbraw/zinc/06/22/67/1132062267.db2.gz HTXDSBDMFMVADT-UHFFFAOYSA-N 1 3 264.457 3.560 20 0 CHADHO CN1C(C)(C)CC([NH2+]C[C@@H]2CCC(F)(F)C2)CC1(C)C ZINC001171613722 1132064789 /nfs/dbraw/zinc/06/47/89/1132064789.db2.gz OCVNAADZNCKPES-GFCCVEGCSA-N 1 3 288.426 3.663 20 0 CHADHO CN1C(C)(C)CC([NH2+]C2(C)CCCCC2)CC1(C)C ZINC001171614388 1132065414 /nfs/dbraw/zinc/06/54/14/1132065414.db2.gz YSQYMPCBCGXYKY-UHFFFAOYSA-N 1 3 266.473 3.950 20 0 CHADHO CCC[N@@H+](Cc1cc(F)cc(CN(C)C)c1)CC(C)C ZINC001232149045 1132427816 /nfs/dbraw/zinc/42/78/16/1132427816.db2.gz JIESGSDCWVFHNB-UHFFFAOYSA-N 1 3 280.431 3.755 20 0 CHADHO CCC[N@H+](Cc1cc(F)cc(CN(C)C)c1)CC(C)C ZINC001232149045 1132427822 /nfs/dbraw/zinc/42/78/22/1132427822.db2.gz JIESGSDCWVFHNB-UHFFFAOYSA-N 1 3 280.431 3.755 20 0 CHADHO CC/C=C\CCCCC[N@@H+]1CCC[C@@]12CCCNC2 ZINC001222232861 1135211628 /nfs/dbraw/zinc/21/16/28/1135211628.db2.gz XSLPCZXHSIHBRH-CWIOURORSA-N 1 3 264.457 3.731 20 0 CHADHO CC/C=C\CCCCC[N@H+]1CCC[C@@]12CCCNC2 ZINC001222232861 1135211633 /nfs/dbraw/zinc/21/16/33/1135211633.db2.gz XSLPCZXHSIHBRH-CWIOURORSA-N 1 3 264.457 3.731 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H]2CC[C@@H](C)c3ccccc32)C1 ZINC000222052524 1125517032 /nfs/dbraw/zinc/51/70/32/1125517032.db2.gz CZHKJGQBPMDUEL-IIDMSEBBSA-N 1 3 272.436 3.556 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H]2CC[C@@H](C)c3ccccc32)C1 ZINC000222052524 1125517038 /nfs/dbraw/zinc/51/70/38/1125517038.db2.gz CZHKJGQBPMDUEL-IIDMSEBBSA-N 1 3 272.436 3.556 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H]2CC[C@@H](C)c3ccccc32)C1 ZINC000222052524 1125517044 /nfs/dbraw/zinc/51/70/44/1125517044.db2.gz CZHKJGQBPMDUEL-IIDMSEBBSA-N 1 3 272.436 3.556 20 0 CHADHO Cc1ccncc1[C@H](C)N[C@H](C)c1cccc(C[NH+](C)C)c1 ZINC000925292095 1125614388 /nfs/dbraw/zinc/61/43/88/1125614388.db2.gz FBKMQIBLFAYVRA-CVEARBPZSA-N 1 3 297.446 3.863 20 0 CHADHO Cc1ccncc1[C@@H](C)N[C@@H](C)c1cccc(C[NH+](C)C)c1 ZINC000925292110 1125614843 /nfs/dbraw/zinc/61/48/43/1125614843.db2.gz FBKMQIBLFAYVRA-JKSUJKDBSA-N 1 3 297.446 3.863 20 0 CHADHO Cc1cc([C@H](C)[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)c(C)s1 ZINC000246820854 1125648578 /nfs/dbraw/zinc/64/85/78/1125648578.db2.gz APIFQQKUERLCLG-NWANDNLSSA-N 1 3 280.481 3.888 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](C)c2sc(C(C)C)nc2C)C1 ZINC000246932870 1125654534 /nfs/dbraw/zinc/65/45/34/1125654534.db2.gz HGLRBDIOBWQSAX-TZMCWYRMSA-N 1 3 295.496 3.567 20 0 CHADHO CN1CCCC[C@@H]1CC[N@H+](C)Cc1cccc2cccnc21 ZINC000075860332 1125658125 /nfs/dbraw/zinc/65/81/25/1125658125.db2.gz GLMTUJJPWXAUQO-GOSISDBHSA-N 1 3 297.446 3.541 20 0 CHADHO CN1CCCC[C@@H]1CC[N@@H+](C)Cc1cccc2cccnc21 ZINC000075860332 1125658127 /nfs/dbraw/zinc/65/81/27/1125658127.db2.gz GLMTUJJPWXAUQO-GOSISDBHSA-N 1 3 297.446 3.541 20 0 CHADHO CCCN(Cc1ccc(C)c(Cl)c1)C1CC[NH2+]CC1 ZINC000261658766 1125737598 /nfs/dbraw/zinc/73/75/98/1125737598.db2.gz BLLIVWHPYGXYHS-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO CCC[N@H+](Cc1ccc(C)c(Cl)c1)C1CCNCC1 ZINC000261658766 1125737606 /nfs/dbraw/zinc/73/76/06/1125737606.db2.gz BLLIVWHPYGXYHS-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO CCC[N@@H+](Cc1ccc(C)c(Cl)c1)C1CCNCC1 ZINC000261658766 1125737614 /nfs/dbraw/zinc/73/76/14/1125737614.db2.gz BLLIVWHPYGXYHS-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO CSC(C)(C)C[C@H](C)[NH2+]CCCN1CCCC[C@@H]1C ZINC001258320840 1129193600 /nfs/dbraw/zinc/19/36/00/1129193600.db2.gz FSKPCWIGSPUKBW-GJZGRUSLSA-N 1 3 286.529 3.761 20 0 CHADHO CC(C)=CCC[C@H](C)CC[NH+]1CCC(N(C)C)CC1 ZINC000482064696 1126740510 /nfs/dbraw/zinc/74/05/10/1126740510.db2.gz BVKJHHQJNJYTMC-INIZCTEOSA-N 1 3 266.473 3.785 20 0 CHADHO CC(C)=CCC[C@H](C)CCN1CCC([NH+](C)C)CC1 ZINC000482064696 1126740512 /nfs/dbraw/zinc/74/05/12/1126740512.db2.gz BVKJHHQJNJYTMC-INIZCTEOSA-N 1 3 266.473 3.785 20 0 CHADHO COc1ccccc1[C@H](C)[NH2+][C@@H](CCN(C)C)C(C)(C)C ZINC000483179188 1126770605 /nfs/dbraw/zinc/77/06/05/1126770605.db2.gz BOMODMIUIKXZLM-YOEHRIQHSA-N 1 3 292.467 3.712 20 0 CHADHO CCc1ccc([C@H](C)[NH2+][C@@H](CCN(C)C)C(C)(C)C)o1 ZINC000483158465 1126770897 /nfs/dbraw/zinc/77/08/97/1126770897.db2.gz UQGDJDWUOSDTHO-BBRMVZONSA-N 1 3 280.456 3.859 20 0 CHADHO CCC[C@H](C)[C@H](CC)[NH2+][C@@H]1CCC[C@H](N(C)C)C1 ZINC000484466302 1126817136 /nfs/dbraw/zinc/81/71/36/1126817136.db2.gz JXCZSTYEQBCOCH-FZKCQIBNSA-N 1 3 254.462 3.664 20 0 CHADHO Cc1cc(C)cc([C@H](C)[NH2+][C@H]2CCC[C@H](N(C)C)C2)c1 ZINC000484480877 1126821386 /nfs/dbraw/zinc/82/13/86/1126821386.db2.gz ANTGERDCBCNOAS-SZMVWBNQSA-N 1 3 274.452 3.827 20 0 CHADHO Cc1ccc2c(c1)[C@@H](NC1C[C@H]3CC[C@@H](C1)[N@H+]3C)CCC2 ZINC000193060682 1126965725 /nfs/dbraw/zinc/96/57/25/1126965725.db2.gz QNLAMVSBSRTBSE-PHSGOXPASA-N 1 3 284.447 3.587 20 0 CHADHO Cc1ccc2c(c1)[C@@H](NC1C[C@H]3CC[C@@H](C1)[N@@H+]3C)CCC2 ZINC000193060682 1126965729 /nfs/dbraw/zinc/96/57/29/1126965729.db2.gz QNLAMVSBSRTBSE-PHSGOXPASA-N 1 3 284.447 3.587 20 0 CHADHO Cc1ccccc1[C@@H](C)NC1CC[NH+](C2CCC2)CC1 ZINC000269063132 1127034962 /nfs/dbraw/zinc/03/49/62/1127034962.db2.gz YCTJZFYBXSYOCC-OAHLLOKOSA-N 1 3 272.436 3.663 20 0 CHADHO CC[C@H](NC1CC[NH+](C2CCC2)CC1)c1ccccc1 ZINC000268997242 1127031773 /nfs/dbraw/zinc/03/17/73/1127031773.db2.gz KXJOWLXXOYTDGL-SFHVURJKSA-N 1 3 272.436 3.744 20 0 CHADHO [NH3+][C@H]1CCC[C@H](N[C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC000629556768 1127107801 /nfs/dbraw/zinc/10/78/01/1127107801.db2.gz YKNNWWRISCUIDQ-OFQRWUPVSA-N 1 3 278.827 3.577 20 0 CHADHO CSCC[C@@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000151061818 1127120801 /nfs/dbraw/zinc/12/08/01/1127120801.db2.gz OSUIFSOGUKFCHR-CQSZACIVSA-N 1 3 284.513 3.515 20 0 CHADHO c1cc([C@@H]2CCC[N@H+]2CCCN2CCCCC2)cs1 ZINC000351310108 1127188292 /nfs/dbraw/zinc/18/82/92/1127188292.db2.gz ZOKJYBFIVTUNBI-INIZCTEOSA-N 1 3 278.465 3.761 20 0 CHADHO c1cc([C@@H]2CCC[N@@H+]2CCCN2CCCCC2)cs1 ZINC000351310108 1127188294 /nfs/dbraw/zinc/18/82/94/1127188294.db2.gz ZOKJYBFIVTUNBI-INIZCTEOSA-N 1 3 278.465 3.761 20 0 CHADHO C[C@H]([NH2+]CC1(CN(C)C)CCCC1)c1ccnc(Cl)c1 ZINC000760896760 1127324608 /nfs/dbraw/zinc/32/46/08/1127324608.db2.gz JDXBOLCMIFYPCD-ZDUSSCGKSA-N 1 3 295.858 3.508 20 0 CHADHO CCN1CC[C@H]([N@H+](C)Cc2ccccc2SC)C[C@@H]1C ZINC000358030282 1127397281 /nfs/dbraw/zinc/39/72/81/1127397281.db2.gz GLSZARZKBRBTER-HOCLYGCPSA-N 1 3 292.492 3.713 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)Cc2ccccc2SC)C[C@@H]1C ZINC000358030282 1127397284 /nfs/dbraw/zinc/39/72/84/1127397284.db2.gz GLSZARZKBRBTER-HOCLYGCPSA-N 1 3 292.492 3.713 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCCc3sccc32)C1 ZINC000361966944 1127603347 /nfs/dbraw/zinc/60/33/47/1127603347.db2.gz HNZPQPQBEUVERJ-NFAWXSAZSA-N 1 3 278.465 3.588 20 0 CHADHO CCC[C@H](N[C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccccc1 ZINC000361966638 1127603361 /nfs/dbraw/zinc/60/33/61/1127603361.db2.gz NPZOGVTYJZEGJH-KSZLIROESA-N 1 3 274.452 3.990 20 0 CHADHO CCC[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1ccccc1 ZINC000361966638 1127603362 /nfs/dbraw/zinc/60/33/62/1127603362.db2.gz NPZOGVTYJZEGJH-KSZLIROESA-N 1 3 274.452 3.990 20 0 CHADHO CC[NH+](CC)Cc1cccc(CNCc2ccncc2C)c1 ZINC000296493452 1127673776 /nfs/dbraw/zinc/67/37/76/1127673776.db2.gz QPZFKFYZOGCTEM-UHFFFAOYSA-N 1 3 297.446 3.522 20 0 CHADHO C[C@@H](CSC(C)(C)C)NC1CC([NH+]2CCCCC2)C1 ZINC000366284798 1127745005 /nfs/dbraw/zinc/74/50/05/1127745005.db2.gz OXTHAFDIVVWIGX-NFOMZHRRSA-N 1 3 284.513 3.513 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1NCc1csc2ccccc12 ZINC000540119429 1127961642 /nfs/dbraw/zinc/96/16/42/1127961642.db2.gz ZCRVNPWAKUADFG-DVOMOZLQSA-N 1 3 288.460 3.720 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1NCc1csc2ccccc12 ZINC000540119429 1127961646 /nfs/dbraw/zinc/96/16/46/1127961646.db2.gz ZCRVNPWAKUADFG-DVOMOZLQSA-N 1 3 288.460 3.720 20 0 CHADHO C[C@H](CC[NH2+][C@@H](c1ccccc1)C1CC1)N1CCCCC1 ZINC000544370465 1127970241 /nfs/dbraw/zinc/97/02/41/1127970241.db2.gz BIMLDWXKJQRRDR-APWZRJJASA-N 1 3 286.463 3.992 20 0 CHADHO CC[C@@H]([NH2+]CC[C@H]1CCCN1C)C(C)(C)c1ccccc1 ZINC000540526862 1127982866 /nfs/dbraw/zinc/98/28/66/1127982866.db2.gz YIASJNMVJGIUJH-QZTJIDSGSA-N 1 3 288.479 3.817 20 0 CHADHO CCN1CCC[C@H](C[NH2+]C[C@H](C)c2cccc(Cl)c2)C1 ZINC000470198547 1128065922 /nfs/dbraw/zinc/06/59/22/1128065922.db2.gz SQHPSNJUUCTQJS-LSDHHAIUSA-N 1 3 294.870 3.765 20 0 CHADHO C[N@H+](CC1CC1)C[C@@H]1CCN([C@@H]2CCCc3ccccc32)C1 ZINC000470976117 1128084279 /nfs/dbraw/zinc/08/42/79/1128084279.db2.gz KGMIQHSVJMXIDI-FXAWDEMLSA-N 1 3 298.474 3.728 20 0 CHADHO C[N@@H+](CC1CC1)C[C@@H]1CCN([C@@H]2CCCc3ccccc32)C1 ZINC000470976117 1128084283 /nfs/dbraw/zinc/08/42/83/1128084283.db2.gz KGMIQHSVJMXIDI-FXAWDEMLSA-N 1 3 298.474 3.728 20 0 CHADHO CCC[C@H](C)[NH+]1CCC(N)(c2ccccc2Cl)CC1 ZINC001257312886 1128230670 /nfs/dbraw/zinc/23/06/70/1128230670.db2.gz HTZBNTHBBSLJOO-ZDUSSCGKSA-N 1 3 280.843 3.778 20 0 CHADHO CCC[C@@H](C[NH2+]C[C@@H]1CCN(C(C)C)C1)c1ccccc1 ZINC000561612779 1128341036 /nfs/dbraw/zinc/34/10/36/1128341036.db2.gz QNCPCJPSLXSWOE-HKUYNNGSSA-N 1 3 288.479 3.890 20 0 CHADHO CN(C)[C@@H]1CCC[N@H+](C[C@@H]2CCCC(C)(C)C2)CC1 ZINC000562417906 1128401470 /nfs/dbraw/zinc/40/14/70/1128401470.db2.gz SXALCOLOPQEAPK-HZPDHXFCSA-N 1 3 266.473 3.619 20 0 CHADHO CN(C)[C@@H]1CCC[N@@H+](C[C@@H]2CCCC(C)(C)C2)CC1 ZINC000562417906 1128401471 /nfs/dbraw/zinc/40/14/71/1128401471.db2.gz SXALCOLOPQEAPK-HZPDHXFCSA-N 1 3 266.473 3.619 20 0 CHADHO Cc1ccc([C@H]([NH2+]CCCN2CCCC2)C2CC2)cc1 ZINC000037229479 1128424822 /nfs/dbraw/zinc/42/48/22/1128424822.db2.gz BOGZMPVHZXSVRR-SFHVURJKSA-N 1 3 272.436 3.522 20 0 CHADHO Cc1ccc([C@H](NCCC[NH+]2CCCC2)C2CC2)cc1 ZINC000037229479 1128424824 /nfs/dbraw/zinc/42/48/24/1128424824.db2.gz BOGZMPVHZXSVRR-SFHVURJKSA-N 1 3 272.436 3.522 20 0 CHADHO Cc1ccc([C@H](C)NC[C@H](C)C[NH+]2CCCC2)c(C)c1 ZINC000062077948 1128436507 /nfs/dbraw/zinc/43/65/07/1128436507.db2.gz JQDRJODACDCIPH-RDJZCZTQSA-N 1 3 274.452 3.686 20 0 CHADHO C[C@@H](CN[C@@H](C)c1ccc2c(c1)CCC2)C[NH+]1CCCC1 ZINC000062078265 1128437264 /nfs/dbraw/zinc/43/72/64/1128437264.db2.gz QWDHFTIDIJGWAA-HOTGVXAUSA-N 1 3 286.463 3.558 20 0 CHADHO CC(C)C[C@@H](C[N@H+](C)C1CCNCC1)c1ccccc1 ZINC000563131708 1128451666 /nfs/dbraw/zinc/45/16/66/1128451666.db2.gz GVUGELMSSJBHRI-KRWDZBQOSA-N 1 3 274.452 3.500 20 0 CHADHO CC(C)C[C@@H](C[N@@H+](C)C1CCNCC1)c1ccccc1 ZINC000563131708 1128451669 /nfs/dbraw/zinc/45/16/69/1128451669.db2.gz GVUGELMSSJBHRI-KRWDZBQOSA-N 1 3 274.452 3.500 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]C[C@@H](C)c2ccc(F)cc2)C1 ZINC000127879106 1128483257 /nfs/dbraw/zinc/48/32/57/1128483257.db2.gz BYFRQMNAFSGTPR-HZPDHXFCSA-N 1 3 292.442 3.639 20 0 CHADHO C[C@@H](NCc1ccc(C[NH3+])cc1)c1ccc(Cl)cc1 ZINC000564212033 1128498899 /nfs/dbraw/zinc/49/88/99/1128498899.db2.gz OXOPJNBQNUCSCN-GFCCVEGCSA-N 1 3 274.795 3.650 20 0 CHADHO [NH3+]Cc1ccc(CN[C@H]2CCc3c2cccc3Cl)cc1 ZINC000564988657 1128517915 /nfs/dbraw/zinc/51/79/15/1128517915.db2.gz MPTSMLSBWDLGLZ-KRWDZBQOSA-N 1 3 286.806 3.576 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@H](C)CCC2CCCC2)C1 ZINC000568564740 1128587559 /nfs/dbraw/zinc/58/75/59/1128587559.db2.gz ARDCUSGGMWZIKA-WBVHZDCISA-N 1 3 266.473 3.665 20 0 CHADHO CN1CCCC[C@@H]1CC[N@@H+]1CCC=C(c2ccccc2)C1 ZINC000556506953 1128598123 /nfs/dbraw/zinc/59/81/23/1128598123.db2.gz YLIXCEPOYIVGTL-LJQANCHMSA-N 1 3 284.447 3.650 20 0 CHADHO CN1CCCC[C@@H]1CC[N@H+]1CCC=C(c2ccccc2)C1 ZINC000556506953 1128598125 /nfs/dbraw/zinc/59/81/25/1128598125.db2.gz YLIXCEPOYIVGTL-LJQANCHMSA-N 1 3 284.447 3.650 20 0 CHADHO CC1(C)CC[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000556585185 1128606248 /nfs/dbraw/zinc/60/62/48/1128606248.db2.gz JCGBTPMLYCOLLY-INIZCTEOSA-N 1 3 264.457 3.562 20 0 CHADHO CCCC[C@H](C)[C@H](C)[NH2+][C@H]1CCC[C@@H](N(C)C)C1 ZINC000569884511 1128611169 /nfs/dbraw/zinc/61/11/69/1128611169.db2.gz TXNRINJTJIJDJH-YHUYYLMFSA-N 1 3 254.462 3.664 20 0 CHADHO CC1=CC[C@H]([NH2+][C@H](C)[C@H]2CCCN(C3CCC3)C2)CC1 ZINC000556833706 1128628421 /nfs/dbraw/zinc/62/84/21/1128628421.db2.gz JRNOJEPRZFYQFA-IKGGRYGDSA-N 1 3 276.468 3.728 20 0 CHADHO C[C@@H]1C[C@H](NCc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000073656709 1128646846 /nfs/dbraw/zinc/64/68/46/1128646846.db2.gz IXDNIBGGPCJLNV-YLJYHZDGSA-N 1 3 294.442 3.829 20 0 CHADHO C[C@@H]1C[C@H](NCc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000073656709 1128646848 /nfs/dbraw/zinc/64/68/48/1128646848.db2.gz IXDNIBGGPCJLNV-YLJYHZDGSA-N 1 3 294.442 3.829 20 0 CHADHO C[C@H]1C[C@@H](NCc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000073656716 1128646785 /nfs/dbraw/zinc/64/67/85/1128646785.db2.gz IXDNIBGGPCJLNV-PXNSSMCTSA-N 1 3 294.442 3.829 20 0 CHADHO C[C@H]1C[C@@H](NCc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000073656716 1128646786 /nfs/dbraw/zinc/64/67/86/1128646786.db2.gz IXDNIBGGPCJLNV-PXNSSMCTSA-N 1 3 294.442 3.829 20 0 CHADHO Cc1ccccc1-c1cccc(CN2CCC[C@H](C[NH3+])C2)c1 ZINC000573119620 1128651450 /nfs/dbraw/zinc/65/14/50/1128651450.db2.gz FUTJXFPMFMAAJI-GOSISDBHSA-N 1 3 294.442 3.833 20 0 CHADHO CCc1ccc(C[N@H+](CC)CCCN2CCCC2)s1 ZINC000573433847 1128654297 /nfs/dbraw/zinc/65/42/97/1128654297.db2.gz DYIMFOGAVIZHAP-UHFFFAOYSA-N 1 3 280.481 3.618 20 0 CHADHO CCc1ccc(C[N@@H+](CC)CCCN2CCCC2)s1 ZINC000573433847 1128654300 /nfs/dbraw/zinc/65/43/00/1128654300.db2.gz DYIMFOGAVIZHAP-UHFFFAOYSA-N 1 3 280.481 3.618 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H]2C[C@@H](C)c3ccccc32)C1 ZINC000574114192 1128661629 /nfs/dbraw/zinc/66/16/29/1128661629.db2.gz CGNWEACSLFOWJP-IIDMSEBBSA-N 1 3 272.436 3.556 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H]2C[C@@H](C)c3ccccc32)C1 ZINC000574114192 1128661632 /nfs/dbraw/zinc/66/16/32/1128661632.db2.gz CGNWEACSLFOWJP-IIDMSEBBSA-N 1 3 272.436 3.556 20 0 CHADHO Cc1ccc(CC[C@@H](C)[NH2+]C[C@H]2CCN(C(C)C)C2)cc1 ZINC000578370006 1128715966 /nfs/dbraw/zinc/71/59/66/1128715966.db2.gz MCWZKBPRVXWOSU-IEBWSBKVSA-N 1 3 288.479 3.636 20 0 CHADHO c1ccc([C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CCNC3(CCC3)C2)cc1 ZINC000643546568 1117791952 /nfs/dbraw/zinc/79/19/52/1117791952.db2.gz REJSAGALPUPEIA-QYZOEREBSA-N 1 3 298.474 3.977 20 0 CHADHO CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+][C@@H]1CCNC2(CCC2)C1 ZINC000643546236 1117792102 /nfs/dbraw/zinc/79/21/02/1117792102.db2.gz KSAAYOISRASYLG-VQHPVUNQSA-N 1 3 278.484 3.712 20 0 CHADHO c1ccc([C@@H](CC2CC2)N[C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000643546019 1117792416 /nfs/dbraw/zinc/79/24/16/1117792416.db2.gz HAYCSKQGBPAMIE-ZWKOTPCHSA-N 1 3 284.447 3.792 20 0 CHADHO C[N@@H+]1CC[C@@H](N[C@H]2CCCc3ccccc32)CC1(C)C ZINC000623336397 1117834401 /nfs/dbraw/zinc/83/44/01/1117834401.db2.gz MIFLLFKFLWGURT-WBVHZDCISA-N 1 3 272.436 3.526 20 0 CHADHO C[N@H+]1CC[C@@H](N[C@H]2CCCc3ccccc32)CC1(C)C ZINC000623336397 1117834409 /nfs/dbraw/zinc/83/44/09/1117834409.db2.gz MIFLLFKFLWGURT-WBVHZDCISA-N 1 3 272.436 3.526 20 0 CHADHO CC(C)[C@H](N[C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(F)cc1 ZINC000623343535 1117835986 /nfs/dbraw/zinc/83/59/86/1117835986.db2.gz YXDNNTHIPYEFSD-SJORKVTESA-N 1 3 292.442 3.985 20 0 CHADHO CC(C)[C@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(F)cc1 ZINC000623343535 1117835989 /nfs/dbraw/zinc/83/59/89/1117835989.db2.gz YXDNNTHIPYEFSD-SJORKVTESA-N 1 3 292.442 3.985 20 0 CHADHO C[N@@H+]1CC[C@@H](N[C@@H](c2ccccc2)C2CC2)CC1(C)C ZINC000623344915 1117836829 /nfs/dbraw/zinc/83/68/29/1117836829.db2.gz IFWAWAZDODBSLU-SJORKVTESA-N 1 3 272.436 3.600 20 0 CHADHO C[N@H+]1CC[C@@H](N[C@@H](c2ccccc2)C2CC2)CC1(C)C ZINC000623344915 1117836837 /nfs/dbraw/zinc/83/68/37/1117836837.db2.gz IFWAWAZDODBSLU-SJORKVTESA-N 1 3 272.436 3.600 20 0 CHADHO C[N@@H+]1CC[C@@H](N[C@H](c2cccs2)C2CC2)CC1(C)C ZINC000623345208 1117837849 /nfs/dbraw/zinc/83/78/49/1117837849.db2.gz WFGYCVLEQSXIGU-HIFRSBDPSA-N 1 3 278.465 3.662 20 0 CHADHO C[N@H+]1CC[C@@H](N[C@H](c2cccs2)C2CC2)CC1(C)C ZINC000623345208 1117837852 /nfs/dbraw/zinc/83/78/52/1117837852.db2.gz WFGYCVLEQSXIGU-HIFRSBDPSA-N 1 3 278.465 3.662 20 0 CHADHO CCCCc1ccc(CN2C[C@@H](C[NH3+])CC[C@H]2C)s1 ZINC001206772193 1117872350 /nfs/dbraw/zinc/87/23/50/1117872350.db2.gz ZAOVVUXBIUSOFV-ZIAGYGMSSA-N 1 3 280.481 3.650 20 0 CHADHO CC(C)[NH+]1CCC(N[C@@H](c2ccccc2)C2CCC2)CC1 ZINC000119292604 1117883166 /nfs/dbraw/zinc/88/31/66/1117883166.db2.gz UBLUBAYGHMZWGD-IBGZPJMESA-N 1 3 286.463 3.990 20 0 CHADHO C[C@@H](CCc1ccccc1)C[NH2+]C[C@H]1CCCCN(C)C1 ZINC000623657466 1117883841 /nfs/dbraw/zinc/88/38/41/1117883841.db2.gz RFWLRXFRSMGWEM-PKOBYXMFSA-N 1 3 288.479 3.577 20 0 CHADHO CC(C)[C@H](C[NH2+]C[C@@H]1CCCCN(C)C1)c1ccccc1 ZINC000623656801 1117884890 /nfs/dbraw/zinc/88/48/90/1117884890.db2.gz CELMSXRUZBHTOX-HKUYNNGSSA-N 1 3 288.479 3.748 20 0 CHADHO CCN(CC)CCC[N@H+](C1CC1)C1CCC(C)CC1 ZINC001167072084 1117889770 /nfs/dbraw/zinc/88/97/70/1117889770.db2.gz PEEWCZJBYXKTPN-UHFFFAOYSA-N 1 3 266.473 3.761 20 0 CHADHO CCN(CC)CCC[N@@H+](C1CC1)C1CCC(C)CC1 ZINC001167072084 1117889778 /nfs/dbraw/zinc/88/97/78/1117889778.db2.gz PEEWCZJBYXKTPN-UHFFFAOYSA-N 1 3 266.473 3.761 20 0 CHADHO CCC[C@@H](C)C[N@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236371818 1128742599 /nfs/dbraw/zinc/74/25/99/1128742599.db2.gz NPKFKXQDZOCDHD-HZPDHXFCSA-N 1 3 266.473 3.667 20 0 CHADHO CCC[C@@H](C)C[N@@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236371818 1128742604 /nfs/dbraw/zinc/74/26/04/1128742604.db2.gz NPKFKXQDZOCDHD-HZPDHXFCSA-N 1 3 266.473 3.667 20 0 CHADHO CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000579872166 1117967168 /nfs/dbraw/zinc/96/71/68/1117967168.db2.gz OHTRXIAVRYTYTG-IAGOWNOFSA-N 1 3 278.484 3.808 20 0 CHADHO Cc1cc([C@H](C)[NH2+]C[C@H]2CCCCN(C)C2)c(C)s1 ZINC000624119888 1117984080 /nfs/dbraw/zinc/98/40/80/1117984080.db2.gz LTVISMFLZXQBLL-DZGCQCFKSA-N 1 3 280.481 3.747 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccc(Cl)c(F)c1 ZINC000624122462 1117984481 /nfs/dbraw/zinc/98/44/81/1117984481.db2.gz RTCBCGDBDHGUEE-OLZOCXBDSA-N 1 3 298.833 3.862 20 0 CHADHO Cc1cc(C)cc([C@@H](C)[NH2+]C[C@H]2CCCCN(C)C2)c1 ZINC000624120945 1117984598 /nfs/dbraw/zinc/98/45/98/1117984598.db2.gz KOOBHLYFMIJLOT-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCCN(C)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000624123078 1117985732 /nfs/dbraw/zinc/98/57/32/1117985732.db2.gz FNNGLJWSOUWZCO-XUWVNRHRSA-N 1 3 292.492 3.562 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@H](c2ccc(F)cc2)C2CC2)C1 ZINC000624121733 1117986121 /nfs/dbraw/zinc/98/61/21/1117986121.db2.gz CCCZGZBHLWIZEQ-KDOFPFPSSA-N 1 3 290.426 3.598 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@H]2CCCCC23CCCC3)C1 ZINC000380634503 1118002536 /nfs/dbraw/zinc/00/25/36/1118002536.db2.gz JBQICRLVNHJGFC-IRXDYDNUSA-N 1 3 278.484 3.809 20 0 CHADHO CC[C@H](NCC[C@H]1CCC[N@@H+]1C)c1ccc(C)cc1 ZINC000181711748 1118004444 /nfs/dbraw/zinc/00/44/44/1118004444.db2.gz FQVKEFSNIPWRGK-SJORKVTESA-N 1 3 260.425 3.520 20 0 CHADHO CC[C@H](NCC[C@H]1CCC[N@H+]1C)c1ccc(C)cc1 ZINC000181711748 1118004450 /nfs/dbraw/zinc/00/44/50/1118004450.db2.gz FQVKEFSNIPWRGK-SJORKVTESA-N 1 3 260.425 3.520 20 0 CHADHO CC[C@H]([NH2+]CC[C@H]1CCCN1C)c1ccc(C)cc1 ZINC000181711748 1118004455 /nfs/dbraw/zinc/00/44/55/1118004455.db2.gz FQVKEFSNIPWRGK-SJORKVTESA-N 1 3 260.425 3.520 20 0 CHADHO CC(C)(C)[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1cccc(F)c1 ZINC000579494561 1128749568 /nfs/dbraw/zinc/74/95/68/1128749568.db2.gz SBFNWLAEUAMCHF-ARFHVFGLSA-N 1 3 278.415 3.772 20 0 CHADHO C[C@@H]1CCC[C@H]([NH2+]C2CCN(C3CCCC3)CC2)CC1 ZINC000443215389 1118025390 /nfs/dbraw/zinc/02/53/90/1118025390.db2.gz XWOGIHNOROJHFD-CVEARBPZSA-N 1 3 278.484 3.952 20 0 CHADHO C[C@H]1CCC[C@@H]([NH2+]C2CCN(C3CCCC3)CC2)CC1 ZINC000443215392 1118025491 /nfs/dbraw/zinc/02/54/91/1118025491.db2.gz XWOGIHNOROJHFD-JKSUJKDBSA-N 1 3 278.484 3.952 20 0 CHADHO C[C@@H]([NH2+]CC[C@H](C)N1CCCCC1)c1cccs1 ZINC000184501352 1118054869 /nfs/dbraw/zinc/05/48/69/1118054869.db2.gz GDCNQMSIZUSDBP-UONOGXRCSA-N 1 3 266.454 3.663 20 0 CHADHO C[C@H]([NH2+]CCC1CCCC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000185725392 1118063755 /nfs/dbraw/zinc/06/37/55/1118063755.db2.gz UISUSVYPZZDNMI-DOTOQJQBSA-N 1 3 278.484 3.809 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H](C)c2cccc(C3CC3)c2)C1 ZINC000340188102 1118106395 /nfs/dbraw/zinc/10/63/95/1118106395.db2.gz DWYGJEZGKGYETG-LSDHHAIUSA-N 1 3 272.436 3.556 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H](C)c2cccc(C3CC3)c2)C1 ZINC000340188102 1118106400 /nfs/dbraw/zinc/10/64/00/1118106400.db2.gz DWYGJEZGKGYETG-LSDHHAIUSA-N 1 3 272.436 3.556 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)c2cccc(C3CC3)c2)C1 ZINC000340188102 1118106402 /nfs/dbraw/zinc/10/64/02/1118106402.db2.gz DWYGJEZGKGYETG-LSDHHAIUSA-N 1 3 272.436 3.556 20 0 CHADHO CC/C=C/CCN1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC001167256532 1118123437 /nfs/dbraw/zinc/12/34/37/1118123437.db2.gz ZCPIQLZDNSXEIE-WRFKIARRSA-N 1 3 278.484 3.787 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@H]2CCCCC23CCCC3)C1 ZINC000706071850 1118140785 /nfs/dbraw/zinc/14/07/85/1118140785.db2.gz WHNAEVLDRASGCO-SJORKVTESA-N 1 3 278.484 3.811 20 0 CHADHO C[C@H]1C[C@@H](N[C@@H]2CCCc3ccc(Cl)cc32)CC[N@@H+]1C ZINC000624329090 1118284084 /nfs/dbraw/zinc/28/40/84/1118284084.db2.gz LIZKAWCPXGJDBL-YLQAJVPDSA-N 1 3 292.854 3.790 20 0 CHADHO C[C@H]1C[C@@H](N[C@@H]2CCCc3ccc(Cl)cc32)CC[N@H+]1C ZINC000624329090 1118284088 /nfs/dbraw/zinc/28/40/88/1118284088.db2.gz LIZKAWCPXGJDBL-YLQAJVPDSA-N 1 3 292.854 3.790 20 0 CHADHO C[NH+](C)CC[C@H](NCc1cc2ccccc2[nH]1)C(C)(C)C ZINC000683930270 1118448921 /nfs/dbraw/zinc/44/89/21/1118448921.db2.gz YIVYHCAONCKTPF-KRWDZBQOSA-N 1 3 287.451 3.624 20 0 CHADHO Cc1ccccc1-c1cccc(CN2CC[C@H]([NH3+])C[C@@H]2C)c1 ZINC000580841141 1118513441 /nfs/dbraw/zinc/51/34/41/1118513441.db2.gz IGZNFPCKQNYEMK-LPHOPBHVSA-N 1 3 294.442 3.974 20 0 CHADHO CCC[C@@H]1C[C@H]1[NH2+][C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12 ZINC000430749213 1118766454 /nfs/dbraw/zinc/76/64/54/1118766454.db2.gz INBHRYFWIRPGGD-OUUBHVDSSA-N 1 3 298.474 3.675 20 0 CHADHO CCN(CC)CCC[NH2+]C1CCC2(CCCC2)CC1 ZINC000129208687 1118769142 /nfs/dbraw/zinc/76/91/42/1118769142.db2.gz QXRCUYWRTDHAIQ-UHFFFAOYSA-N 1 3 266.473 3.811 20 0 CHADHO Cc1ccc2[nH]c(C[NH2+]CCCN3CCCCC3)cc2c1C ZINC000472078987 1118960970 /nfs/dbraw/zinc/96/09/70/1118960970.db2.gz QYKHCPFILIYIDC-UHFFFAOYSA-N 1 3 299.462 3.750 20 0 CHADHO CC(C)(C[NH2+][C@@H]1CCC[C@@H]1CCCF)CN1CCCC1 ZINC000511031375 1118962517 /nfs/dbraw/zinc/96/25/17/1118962517.db2.gz QLPWTPHEXWBCTF-HZPDHXFCSA-N 1 3 284.463 3.616 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H]2CCCc3c(C)ccc(C)c32)C1 ZINC000349812020 1119272628 /nfs/dbraw/zinc/27/26/28/1119272628.db2.gz JQHWPLAYBROSOM-AEFFLSMTSA-N 1 3 286.463 3.612 20 0 CHADHO CC[C@H](NCc1cccc2c1CC[NH2+]C2)c1ccccc1F ZINC000635013073 1119368862 /nfs/dbraw/zinc/36/88/62/1119368862.db2.gz ZEKYZOZVYXJNMS-IBGZPJMESA-N 1 3 298.405 3.712 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@@H]1CCCc2ccc(F)cc21 ZINC000650756706 1119414218 /nfs/dbraw/zinc/41/42/18/1119414218.db2.gz IEUSTQKSUPEVGD-LJQANCHMSA-N 1 3 298.405 3.712 20 0 CHADHO C[C@@H]([NH2+]C1CCN(C2CCCCC2)CC1)C1CCCC1 ZINC000168456793 1119446082 /nfs/dbraw/zinc/44/60/82/1119446082.db2.gz AJFOATSDLAVINZ-OAHLLOKOSA-N 1 3 278.484 3.952 20 0 CHADHO C[C@@H](NCCC[N@H+](C)C1CCCCC1)C(C)(C)C(F)F ZINC000657829768 1119478279 /nfs/dbraw/zinc/47/82/79/1119478279.db2.gz HZIANESCIFCFPF-CYBMUJFWSA-N 1 3 290.442 3.910 20 0 CHADHO C[C@H]1CC[C@H](CN)C[N@@H+]1C1CCC2(CCCC2)CC1 ZINC000129785208 1119558650 /nfs/dbraw/zinc/55/86/50/1119558650.db2.gz PNEMRCWUWVFGAP-LSDHHAIUSA-N 1 3 264.457 3.549 20 0 CHADHO C[C@H]1CC[C@H](CN)C[N@H+]1C1CCC2(CCCC2)CC1 ZINC000129785208 1119558651 /nfs/dbraw/zinc/55/86/51/1119558651.db2.gz PNEMRCWUWVFGAP-LSDHHAIUSA-N 1 3 264.457 3.549 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@@H](C)C2CCC(F)(F)CC2)C1 ZINC000685455737 1119611110 /nfs/dbraw/zinc/61/11/10/1119611110.db2.gz ZMDNNSCJPUKUDJ-KBPBESRZSA-N 1 3 288.426 3.520 20 0 CHADHO C1CCC(N2CCC([NH2+][C@@H]3CCCSCC3)CC2)CC1 ZINC000657898496 1119619461 /nfs/dbraw/zinc/61/94/61/1119619461.db2.gz PGMBUERTPWUSMR-OAHLLOKOSA-N 1 3 296.524 3.659 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCCSCC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000657969781 1119655372 /nfs/dbraw/zinc/65/53/72/1119655372.db2.gz UQICCUYOYRVNKG-ARFHVFGLSA-N 1 3 296.524 3.515 20 0 CHADHO C[C@@H](Cc1cccs1)N[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000658229262 1119706791 /nfs/dbraw/zinc/70/67/91/1119706791.db2.gz PYPGSUHNPDOHOH-GJZGRUSLSA-N 1 3 292.492 3.676 20 0 CHADHO C[C@@H](Cc1cccs1)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000658229262 1119706793 /nfs/dbraw/zinc/70/67/93/1119706793.db2.gz PYPGSUHNPDOHOH-GJZGRUSLSA-N 1 3 292.492 3.676 20 0 CHADHO Cc1ccc2c(c1)[C@@H](NC1CC[NH+](CC3CC3)CC1)[C@H](C)C2 ZINC000658245450 1119711155 /nfs/dbraw/zinc/71/11/55/1119711155.db2.gz JTCWZXZLASQQMI-QRWLVFNGSA-N 1 3 298.474 3.692 20 0 CHADHO COc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H](N(C)C)C2)c(C)c1 ZINC000414121599 1119906696 /nfs/dbraw/zinc/90/66/96/1119906696.db2.gz ZWYLPYZGQVRMQV-HRCADAONSA-N 1 3 290.451 3.527 20 0 CHADHO c1ccc([C@@H]2C[C@@H]2C[NH2+]C[C@H]2CCCN(CC3CC3)C2)cc1 ZINC000668819678 1119928953 /nfs/dbraw/zinc/92/89/53/1119928953.db2.gz PSHPKJLUBUDFAN-RLLQIKCJSA-N 1 3 298.474 3.502 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@H](C)[C@@H]1CC2CCC1CC2 ZINC000381724925 1128885599 /nfs/dbraw/zinc/88/55/99/1128885599.db2.gz RZJDBNVAONZFNH-VXLLPVPCSA-N 1 3 266.473 3.521 20 0 CHADHO C[C@H](C[NH2+]C[C@H]1CCCCN(C)C1)c1cccc(Cl)c1 ZINC000623657334 1120064947 /nfs/dbraw/zinc/06/49/47/1120064947.db2.gz NXGXUACVWBIDCO-HUUCEWRRSA-N 1 3 294.870 3.765 20 0 CHADHO CCC[C@H](C)[C@H](CC)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000624120916 1120068586 /nfs/dbraw/zinc/06/85/86/1120068586.db2.gz KAAZRAFTEMAVBA-XHSDSOJGSA-N 1 3 254.462 3.523 20 0 CHADHO CC[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCN(C(C)C)C2)CC1 ZINC000251698480 1128888028 /nfs/dbraw/zinc/88/80/28/1128888028.db2.gz IUKFUGFMWPVCHQ-BRWVUGGUSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)COc1ccc([C@H](C)[NH2+]C[C@H](C)CN(C)C)cc1 ZINC000314277388 1120182053 /nfs/dbraw/zinc/18/20/53/1120182053.db2.gz JKSIECTWKGDTRJ-HOTGVXAUSA-N 1 3 292.467 3.570 20 0 CHADHO CCCN1CCC([NH2+]Cc2cc(C)cc(Cl)c2)CC1 ZINC000395229897 1120227965 /nfs/dbraw/zinc/22/79/65/1120227965.db2.gz VGBVAAWBEGFDSM-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCCC[C@@H]1C)c1ccccc1 ZINC000216004244 1120241285 /nfs/dbraw/zinc/24/12/85/1120241285.db2.gz KLWSNYSXZKFAJO-JKSUJKDBSA-N 1 3 260.425 3.602 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@@H](C)[C@@H]1C[C@H]1c1cccs1 ZINC000417331950 1120428928 /nfs/dbraw/zinc/42/89/28/1120428928.db2.gz WRMYNXQRKAJJHA-SOUVJXGZSA-N 1 3 280.481 3.560 20 0 CHADHO CCCN1CC[C@H](C[NH2+]CCCC2CCCCC2)C1 ZINC000584746201 1120430100 /nfs/dbraw/zinc/43/01/00/1120430100.db2.gz CPAKZDVSYYNHOF-QGZVFWFLSA-N 1 3 266.473 3.668 20 0 CHADHO C[C@H]([NH2+]C1CCN(C2CCCCC2)CC1)C1CCC1 ZINC000157523675 1120437774 /nfs/dbraw/zinc/43/77/74/1120437774.db2.gz SBYOGOGSBDCUTE-AWEZNQCLSA-N 1 3 264.457 3.562 20 0 CHADHO C[C@@H]([NH2+]CC(C)(C)CN(C)C)c1cc2ccccc2o1 ZINC000019905914 1120548183 /nfs/dbraw/zinc/54/81/83/1120548183.db2.gz BMIWUEMVHYHQOO-CYBMUJFWSA-N 1 3 274.408 3.671 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+][C@@H]1CCc2ccccc21 ZINC000019913088 1120549150 /nfs/dbraw/zinc/54/91/50/1120549150.db2.gz AULFMTJKMCQIKL-CRAIPNDOSA-N 1 3 272.436 3.528 20 0 CHADHO CC[N@@H+]1CCC[C@@H]1CN[C@@H](C)c1ccc(SC)cc1 ZINC000019960910 1120553652 /nfs/dbraw/zinc/55/36/52/1120553652.db2.gz UEIBCRSWBMYJRH-DZGCQCFKSA-N 1 3 278.465 3.543 20 0 CHADHO CC[N@H+]1CCC[C@@H]1CN[C@@H](C)c1ccc(SC)cc1 ZINC000019960910 1120553655 /nfs/dbraw/zinc/55/36/55/1120553655.db2.gz UEIBCRSWBMYJRH-DZGCQCFKSA-N 1 3 278.465 3.543 20 0 CHADHO C[C@H](C[C@@H]1CCCCC[NH2+]1)NC[C@@H]1CCCCC1(F)F ZINC000390598678 1120574672 /nfs/dbraw/zinc/57/46/72/1120574672.db2.gz UBYCTOZYOIAHBP-ILXRZTDVSA-N 1 3 288.426 3.712 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)CCS1 ZINC000922836467 1120607979 /nfs/dbraw/zinc/60/79/79/1120607979.db2.gz CIXCVFQDAGWFRZ-ZBFHGGJFSA-N 1 3 296.524 3.657 20 0 CHADHO C[C@@H](C[NH2+][C@H](Cc1ccccc1)c1ccccc1)CN(C)C ZINC000390708385 1120609033 /nfs/dbraw/zinc/60/90/33/1120609033.db2.gz GZZYEJWITHBSFQ-FXAWDEMLSA-N 1 3 296.458 3.758 20 0 CHADHO C[C@@H](CN[C@H](Cc1ccccc1)c1ccccc1)C[NH+](C)C ZINC000390708385 1120609035 /nfs/dbraw/zinc/60/90/35/1120609035.db2.gz GZZYEJWITHBSFQ-FXAWDEMLSA-N 1 3 296.458 3.758 20 0 CHADHO CC(C)c1ccc([C@@H](C)N2CC[C@]3(CC[N@H+](C)C3)C2)cc1 ZINC000429017185 1120616973 /nfs/dbraw/zinc/61/69/73/1120616973.db2.gz DUAZEDRIBQACLK-APWZRJJASA-N 1 3 286.463 3.899 20 0 CHADHO CC(C)c1ccc([C@@H](C)N2CC[C@]3(CC[N@@H+](C)C3)C2)cc1 ZINC000429017185 1120616978 /nfs/dbraw/zinc/61/69/78/1120616978.db2.gz DUAZEDRIBQACLK-APWZRJJASA-N 1 3 286.463 3.899 20 0 CHADHO C[C@@H]1C[C@@H](NCc2ccc(F)c3ccccc23)CC[N@@H+]1C ZINC000631079572 1120633265 /nfs/dbraw/zinc/63/32/65/1120633265.db2.gz IJFZTIUDRHUQQT-HIFRSBDPSA-N 1 3 286.394 3.551 20 0 CHADHO C[C@@H]1C[C@@H](NCc2ccc(F)c3ccccc23)CC[N@H+]1C ZINC000631079572 1120633267 /nfs/dbraw/zinc/63/32/67/1120633267.db2.gz IJFZTIUDRHUQQT-HIFRSBDPSA-N 1 3 286.394 3.551 20 0 CHADHO CC[C@H](C)C[C@H](CC)[N@@H+]1CCC[C@@]2(CCCNC2)C1 ZINC000228082881 1120767996 /nfs/dbraw/zinc/76/79/96/1120767996.db2.gz PQEGAFMUQUDCHO-YESZJQIVSA-N 1 3 266.473 3.667 20 0 CHADHO CC[C@H](C)C[C@H](CC)[N@H+]1CCC[C@@]2(CCCNC2)C1 ZINC000228082881 1120767999 /nfs/dbraw/zinc/76/79/99/1120767999.db2.gz PQEGAFMUQUDCHO-YESZJQIVSA-N 1 3 266.473 3.667 20 0 CHADHO CC[NH+](CC)C[C@@H]1CCN(C[C@H](C)Cc2ccccc2)C1 ZINC000248547139 1120878014 /nfs/dbraw/zinc/87/80/14/1120878014.db2.gz FAOUDDGZQBFAMT-MJGOQNOKSA-N 1 3 288.479 3.529 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](C[C@H](C)Cc2ccccc2)C1 ZINC000248547139 1120878017 /nfs/dbraw/zinc/87/80/17/1120878017.db2.gz FAOUDDGZQBFAMT-MJGOQNOKSA-N 1 3 288.479 3.529 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](C[C@H](C)Cc2ccccc2)C1 ZINC000248547139 1120878021 /nfs/dbraw/zinc/87/80/21/1120878021.db2.gz FAOUDDGZQBFAMT-MJGOQNOKSA-N 1 3 288.479 3.529 20 0 CHADHO Cc1ccc([C@@H](C)NCc2cccc3c2CC[NH2+]C3)cc1F ZINC000662280840 1120917689 /nfs/dbraw/zinc/91/76/89/1120917689.db2.gz GGZGSYQMUUNIRJ-CQSZACIVSA-N 1 3 298.405 3.631 20 0 CHADHO CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663464144 1120980935 /nfs/dbraw/zinc/98/09/35/1120980935.db2.gz COWVDGNIRSDRPD-BRWVUGGUSA-N 1 3 278.484 3.523 20 0 CHADHO C[C@H](N)C[NH2+][C@@H](C)c1ccc(SC2CCCC2)cc1 ZINC000643528312 1121007211 /nfs/dbraw/zinc/00/72/11/1121007211.db2.gz GUATWKJENWOZAH-STQMWFEESA-N 1 3 278.465 3.719 20 0 CHADHO C[C@@H](N[C@@H]1CC12CC[NH2+]CC2)c1ccc(Cl)cc1Cl ZINC000643533896 1121009756 /nfs/dbraw/zinc/00/97/56/1121009756.db2.gz HOYFMNWFNFGSSJ-QMTHXVAHSA-N 1 3 299.245 3.786 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@@H]1C[C@H](C)CC(C)(C)C1 ZINC000300402530 1121018989 /nfs/dbraw/zinc/01/89/89/1121018989.db2.gz ULSJPSOYJNHICZ-LSDHHAIUSA-N 1 3 254.462 3.521 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N1CCc2c(F)cccc2C1 ZINC001167842471 1121064748 /nfs/dbraw/zinc/06/47/48/1121064748.db2.gz XWLZITYDZAUOQK-HNNXBMFYSA-N 1 3 292.442 3.694 20 0 CHADHO CC[C@H](NC[C@@H](C)C[NH+]1CCCC1)c1ccc(C)cc1 ZINC000062077485 1121186300 /nfs/dbraw/zinc/18/63/00/1121186300.db2.gz XNEAWNACSAJWIV-AEFFLSMTSA-N 1 3 274.452 3.768 20 0 CHADHO C[C@@H](c1cccc(Cl)c1)N1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000063197595 1121200982 /nfs/dbraw/zinc/20/09/82/1121200982.db2.gz QAJDWUCZCGNJHH-SUMWQHHRSA-N 1 3 292.854 3.865 20 0 CHADHO CC(C)C[C@H](C)[NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000512334059 1121272296 /nfs/dbraw/zinc/27/22/96/1121272296.db2.gz ZFEWIPSLUFAGKA-JYJNAYRXSA-N 1 3 266.473 3.664 20 0 CHADHO C[C@@H](CCc1cccc(F)c1)[N@@H+]1CCC[C@@H](N(C)C)CC1 ZINC000432790537 1121354032 /nfs/dbraw/zinc/35/40/32/1121354032.db2.gz CJZMEMQHUNCDHZ-MAUKXSAKSA-N 1 3 292.442 3.563 20 0 CHADHO C[C@@H](CCc1cccc(F)c1)[N@H+]1CCC[C@@H](N(C)C)CC1 ZINC000432790537 1121354041 /nfs/dbraw/zinc/35/40/41/1121354041.db2.gz CJZMEMQHUNCDHZ-MAUKXSAKSA-N 1 3 292.442 3.563 20 0 CHADHO C[C@H](CCc1cccc(F)c1)[N@@H+]1CCC[C@H](N(C)C)CC1 ZINC000432790538 1121354374 /nfs/dbraw/zinc/35/43/74/1121354374.db2.gz CJZMEMQHUNCDHZ-QAPCUYQASA-N 1 3 292.442 3.563 20 0 CHADHO C[C@H](CCc1cccc(F)c1)[N@H+]1CCC[C@H](N(C)C)CC1 ZINC000432790538 1121354382 /nfs/dbraw/zinc/35/43/82/1121354382.db2.gz CJZMEMQHUNCDHZ-QAPCUYQASA-N 1 3 292.442 3.563 20 0 CHADHO CC[C@H](C[N@@H+]1CCC[C@@H](N(C)C)CC1)c1ccccc1 ZINC000432816118 1121379378 /nfs/dbraw/zinc/37/93/78/1121379378.db2.gz NDSJZXAKLCRLQQ-SJLPKXTDSA-N 1 3 274.452 3.596 20 0 CHADHO CC[C@H](C[N@H+]1CCC[C@@H](N(C)C)CC1)c1ccccc1 ZINC000432816118 1121379388 /nfs/dbraw/zinc/37/93/88/1121379388.db2.gz NDSJZXAKLCRLQQ-SJLPKXTDSA-N 1 3 274.452 3.596 20 0 CHADHO CC[C@H](N[C@@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(Cl)c1 ZINC000219234544 1121469432 /nfs/dbraw/zinc/46/94/32/1121469432.db2.gz GPADXURDIJDRIU-MAZHCROVSA-N 1 3 280.843 3.863 20 0 CHADHO CC[C@H](N[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(Cl)c1 ZINC000219234544 1121469436 /nfs/dbraw/zinc/46/94/36/1121469436.db2.gz GPADXURDIJDRIU-MAZHCROVSA-N 1 3 280.843 3.863 20 0 CHADHO c1ccc([C@H](N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C2CCC2)cc1 ZINC000166487391 1121629112 /nfs/dbraw/zinc/62/91/12/1121629112.db2.gz ZQCXVNPGQPAENM-QRVBRYPASA-N 1 3 284.447 3.744 20 0 CHADHO c1ccc([C@H](N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)C2CCC2)cc1 ZINC000166487391 1121629115 /nfs/dbraw/zinc/62/91/15/1121629115.db2.gz ZQCXVNPGQPAENM-QRVBRYPASA-N 1 3 284.447 3.744 20 0 CHADHO CC[NH+](CC)CCCN1C[C@H](C)C[C@H]1c1ccccc1 ZINC000513236992 1121674864 /nfs/dbraw/zinc/67/48/64/1121674864.db2.gz ROWLAOXHDTWBMC-AEFFLSMTSA-N 1 3 274.452 3.801 20 0 CHADHO CCN(CC)CCC[N@@H+]1C[C@H](C)C[C@H]1c1ccccc1 ZINC000513236992 1121674868 /nfs/dbraw/zinc/67/48/68/1121674868.db2.gz ROWLAOXHDTWBMC-AEFFLSMTSA-N 1 3 274.452 3.801 20 0 CHADHO CCN(CC)CCC[N@H+]1C[C@H](C)C[C@H]1c1ccccc1 ZINC000513236992 1121674873 /nfs/dbraw/zinc/67/48/73/1121674873.db2.gz ROWLAOXHDTWBMC-AEFFLSMTSA-N 1 3 274.452 3.801 20 0 CHADHO CC(C)(C)C1CCC([N@@H+]2CC[C@@]3(C2)CCCNC3)CC1 ZINC000709968874 1121691776 /nfs/dbraw/zinc/69/17/76/1121691776.db2.gz CWKQTKJVESRDGZ-HTWSVDAQSA-N 1 3 278.484 3.667 20 0 CHADHO CC(C)(C)C1CCC([N@H+]2CC[C@@]3(C2)CCCNC3)CC1 ZINC000709968874 1121691779 /nfs/dbraw/zinc/69/17/79/1121691779.db2.gz CWKQTKJVESRDGZ-HTWSVDAQSA-N 1 3 278.484 3.667 20 0 CHADHO CCCC[C@@H](CC)CC[NH2+]C[C@H]1CCN(CC)C1 ZINC000535597495 1121744460 /nfs/dbraw/zinc/74/44/60/1121744460.db2.gz HZJFVINHLIIMQA-HZPDHXFCSA-N 1 3 254.462 3.524 20 0 CHADHO CC(C)C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@@H]3CN(C)C[C@H]23)C1 ZINC001179816785 1121913155 /nfs/dbraw/zinc/91/31/55/1121913155.db2.gz NTFCEMJDPIULLY-FLXSYLCISA-N 1 3 278.484 3.521 20 0 CHADHO CCC[N@H+](C[C@@H](C)N)[C@@H](C)c1cc2ccccc2o1 ZINC000420295785 1121995089 /nfs/dbraw/zinc/99/50/89/1121995089.db2.gz ASNVLDYBTLLFRE-OLZOCXBDSA-N 1 3 260.381 3.553 20 0 CHADHO CCC[N@@H+](C[C@@H](C)N)[C@@H](C)c1cc2ccccc2o1 ZINC000420295785 1121995096 /nfs/dbraw/zinc/99/50/96/1121995096.db2.gz ASNVLDYBTLLFRE-OLZOCXBDSA-N 1 3 260.381 3.553 20 0 CHADHO CC[C@H]([NH2+]C1CCC(C(C)(C)CC)CC1)C1CNC1 ZINC000716147484 1121997998 /nfs/dbraw/zinc/99/79/98/1121997998.db2.gz RDWKKUGHMSWYSQ-GPANFISMSA-N 1 3 266.473 3.569 20 0 CHADHO CCCN(Cc1cccc(C(F)F)c1)C1CC[NH2+]CC1 ZINC000420308967 1121998375 /nfs/dbraw/zinc/99/83/75/1121998375.db2.gz DHYSQYQMXLTRKU-UHFFFAOYSA-N 1 3 282.378 3.588 20 0 CHADHO CCC[N@H+](Cc1cccc(C(F)F)c1)C1CCNCC1 ZINC000420308967 1121998380 /nfs/dbraw/zinc/99/83/80/1121998380.db2.gz DHYSQYQMXLTRKU-UHFFFAOYSA-N 1 3 282.378 3.588 20 0 CHADHO CCC[N@@H+](Cc1cccc(C(F)F)c1)C1CCNCC1 ZINC000420308967 1121998382 /nfs/dbraw/zinc/99/83/82/1121998382.db2.gz DHYSQYQMXLTRKU-UHFFFAOYSA-N 1 3 282.378 3.588 20 0 CHADHO [NH3+]C[C@H](NCCc1c(F)cccc1Cl)C1CCCCC1 ZINC000420374773 1122003260 /nfs/dbraw/zinc/00/32/60/1122003260.db2.gz SKOSIRQQLCXWBP-INIZCTEOSA-N 1 3 298.833 3.519 20 0 CHADHO CCN(CC)CCC[N@H+](CC)C[C@H]1CCCC[C@H]1C ZINC001181506320 1122059483 /nfs/dbraw/zinc/05/94/83/1122059483.db2.gz PYRGYUURUDAMIP-IAGOWNOFSA-N 1 3 268.489 3.867 20 0 CHADHO CCN(CC)CCC[N@@H+](CC)C[C@H]1CCCC[C@H]1C ZINC001181506320 1122059489 /nfs/dbraw/zinc/05/94/89/1122059489.db2.gz PYRGYUURUDAMIP-IAGOWNOFSA-N 1 3 268.489 3.867 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+]Cc2cccc(C3CC3)c2)C1 ZINC000421367259 1122102786 /nfs/dbraw/zinc/10/27/86/1122102786.db2.gz SKUXMCOIZWMLRT-QZTJIDSGSA-N 1 3 272.436 3.526 20 0 CHADHO CC(C)(C)N1CCC([NH2+]C[C@@H]2C[C@@H]2c2ccccc2)CC1 ZINC000503035309 1122163485 /nfs/dbraw/zinc/16/34/85/1122163485.db2.gz NHIRFPVLXYHWEX-FUHWJXTLSA-N 1 3 286.463 3.643 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+]C1(c2ccc(F)cc2)CCCC1 ZINC000503065472 1122164372 /nfs/dbraw/zinc/16/43/72/1122164372.db2.gz VMTPLDRODHUXLA-QGZVFWFLSA-N 1 3 290.426 3.669 20 0 CHADHO C[N@@H+]1CCC[C@@H]1CCNC1(c2ccc(F)cc2)CCCC1 ZINC000503065472 1122164376 /nfs/dbraw/zinc/16/43/76/1122164376.db2.gz VMTPLDRODHUXLA-QGZVFWFLSA-N 1 3 290.426 3.669 20 0 CHADHO C[N@H+]1CCC[C@@H]1CCNC1(c2ccc(F)cc2)CCCC1 ZINC000503065472 1122164380 /nfs/dbraw/zinc/16/43/80/1122164380.db2.gz VMTPLDRODHUXLA-QGZVFWFLSA-N 1 3 290.426 3.669 20 0 CHADHO CC1=C(C)C[C@H]([C@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)CC1 ZINC001182908910 1122196097 /nfs/dbraw/zinc/19/60/97/1122196097.db2.gz DDVMSIVLEXGTAE-OKZBNKHCSA-N 1 3 278.484 3.833 20 0 CHADHO CC(C)(C)c1cccc(CN2CCC[C@@](C)([NH3+])CC2)c1 ZINC001205273654 1122227348 /nfs/dbraw/zinc/22/73/48/1122227348.db2.gz NOSIDKOTJCYHPJ-GOSISDBHSA-N 1 3 274.452 3.687 20 0 CHADHO C[C@@H]1C[C@]1([NH2+]CC[C@@H]1CCCN1C)c1ccc(Cl)cc1 ZINC000503368533 1122256570 /nfs/dbraw/zinc/25/65/70/1122256570.db2.gz DMQUJXWIUMRZDG-XOKHGSTOSA-N 1 3 292.854 3.649 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@H](C)Cc1cccc(C)c1 ZINC001184418877 1122275996 /nfs/dbraw/zinc/27/59/96/1122275996.db2.gz SXOWRGYYRWCWAB-DLBZAZTESA-N 1 3 276.468 3.636 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@@H](C)[C@@H]1CC2CCC1CC2 ZINC001184419355 1122276229 /nfs/dbraw/zinc/27/62/29/1122276229.db2.gz ZUMOFLXZDQXTGS-QOCJCZBQSA-N 1 3 280.500 3.911 20 0 CHADHO CC[C@@H](NC1CC[NH+](CC2CC2)CC1)c1ccc(C)cc1 ZINC000154459023 1122366284 /nfs/dbraw/zinc/36/62/84/1122366284.db2.gz GRUYKBORPPQQSX-LJQANCHMSA-N 1 3 286.463 3.910 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H](C)[C@H](C)c1ccc(OC)cc1 ZINC000514248432 1122391918 /nfs/dbraw/zinc/39/19/18/1122391918.db2.gz QBJCWUDJLFRWHA-HOTGVXAUSA-N 1 3 292.467 3.509 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCC[C@H]1c1ccc(Cl)cc1)CN(C)C ZINC000425934389 1122663106 /nfs/dbraw/zinc/66/31/06/1122663106.db2.gz BPAURFKPEGPPRV-XOKHGSTOSA-N 1 3 294.870 3.763 20 0 CHADHO CCSc1ccc([C@@H](C)[NH2+]C[C@H](C)CN(C)C)cc1 ZINC000425932504 1122663116 /nfs/dbraw/zinc/66/31/16/1122663116.db2.gz QKTOJQWQZNNOSR-UONOGXRCSA-N 1 3 280.481 3.647 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H](C)CN(C)C)c1ccc(Cl)s1 ZINC000425938374 1122667683 /nfs/dbraw/zinc/66/76/83/1122667683.db2.gz PYWDOULRIKUIFB-GHMZBOCLSA-N 1 3 274.861 3.640 20 0 CHADHO CC[C@H]([NH2+]C[C@@H](C)CN(C)C)c1ccc(Cl)s1 ZINC000425938375 1122668064 /nfs/dbraw/zinc/66/80/64/1122668064.db2.gz PYWDOULRIKUIFB-MNOVXSKESA-N 1 3 274.861 3.640 20 0 CHADHO CC(C)[C@H]([NH2+]C[C@@H](C)CN(C)C)c1cc2ccccc2o1 ZINC000425943772 1122673530 /nfs/dbraw/zinc/67/35/30/1122673530.db2.gz SUUNFYFOAYRTHK-KDOFPFPSSA-N 1 3 288.435 3.917 20 0 CHADHO C[C@H]([NH2+]CCC(C)(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000295584930 1122752628 /nfs/dbraw/zinc/75/26/28/1122752628.db2.gz BQONSQKKPWLTJH-HOCLYGCPSA-N 1 3 296.405 3.532 20 0 CHADHO C[C@H]([NH2+]CCCN1CCCCC1)c1cc2ccccc2[nH]1 ZINC000775622760 1122827454 /nfs/dbraw/zinc/82/74/54/1122827454.db2.gz HNWOWIURRXNUAX-HNNXBMFYSA-N 1 3 285.435 3.695 20 0 CHADHO CC(C)CSCCCN1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000154062647 1129081633 /nfs/dbraw/zinc/08/16/33/1129081633.db2.gz LAGOAJKSHJYLDI-QGZVFWFLSA-N 1 3 298.540 3.716 20 0 CHADHO CCCC[N@H+](C)CC1CCN(Cc2ccc(CC)o2)CC1 ZINC000506859930 1122909249 /nfs/dbraw/zinc/90/92/49/1122909249.db2.gz GLVIYGWBTAXNEV-UHFFFAOYSA-N 1 3 292.467 3.786 20 0 CHADHO CCCC[N@@H+](C)CC1CCN(Cc2ccc(CC)o2)CC1 ZINC000506859930 1122909252 /nfs/dbraw/zinc/90/92/52/1122909252.db2.gz GLVIYGWBTAXNEV-UHFFFAOYSA-N 1 3 292.467 3.786 20 0 CHADHO c1cc(CNC2CC[NH+](C3CC3)CC2)cc(CC2CCC2)c1 ZINC001199078923 1123020310 /nfs/dbraw/zinc/02/03/10/1123020310.db2.gz WZHNPRMPZRKENF-UHFFFAOYSA-N 1 3 298.474 3.746 20 0 CHADHO CSc1ccccc1[C@H](C)[NH2+]CC[C@@H]1CCCCN1C ZINC000440612439 1123022141 /nfs/dbraw/zinc/02/21/41/1123022141.db2.gz JJTSHHVANFVMOA-GJZGRUSLSA-N 1 3 292.492 3.934 20 0 CHADHO C[C@@H]1[C@H](C[NH3+])CCCN1Cc1ccc(C(C)(C)C)cc1 ZINC001205903962 1123064994 /nfs/dbraw/zinc/06/49/94/1123064994.db2.gz SGGNQUYSLJOWJB-ZBFHGGJFSA-N 1 3 274.452 3.543 20 0 CHADHO C[C@H]1[C@H](C[NH3+])CCCN1Cc1ccc(C(C)(C)C)cc1 ZINC001205903960 1123065264 /nfs/dbraw/zinc/06/52/64/1123065264.db2.gz SGGNQUYSLJOWJB-HOCLYGCPSA-N 1 3 274.452 3.543 20 0 CHADHO CCC(C)(C)CCN1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000441400942 1123084419 /nfs/dbraw/zinc/08/44/19/1123084419.db2.gz MAVDFNACHTVGJP-NVXWUHKLSA-N 1 3 278.484 3.761 20 0 CHADHO CCC(C)(C)CCN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000441400942 1123084424 /nfs/dbraw/zinc/08/44/24/1123084424.db2.gz MAVDFNACHTVGJP-NVXWUHKLSA-N 1 3 278.484 3.761 20 0 CHADHO CCC(C)(C)CCN1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000441400941 1123084805 /nfs/dbraw/zinc/08/48/05/1123084805.db2.gz MAVDFNACHTVGJP-DOTOQJQBSA-N 1 3 278.484 3.761 20 0 CHADHO CCC(C)(C)CCN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000441400941 1123084808 /nfs/dbraw/zinc/08/48/08/1123084808.db2.gz MAVDFNACHTVGJP-DOTOQJQBSA-N 1 3 278.484 3.761 20 0 CHADHO C[N@H+](CC1CCCC1)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167994811 1123103192 /nfs/dbraw/zinc/10/31/92/1123103192.db2.gz QDWUWJYLXZPYDC-JWTNVVGKSA-N 1 3 276.468 3.514 20 0 CHADHO C[N@@H+](CC1CCCC1)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167994811 1123103194 /nfs/dbraw/zinc/10/31/94/1123103194.db2.gz QDWUWJYLXZPYDC-JWTNVVGKSA-N 1 3 276.468 3.514 20 0 CHADHO C[C@@H]1CC[N@@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)[C@H](C)C1 ZINC001167996145 1123117035 /nfs/dbraw/zinc/11/70/35/1123117035.db2.gz XLADJYAQEXSJSH-SUQXETJPSA-N 1 3 276.468 3.512 20 0 CHADHO C[C@@H]1CC[N@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)[C@H](C)C1 ZINC001167996145 1123117037 /nfs/dbraw/zinc/11/70/37/1123117037.db2.gz XLADJYAQEXSJSH-SUQXETJPSA-N 1 3 276.468 3.512 20 0 CHADHO CCC[C@H](C)C[N@@H+]1CCCC[C@H]1C[C@@H]1CCCN1C ZINC001201552088 1123118548 /nfs/dbraw/zinc/11/85/48/1123118548.db2.gz JHHGDKFQBZZRMM-ULQDDVLXSA-N 1 3 266.473 3.761 20 0 CHADHO CCC[C@H](C)C[N@H+]1CCCC[C@H]1C[C@@H]1CCCN1C ZINC001201552088 1123118552 /nfs/dbraw/zinc/11/85/52/1123118552.db2.gz JHHGDKFQBZZRMM-ULQDDVLXSA-N 1 3 266.473 3.761 20 0 CHADHO CCC[C@@H](C)C[N@@H+]1CCCC[C@@H]1C[C@@H]1CCCN1C ZINC001201552087 1123119068 /nfs/dbraw/zinc/11/90/68/1123119068.db2.gz JHHGDKFQBZZRMM-IXDOHACOSA-N 1 3 266.473 3.761 20 0 CHADHO CCC[C@@H](C)C[N@H+]1CCCC[C@@H]1C[C@@H]1CCCN1C ZINC001201552087 1123119069 /nfs/dbraw/zinc/11/90/69/1123119069.db2.gz JHHGDKFQBZZRMM-IXDOHACOSA-N 1 3 266.473 3.761 20 0 CHADHO CCCC[C@H](CC)CN1CCC([NH+]2CCCC2)CC1 ZINC001201562909 1123124372 /nfs/dbraw/zinc/12/43/72/1123124372.db2.gz IMRJDZPHFLIULT-INIZCTEOSA-N 1 3 266.473 3.763 20 0 CHADHO CC(C)C[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC001201616968 1123131968 /nfs/dbraw/zinc/13/19/68/1123131968.db2.gz DOUVRKORLQYXQN-GBESFXJTSA-N 1 3 286.463 3.533 20 0 CHADHO CC(C)[C@H](Cc1ccccc1)[NH2+]CCCN(C)C(C)C ZINC000427612011 1123195103 /nfs/dbraw/zinc/19/51/03/1123195103.db2.gz JZNNUQHSGIJKRB-SFHVURJKSA-N 1 3 276.468 3.574 20 0 CHADHO CCCC1(CN[C@@H]2C[C@@H]([NH3+])c3ccccc32)CCC1 ZINC000391797043 1123215299 /nfs/dbraw/zinc/21/52/99/1123215299.db2.gz DGLCEVJMXBFKGS-HZPDHXFCSA-N 1 3 258.409 3.691 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000536496456 1123233689 /nfs/dbraw/zinc/23/36/89/1123233689.db2.gz GZRZJOZVFBDJPR-DYVFJYSZSA-N 1 3 292.854 3.649 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000536496456 1123233691 /nfs/dbraw/zinc/23/36/91/1123233691.db2.gz GZRZJOZVFBDJPR-DYVFJYSZSA-N 1 3 292.854 3.649 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000536496456 1123233694 /nfs/dbraw/zinc/23/36/94/1123233694.db2.gz GZRZJOZVFBDJPR-DYVFJYSZSA-N 1 3 292.854 3.649 20 0 CHADHO COc1ccc2cc([C@@H](C)[NH2+]CC3(N)CCCC3)ccc2c1 ZINC000665250192 1123266141 /nfs/dbraw/zinc/26/61/41/1123266141.db2.gz KETIBECMVHUABQ-CQSZACIVSA-N 1 3 298.430 3.771 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NCC2CCC(F)(F)CC2)c2ccccc21 ZINC000335022293 1123291569 /nfs/dbraw/zinc/29/15/69/1123291569.db2.gz KTHCGQIQRDJURX-HUUCEWRRSA-N 1 3 280.362 3.546 20 0 CHADHO C[C@@H]([NH2+]C[C@H](C)CN1CCCC1)C1CCC(F)(F)CC1 ZINC000474033089 1123312462 /nfs/dbraw/zinc/31/24/62/1123312462.db2.gz KTHVNFHJHBLANH-UONOGXRCSA-N 1 3 288.426 3.522 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C[C@@H](C)C1CCCCC1 ZINC000665284050 1123315494 /nfs/dbraw/zinc/31/54/94/1123315494.db2.gz ZMNBZCMGQYYFSN-ZIAGYGMSSA-N 1 3 289.467 3.716 20 0 CHADHO C[C@@H]1CCC[C@@H]1C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000467442419 1123318642 /nfs/dbraw/zinc/31/86/42/1123318642.db2.gz FULAOZYQGASBBT-HZPDHXFCSA-N 1 3 278.484 3.809 20 0 CHADHO CCC1(N2CCC2)CC[NH+]([C@@H](C)Cc2ccsc2)CC1 ZINC000895827518 1123517409 /nfs/dbraw/zinc/51/74/09/1123517409.db2.gz LYUGLHOPIFPVJV-HNNXBMFYSA-N 1 3 292.492 3.629 20 0 CHADHO COc1ccc([C@H](C)[C@@H](C)[NH2+]CCCN(C)C(C)C)cc1 ZINC000474465204 1123534945 /nfs/dbraw/zinc/53/49/45/1123534945.db2.gz WOKRTFRPXFWHEQ-HZPDHXFCSA-N 1 3 292.467 3.507 20 0 CHADHO CCN1CC[C@@H](C[NH2+]C[C@H](CC(C)C)c2ccccc2)C1 ZINC000474497802 1123541029 /nfs/dbraw/zinc/54/10/29/1123541029.db2.gz ZBSRURNBGHKBOI-HKUYNNGSSA-N 1 3 288.479 3.748 20 0 CHADHO CC[C@@H]([NH2+]C1CCN(C2CCCCC2)CC1)C1CC1 ZINC000157553192 1129129886 /nfs/dbraw/zinc/12/98/86/1129129886.db2.gz MZGFAYOKFPWLDZ-QGZVFWFLSA-N 1 3 264.457 3.562 20 0 CHADHO C[C@H](CNc1ccnc2ccccc21)C[NH+]1CCCCC1 ZINC000041720957 1123594499 /nfs/dbraw/zinc/59/44/99/1123594499.db2.gz GROLWXKHQQTXPN-OAHLLOKOSA-N 1 3 283.419 3.769 20 0 CHADHO Cc1cc(F)ccc1[C@H](C)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000858491630 1123657770 /nfs/dbraw/zinc/65/77/70/1123657770.db2.gz MDBWVIAOXBTRCG-LSDHHAIUSA-N 1 3 278.415 3.517 20 0 CHADHO CC1=CCC[C@@H](C)[C@H]1C[N@@H+]1CCCC12CCN(C)CC2 ZINC000475131413 1123796459 /nfs/dbraw/zinc/79/64/59/1123796459.db2.gz RNSILQGMBSXIDN-SJORKVTESA-N 1 3 276.468 3.539 20 0 CHADHO CC1=CCC[C@@H](C)[C@H]1C[N@H+]1CCCC12CCN(C)CC2 ZINC000475131413 1123796464 /nfs/dbraw/zinc/79/64/64/1123796464.db2.gz RNSILQGMBSXIDN-SJORKVTESA-N 1 3 276.468 3.539 20 0 CHADHO C/C(=C\c1ccccc1)C[NH2+]C1CCN(CC(C)C)CC1 ZINC000102421165 1123869187 /nfs/dbraw/zinc/86/91/87/1123869187.db2.gz HHGYTZSVAUHIKM-GHRIWEEISA-N 1 3 286.463 3.800 20 0 CHADHO CC[NH+]1CCC(N[C@H](C)c2ccc3c(c2)CCCC3)CC1 ZINC000035011806 1124023535 /nfs/dbraw/zinc/02/35/35/1124023535.db2.gz PQUHCAYNXZCWBH-OAHLLOKOSA-N 1 3 286.463 3.700 20 0 CHADHO C[C@H](CN(C)CCC[NH+]1CCCCC1)c1ccccc1 ZINC000444574287 1124042722 /nfs/dbraw/zinc/04/27/22/1124042722.db2.gz PIJLKFZXODYKGU-QGZVFWFLSA-N 1 3 274.452 3.598 20 0 CHADHO CS[C@H]1C[C@H](NC2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)C1 ZINC000866486437 1124072084 /nfs/dbraw/zinc/07/20/84/1124072084.db2.gz HMWSULICPMXXES-MWQQHZPXSA-N 1 3 296.524 3.513 20 0 CHADHO CCc1ccc(C[N@H+](C)CC[C@H]2CCCCN2C)cc1 ZINC000525271861 1124119019 /nfs/dbraw/zinc/11/90/19/1124119019.db2.gz HLMCGBYVPXHXAP-GOSISDBHSA-N 1 3 274.452 3.555 20 0 CHADHO CCc1ccc(C[N@@H+](C)CC[C@H]2CCCCN2C)cc1 ZINC000525271861 1124119020 /nfs/dbraw/zinc/11/90/20/1124119020.db2.gz HLMCGBYVPXHXAP-GOSISDBHSA-N 1 3 274.452 3.555 20 0 CHADHO C[C@H](CC[NH2+]CC(C)(C)CN1CCCC1)c1ccccc1 ZINC000446779778 1124123039 /nfs/dbraw/zinc/12/30/39/1124123039.db2.gz CAZZACFQLQTMAS-QGZVFWFLSA-N 1 3 288.479 3.892 20 0 CHADHO CCC[C@H]([NH2+]C[C@@H]1CCCN(CC)C1)c1cc(C)ccn1 ZINC001118991243 1131244428 /nfs/dbraw/zinc/24/44/28/1131244428.db2.gz JPCVFGAOJBWKMY-IRXDYDNUSA-N 1 3 289.467 3.553 20 0 CHADHO CC[NH+]1CCC(N[C@@H]2C[C@@H](C(C)C)c3ccccc32)CC1 ZINC000447521199 1124479848 /nfs/dbraw/zinc/47/98/48/1124479848.db2.gz VPSNXKOZRILUNH-RBUKOAKNSA-N 1 3 286.463 3.945 20 0 CHADHO CC(C)[C@@H]1C[C@@H](NC[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc21 ZINC000447536964 1124485299 /nfs/dbraw/zinc/48/52/99/1124485299.db2.gz ROSSZUNULRCPHG-UIAACRFSSA-N 1 3 298.474 3.945 20 0 CHADHO CC(C)[C@@H]1C[C@@H](NC[C@H]2CC[N@H+](C3CC3)C2)c2ccccc21 ZINC000447536964 1124485301 /nfs/dbraw/zinc/48/53/01/1124485301.db2.gz ROSSZUNULRCPHG-UIAACRFSSA-N 1 3 298.474 3.945 20 0 CHADHO CC[C@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)C1CCCC1 ZINC000449131482 1124653380 /nfs/dbraw/zinc/65/33/80/1124653380.db2.gz MWQNCTFPHVVARM-WBVHZDCISA-N 1 3 266.473 3.665 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1cccc([O-])c1F ZINC000872017323 1124656573 /nfs/dbraw/zinc/65/65/73/1124656573.db2.gz ZEZNUVHLDOWRQO-KGLIPLIRSA-N 1 3 296.430 3.692 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1cccc([O-])c1F ZINC000872017324 1124657329 /nfs/dbraw/zinc/65/73/29/1124657329.db2.gz ZEZNUVHLDOWRQO-UONOGXRCSA-N 1 3 296.430 3.692 20 0 CHADHO CC(C)[NH+](CCCN[C@H]1CCO[C@H](C(C)(C)C)C1)C(C)C ZINC000872039469 1124663660 /nfs/dbraw/zinc/66/36/60/1124663660.db2.gz FQQPPWIXZLGXGP-IRXDYDNUSA-N 1 3 298.515 3.679 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CCC[C@H]2C=CCC2)CC1 ZINC000872107374 1124684920 /nfs/dbraw/zinc/68/49/20/1124684920.db2.gz LSMCBEOGAOMDAN-HNNXBMFYSA-N 1 3 264.457 3.585 20 0 CHADHO CC[N@@H+]1CC[C@H](N[C@@H]2CCCc3c(F)cccc32)[C@H](C)C1 ZINC000449349856 1124697406 /nfs/dbraw/zinc/69/74/06/1124697406.db2.gz KNFVJMGQBVFWHY-JEBQAFNWSA-N 1 3 290.426 3.523 20 0 CHADHO CC[N@H+]1CC[C@H](N[C@@H]2CCCc3c(F)cccc32)[C@H](C)C1 ZINC000449349856 1124697408 /nfs/dbraw/zinc/69/74/08/1124697408.db2.gz KNFVJMGQBVFWHY-JEBQAFNWSA-N 1 3 290.426 3.523 20 0 CHADHO C[C@H]1CCCC[C@H]1[NH+]1CCC(NC2CC(C)(F)C2)CC1 ZINC000449374635 1124704888 /nfs/dbraw/zinc/70/48/88/1124704888.db2.gz BGVNNBARESHDKW-MHABSNSOSA-N 1 3 282.447 3.510 20 0 CHADHO CCCc1ccc2nccc(N3CCC([NH+](C)C)CC3)c2c1 ZINC000450251110 1124957062 /nfs/dbraw/zinc/95/70/62/1124957062.db2.gz QZFZGCSCQRTTFW-UHFFFAOYSA-N 1 3 297.446 3.718 20 0 CHADHO CSC(C)(C)CC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000877081061 1125006712 /nfs/dbraw/zinc/00/67/12/1125006712.db2.gz TZWCAXQGKPSPJH-UHFFFAOYSA-N 1 3 298.540 3.905 20 0 CHADHO CC[C@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cc(C)ccc1C ZINC000530223084 1125133227 /nfs/dbraw/zinc/13/32/27/1125133227.db2.gz MLMGROKLQCDGHY-ONYGOOLBSA-N 1 3 272.436 3.627 20 0 CHADHO C[NH+](C)[C@@H]1CCC[C@@H](N[C@H](CC2CC2)c2ccccc2)C1 ZINC000532248060 1125243964 /nfs/dbraw/zinc/24/39/64/1125243964.db2.gz DDUROECHIDYVCX-GUDVDZBRSA-N 1 3 286.463 3.990 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@H](CC2CC2)c2ccccc2)C1 ZINC000532248060 1125243967 /nfs/dbraw/zinc/24/39/67/1125243967.db2.gz DDUROECHIDYVCX-GUDVDZBRSA-N 1 3 286.463 3.990 20 0 CHADHO Cc1cccc(C[NH+]2CCC(NCc3ccccc3)CC2)c1 ZINC000061017778 1125367897 /nfs/dbraw/zinc/36/78/97/1125367897.db2.gz PFPFYATZWOTBTD-UHFFFAOYSA-N 1 3 294.442 3.749 20 0 CHADHO C[N@@H+]1CCC[C@H]2CN(Cc3ccc4ccccc4c3)CC[C@H]21 ZINC000532536502 1125409005 /nfs/dbraw/zinc/40/90/05/1125409005.db2.gz OAGMSUNIGKRZAT-VQTJNVASSA-N 1 3 294.442 3.756 20 0 CHADHO C[N@H+]1CCC[C@H]2CN(Cc3ccc4ccccc4c3)CC[C@H]21 ZINC000532536502 1125409009 /nfs/dbraw/zinc/40/90/09/1125409009.db2.gz OAGMSUNIGKRZAT-VQTJNVASSA-N 1 3 294.442 3.756 20 0 CHADHO CN1CCC[C@H]2C[N@H+](Cc3ccc4ccccc4c3)CC[C@H]21 ZINC000532536502 1125409012 /nfs/dbraw/zinc/40/90/12/1125409012.db2.gz OAGMSUNIGKRZAT-VQTJNVASSA-N 1 3 294.442 3.756 20 0 CHADHO CN1CCC[C@H]2C[N@@H+](Cc3ccc4ccccc4c3)CC[C@H]21 ZINC000532536502 1125409015 /nfs/dbraw/zinc/40/90/15/1125409015.db2.gz OAGMSUNIGKRZAT-VQTJNVASSA-N 1 3 294.442 3.756 20 0 CHADHO CC(C)[C@H](NC[C@H]1CCC[NH2+]C1)c1ccc(Cl)cc1 ZINC000132077827 1125413713 /nfs/dbraw/zinc/41/37/13/1125413713.db2.gz SBPONZIDDBFZRP-BBRMVZONSA-N 1 3 280.843 3.626 20 0 CHADHO CC[C@@H]1c2ccsc2CC[N@H+]1CC[C@@H]1CCCN1C ZINC000124925947 1125443045 /nfs/dbraw/zinc/44/30/45/1125443045.db2.gz USKOMTPNBBBKMI-DZGCQCFKSA-N 1 3 278.465 3.542 20 0 CHADHO CC[C@@H]1c2ccsc2CC[N@@H+]1CC[C@@H]1CCCN1C ZINC000124925947 1125443048 /nfs/dbraw/zinc/44/30/48/1125443048.db2.gz USKOMTPNBBBKMI-DZGCQCFKSA-N 1 3 278.465 3.542 20 0 CHADHO CC[C@H](NC[C@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1 ZINC000125783134 1125452348 /nfs/dbraw/zinc/45/23/48/1125452348.db2.gz NYISISIFOCYTHP-AEFFLSMTSA-N 1 3 274.452 3.848 20 0 CHADHO CC[C@H](NC[C@H]1CCC[N@H+](C(C)C)C1)c1ccccc1 ZINC000125783134 1125452352 /nfs/dbraw/zinc/45/23/52/1125452352.db2.gz NYISISIFOCYTHP-AEFFLSMTSA-N 1 3 274.452 3.848 20 0 CHADHO CC[C@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)c1ccccc1 ZINC000125783134 1125452355 /nfs/dbraw/zinc/45/23/55/1125452355.db2.gz NYISISIFOCYTHP-AEFFLSMTSA-N 1 3 274.452 3.848 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+][C@@H](c1ccccc1)C1CCC1 ZINC000348267280 1125452456 /nfs/dbraw/zinc/45/24/56/1125452456.db2.gz PUGGNPFLRWNURP-MSOLQXFVSA-N 1 3 272.436 3.602 20 0 CHADHO C[N@@H+]1CCC[C@@H]1CCN[C@@H](c1ccccc1)C1CCC1 ZINC000348267280 1125452460 /nfs/dbraw/zinc/45/24/60/1125452460.db2.gz PUGGNPFLRWNURP-MSOLQXFVSA-N 1 3 272.436 3.602 20 0 CHADHO C[N@H+]1CCC[C@@H]1CCN[C@@H](c1ccccc1)C1CCC1 ZINC000348267280 1125452463 /nfs/dbraw/zinc/45/24/63/1125452463.db2.gz PUGGNPFLRWNURP-MSOLQXFVSA-N 1 3 272.436 3.602 20 0 CHADHO CCc1ccc(C[NH2+]C2CCN(C(C)(C)C)CC2)cc1 ZINC000037786300 1129270204 /nfs/dbraw/zinc/27/02/04/1129270204.db2.gz FJLLEJOZNQNLMS-UHFFFAOYSA-N 1 3 274.452 3.602 20 0 CHADHO CN(C)[C@@H]1CCC[N@H+](C[C@@]2(C)C[C@@H]2c2ccccc2)CC1 ZINC000639105124 1129281546 /nfs/dbraw/zinc/28/15/46/1129281546.db2.gz RVTPNWVAASDKRA-GUDVDZBRSA-N 1 3 286.463 3.596 20 0 CHADHO CN(C)[C@@H]1CCC[N@@H+](C[C@@]2(C)C[C@@H]2c2ccccc2)CC1 ZINC000639105124 1129281549 /nfs/dbraw/zinc/28/15/49/1129281549.db2.gz RVTPNWVAASDKRA-GUDVDZBRSA-N 1 3 286.463 3.596 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2cccs2)C1 ZINC000639169619 1129288211 /nfs/dbraw/zinc/28/82/11/1129288211.db2.gz HNBAIEGKSPSBSN-XUWVNRHRSA-N 1 3 292.492 3.560 20 0 CHADHO CCCCC[C@@H](CC)[NH+]1CCC(N(C)C2CC2)CC1 ZINC001258443669 1129362524 /nfs/dbraw/zinc/36/25/24/1129362524.db2.gz NWLUYZLGSPIHQC-OAHLLOKOSA-N 1 3 266.473 3.904 20 0 CHADHO CCCCN1CCC([NH2+]Cc2cc(Cl)cs2)CC1 ZINC000093094534 1129416453 /nfs/dbraw/zinc/41/64/53/1129416453.db2.gz ZVJBKWFYFWGNCS-UHFFFAOYSA-N 1 3 286.872 3.756 20 0 CHADHO CCC[C@H](C[NH+]1CCC(N(C)C)CC1)c1ccccc1 ZINC000179728020 1129432344 /nfs/dbraw/zinc/43/23/44/1129432344.db2.gz NWZZUCROYLJNDJ-QGZVFWFLSA-N 1 3 274.452 3.596 20 0 CHADHO CCC[C@H](CN1CCC([NH+](C)C)CC1)c1ccccc1 ZINC000179728020 1129432348 /nfs/dbraw/zinc/43/23/48/1129432348.db2.gz NWZZUCROYLJNDJ-QGZVFWFLSA-N 1 3 274.452 3.596 20 0 CHADHO CCC[C@@H]([NH2+]C[C@H](C)N)c1ccc(Cl)c(Cl)c1 ZINC000643528911 1129444404 /nfs/dbraw/zinc/44/44/04/1129444404.db2.gz QUBVXDZCIJBUKA-TVQRCGJNSA-N 1 3 275.223 3.771 20 0 CHADHO CC(C)C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCNC3(CCC3)C2)C1 ZINC000643548674 1129445810 /nfs/dbraw/zinc/44/58/10/1129445810.db2.gz SXQKHRHQLYSTLQ-YESZJQIVSA-N 1 3 278.484 3.856 20 0 CHADHO CCc1oc2ccccc2c1CN1CC[C@@H]([NH3+])[C@@H](CC)C1 ZINC000647498939 1129580210 /nfs/dbraw/zinc/58/02/10/1129580210.db2.gz UINCCRUZXXXDIM-XJKSGUPXSA-N 1 3 286.419 3.554 20 0 CHADHO CCC[C@H](C[N@@H+]1CC[C@@H](N)[C@@H](CC)C1)c1ccccc1 ZINC000647498628 1129580546 /nfs/dbraw/zinc/58/05/46/1129580546.db2.gz LLTMKCQQJQROBK-CGTJXYLNSA-N 1 3 274.452 3.630 20 0 CHADHO CCC[C@H](C[N@H+]1CC[C@@H](N)[C@@H](CC)C1)c1ccccc1 ZINC000647498628 1129580550 /nfs/dbraw/zinc/58/05/50/1129580550.db2.gz LLTMKCQQJQROBK-CGTJXYLNSA-N 1 3 274.452 3.630 20 0 CHADHO Cc1cc(Cl)cc(C)c1CNCc1ccc(C[NH3+])cc1 ZINC000647552938 1129581179 /nfs/dbraw/zinc/58/11/79/1129581179.db2.gz ADABCMUFUUGFRM-UHFFFAOYSA-N 1 3 288.822 3.705 20 0 CHADHO [NH3+]C[C@H]1CCN(Cc2ccc(C3CCCCC3)cc2)C1 ZINC000647829725 1129585280 /nfs/dbraw/zinc/58/52/80/1129585280.db2.gz QXHKLSSFRPVFLD-MRXNPFEDSA-N 1 3 272.436 3.515 20 0 CHADHO CCC[NH+]1CCC(N(C)Cc2cccc3cnccc32)CC1 ZINC000183139425 1129618708 /nfs/dbraw/zinc/61/87/08/1129618708.db2.gz SQMUQZNBKFVFGP-UHFFFAOYSA-N 1 3 297.446 3.541 20 0 CHADHO CCC[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC001169098871 1129696509 /nfs/dbraw/zinc/69/65/09/1129696509.db2.gz LXDGQVIVYCZIGQ-FJIDUMEYSA-N 1 3 272.436 3.743 20 0 CHADHO CCC[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC001169098871 1129696512 /nfs/dbraw/zinc/69/65/12/1129696512.db2.gz LXDGQVIVYCZIGQ-FJIDUMEYSA-N 1 3 272.436 3.743 20 0 CHADHO CN1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccc3ccccc3c1)C2 ZINC001169089310 1129699316 /nfs/dbraw/zinc/69/93/16/1129699316.db2.gz BCCYNVDEIDOFME-REPLKXPHSA-N 1 3 280.415 3.555 20 0 CHADHO Cc1cccc([C@@H](C)N[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1C ZINC001169119558 1129700042 /nfs/dbraw/zinc/70/00/42/1129700042.db2.gz UJWPYCHASYRCGE-WCXIOVBPSA-N 1 3 272.436 3.579 20 0 CHADHO Cc1cccc([C@@H](C)N[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1C ZINC001169119558 1129700044 /nfs/dbraw/zinc/70/00/44/1129700044.db2.gz UJWPYCHASYRCGE-WCXIOVBPSA-N 1 3 272.436 3.579 20 0 CHADHO Cc1cccc(CN(C2CC2)[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1C ZINC001169153426 1129705415 /nfs/dbraw/zinc/70/54/15/1129705415.db2.gz ISZYNTKGJDHXCV-ACDBMABISA-N 1 3 298.474 3.893 20 0 CHADHO Cc1cccc(CN(C2CC2)[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1C ZINC001169153426 1129705417 /nfs/dbraw/zinc/70/54/17/1129705417.db2.gz ISZYNTKGJDHXCV-ACDBMABISA-N 1 3 298.474 3.893 20 0 CHADHO CCN(Cc1ccc(Cl)cc1)C1CC[NH+](CC)CC1 ZINC001169266590 1129712382 /nfs/dbraw/zinc/71/23/82/1129712382.db2.gz XAAXLTNHXRWHNL-UHFFFAOYSA-N 1 3 280.843 3.646 20 0 CHADHO C[NH2+]Cc1ccccc1CNCc1ccc(C(C)C)cc1 ZINC000650718836 1129720938 /nfs/dbraw/zinc/72/09/38/1129720938.db2.gz XQOOHNPHEIUYJW-UHFFFAOYSA-N 1 3 282.431 3.819 20 0 CHADHO CC(C)(CCN1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1)C1CC1 ZINC000653586879 1129786419 /nfs/dbraw/zinc/78/64/19/1129786419.db2.gz GJUZOXTZXFLALH-CRAIPNDOSA-N 1 3 290.495 3.761 20 0 CHADHO CC(C)(CCN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)C1CC1 ZINC000653586879 1129786423 /nfs/dbraw/zinc/78/64/23/1129786423.db2.gz GJUZOXTZXFLALH-CRAIPNDOSA-N 1 3 290.495 3.761 20 0 CHADHO CC(C)(CCN1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)C1CC1 ZINC000653586880 1129786861 /nfs/dbraw/zinc/78/68/61/1129786861.db2.gz GJUZOXTZXFLALH-MAUKXSAKSA-N 1 3 290.495 3.761 20 0 CHADHO CC(C)(CCN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)C1CC1 ZINC000653586880 1129786863 /nfs/dbraw/zinc/78/68/63/1129786863.db2.gz GJUZOXTZXFLALH-MAUKXSAKSA-N 1 3 290.495 3.761 20 0 CHADHO c1ccc(CC2(NC3C[C@H]4CC[C@@H](C3)[N@H+]4C3CC3)CC2)cc1 ZINC000903151841 1130119370 /nfs/dbraw/zinc/11/93/70/1130119370.db2.gz JAOKQQYQKDAEFW-JLYLLQBASA-N 1 3 296.458 3.509 20 0 CHADHO c1ccc(CC2(NC3C[C@H]4CC[C@@H](C3)[N@@H+]4C3CC3)CC2)cc1 ZINC000903151841 1130119374 /nfs/dbraw/zinc/11/93/74/1130119374.db2.gz JAOKQQYQKDAEFW-JLYLLQBASA-N 1 3 296.458 3.509 20 0 CHADHO CC(C)CCC[C@@H](C)N1CCC([NH3+])(CC2CC2)CC1 ZINC001170072066 1130146337 /nfs/dbraw/zinc/14/63/37/1130146337.db2.gz XPKLTZCNARVVSL-OAHLLOKOSA-N 1 3 266.473 3.795 20 0 CHADHO c1cc2cncc(-c3ccc(C[NH+]4CCCC4)cc3)c2[nH]1 ZINC001240059509 1130206906 /nfs/dbraw/zinc/20/69/06/1130206906.db2.gz LIHNCYKJBCBHRJ-UHFFFAOYSA-N 1 3 277.371 3.826 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H]2c3ccccc3CC[C@@H]2C)C1 ZINC000678767551 1130451034 /nfs/dbraw/zinc/45/10/34/1130451034.db2.gz NEEZRWRRDITVCO-FCEWJHQRSA-N 1 3 286.463 3.632 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H]2c3ccccc3CC[C@@H]2C)C1 ZINC000678767551 1130451038 /nfs/dbraw/zinc/45/10/38/1130451038.db2.gz NEEZRWRRDITVCO-FCEWJHQRSA-N 1 3 286.463 3.632 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2c3ccccc3CC[C@@H]2C)C1 ZINC000678767551 1130451043 /nfs/dbraw/zinc/45/10/43/1130451043.db2.gz NEEZRWRRDITVCO-FCEWJHQRSA-N 1 3 286.463 3.632 20 0 CHADHO CC(C)[NH+]1CCC(N(C)CC(C)(C)c2ccccc2)CC1 ZINC000678811523 1130457800 /nfs/dbraw/zinc/45/78/00/1130457800.db2.gz BYBGYGMLRIJSND-UHFFFAOYSA-N 1 3 288.479 3.769 20 0 CHADHO CC(C)N(Cc1ccc(Cl)cc1)[C@@H]1CCC[NH2+]CC1 ZINC001206579906 1130487222 /nfs/dbraw/zinc/48/72/22/1130487222.db2.gz AUCOIJSVSSXBAB-MRXNPFEDSA-N 1 3 280.843 3.693 20 0 CHADHO CC(C)[N@H+](C)Cc1ccccc1CNCc1ccc(O)cc1 ZINC000679399473 1130526974 /nfs/dbraw/zinc/52/69/74/1130526974.db2.gz AFKOUQLEJKBSHO-UHFFFAOYSA-N 1 3 298.430 3.522 20 0 CHADHO CC(C)[N@@H+](C)Cc1ccccc1CNCc1ccc(O)cc1 ZINC000679399473 1130526976 /nfs/dbraw/zinc/52/69/76/1130526976.db2.gz AFKOUQLEJKBSHO-UHFFFAOYSA-N 1 3 298.430 3.522 20 0 CHADHO CCC(CC)C[NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000679738933 1130553149 /nfs/dbraw/zinc/55/31/49/1130553149.db2.gz GVHQFAIWSVLKPB-GDBMZVCRSA-N 1 3 266.473 3.665 20 0 CHADHO Cc1ccc(C[N@@H+]2CCCC23CCNCC3)c2ccccc12 ZINC001235141730 1130714637 /nfs/dbraw/zinc/71/46/37/1130714637.db2.gz XFTCWMNTVVBTAG-UHFFFAOYSA-N 1 3 294.442 3.866 20 0 CHADHO Cc1ccc(C[N@H+]2CCCC23CCNCC3)c2ccccc12 ZINC001235141730 1130714641 /nfs/dbraw/zinc/71/46/41/1130714641.db2.gz XFTCWMNTVVBTAG-UHFFFAOYSA-N 1 3 294.442 3.866 20 0 CHADHO c1cc2ccc(CN3CCCC34CC[NH2+]CC4)cc2s1 ZINC001235143524 1130714793 /nfs/dbraw/zinc/71/47/93/1130714793.db2.gz DMSFEBKZRQARJG-UHFFFAOYSA-N 1 3 286.444 3.619 20 0 CHADHO CC(C)c1cccc(CN2CCCCC23CC[NH2+]CC3)c1 ZINC001235190636 1130721239 /nfs/dbraw/zinc/72/12/39/1130721239.db2.gz GQXYOFFXDWRUTP-UHFFFAOYSA-N 1 3 286.463 3.918 20 0 CHADHO CC(C)c1cccc(C[N@@H+]2CCCCC23CCNCC3)c1 ZINC001235190636 1130721241 /nfs/dbraw/zinc/72/12/41/1130721241.db2.gz GQXYOFFXDWRUTP-UHFFFAOYSA-N 1 3 286.463 3.918 20 0 CHADHO CC(C)c1cccc(C[N@H+]2CCCCC23CCNCC3)c1 ZINC001235190636 1130721246 /nfs/dbraw/zinc/72/12/46/1130721246.db2.gz GQXYOFFXDWRUTP-UHFFFAOYSA-N 1 3 286.463 3.918 20 0 CHADHO Cc1cc(C)c(C[N@@H+]2CCCCC23CCNCC3)c(C)c1 ZINC001235191707 1130722162 /nfs/dbraw/zinc/72/21/62/1130722162.db2.gz WKKWUZYSBHKYCX-UHFFFAOYSA-N 1 3 286.463 3.720 20 0 CHADHO Cc1cc(C)c(C[N@H+]2CCCCC23CCNCC3)c(C)c1 ZINC001235191707 1130722166 /nfs/dbraw/zinc/72/21/66/1130722166.db2.gz WKKWUZYSBHKYCX-UHFFFAOYSA-N 1 3 286.463 3.720 20 0 CHADHO Cc1ccc([C@@H]2CCCN2CC[C@@H]2CCCC[NH2+]2)cc1 ZINC001235679049 1130768301 /nfs/dbraw/zinc/76/83/01/1130768301.db2.gz OFJJMJOVAMCLLW-ROUUACIJSA-N 1 3 272.436 3.664 20 0 CHADHO Cc1cccc(C)c1-c1cccc(CN2CC[C@H](C[NH3+])C2)c1 ZINC001235748583 1130775862 /nfs/dbraw/zinc/77/58/62/1130775862.db2.gz CHTLYCYDXAMRHO-GOSISDBHSA-N 1 3 294.442 3.751 20 0 CHADHO Cc1ccc(-c2ccc(CN3CC4(CC([NH3+])C4)C3)cc2)cc1 ZINC001235819654 1130783329 /nfs/dbraw/zinc/78/33/29/1130783329.db2.gz GOKBRVZRTSTSQG-UHFFFAOYSA-N 1 3 292.426 3.585 20 0 CHADHO Cc1ccc(-c2cccc(CN3CC4(CC([NH3+])C4)C3)c2)cc1 ZINC001235820993 1130783682 /nfs/dbraw/zinc/78/36/82/1130783682.db2.gz WDQHLRADFWPGGF-UHFFFAOYSA-N 1 3 292.426 3.585 20 0 CHADHO COc1c(C)cc([C@@H](C)[NH2+]C[C@H](C)CN(C)C)cc1Cl ZINC000813876941 1130793078 /nfs/dbraw/zinc/79/30/78/1130793078.db2.gz DXOLMEJUTIIABP-WCQYABFASA-N 1 3 298.858 3.505 20 0 CHADHO Cc1c(C[N@H+]2C[C@H](N)CC[C@H]2C)cccc1-c1ccccc1 ZINC001235891741 1130795238 /nfs/dbraw/zinc/79/52/38/1130795238.db2.gz IQJMHKCVFVLDFS-DNVCBOLYSA-N 1 3 294.442 3.974 20 0 CHADHO Cc1c(C[N@@H+]2C[C@H](N)CC[C@H]2C)cccc1-c1ccccc1 ZINC001235891741 1130795243 /nfs/dbraw/zinc/79/52/43/1130795243.db2.gz IQJMHKCVFVLDFS-DNVCBOLYSA-N 1 3 294.442 3.974 20 0 CHADHO CC1(C)[C@@H]2C[C@H]([NH2+]C3CCN(CC4CCCC4)CC3)C[C@@H]21 ZINC001170729220 1130829049 /nfs/dbraw/zinc/82/90/49/1130829049.db2.gz BMZOMIMJERIKKQ-BCDXTJNWSA-N 1 3 290.495 3.665 20 0 CHADHO C[C@H]1C[N@H+](Cc2ccccc2-c2ccc(F)cc2)CCCN1 ZINC001236095812 1130859908 /nfs/dbraw/zinc/85/99/08/1130859908.db2.gz ZHTOJDCGRHJERS-HNNXBMFYSA-N 1 3 298.405 3.677 20 0 CHADHO C[C@H]1C[N@@H+](Cc2ccccc2-c2ccc(F)cc2)CCCN1 ZINC001236095812 1130859912 /nfs/dbraw/zinc/85/99/12/1130859912.db2.gz ZHTOJDCGRHJERS-HNNXBMFYSA-N 1 3 298.405 3.677 20 0 CHADHO CCC[N@H+](Cc1ccc(F)c2ccoc21)C1CCNCC1 ZINC001236183943 1130882040 /nfs/dbraw/zinc/88/20/40/1130882040.db2.gz CLUZQCXAZOPUSV-UHFFFAOYSA-N 1 3 290.382 3.536 20 0 CHADHO CCC[N@@H+](Cc1ccc(F)c2ccoc21)C1CCNCC1 ZINC001236183943 1130882043 /nfs/dbraw/zinc/88/20/43/1130882043.db2.gz CLUZQCXAZOPUSV-UHFFFAOYSA-N 1 3 290.382 3.536 20 0 CHADHO C[NH2+]C1CCC(N(C)Cc2ccc(F)c(C)c2Cl)CC1 ZINC001236216266 1130892156 /nfs/dbraw/zinc/89/21/56/1130892156.db2.gz WJIKKYFGLMDXDQ-UHFFFAOYSA-N 1 3 298.833 3.750 20 0 CHADHO CN(Cc1ccc(C2CCC2)cc1)C1(C)CC[NH2+]CC1 ZINC001236225748 1130896523 /nfs/dbraw/zinc/89/65/23/1130896523.db2.gz FEKWRTOUFFPVBO-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO C[N@H+](Cc1ccc(C2CCC2)cc1)C1(C)CCNCC1 ZINC001236225748 1130896529 /nfs/dbraw/zinc/89/65/29/1130896529.db2.gz FEKWRTOUFFPVBO-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO C[N@@H+](Cc1ccc(C2CCC2)cc1)C1(C)CCNCC1 ZINC001236225748 1130896537 /nfs/dbraw/zinc/89/65/37/1130896537.db2.gz FEKWRTOUFFPVBO-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO C1=CC[C@H](C[N@@H+](C[C@@H]2CCCNC2)C2CCCC2)CC1 ZINC001236371701 1130922325 /nfs/dbraw/zinc/92/23/25/1130922325.db2.gz MEZFNZYRMSBYRR-DLBZAZTESA-N 1 3 276.468 3.587 20 0 CHADHO C1=CC[C@H](C[N@H+](C[C@@H]2CCCNC2)C2CCCC2)CC1 ZINC001236371701 1130922329 /nfs/dbraw/zinc/92/23/29/1130922329.db2.gz MEZFNZYRMSBYRR-DLBZAZTESA-N 1 3 276.468 3.587 20 0 CHADHO Cc1ccc(C[N@H+](C[C@H]2CCCNC2)C2CCCC2)cc1 ZINC001236375525 1130923319 /nfs/dbraw/zinc/92/33/19/1130923319.db2.gz ZTHVMYMYHIRRIJ-SFHVURJKSA-N 1 3 286.463 3.739 20 0 CHADHO Cc1ccc(C[N@@H+](C[C@H]2CCCNC2)C2CCCC2)cc1 ZINC001236375525 1130923322 /nfs/dbraw/zinc/92/33/22/1130923322.db2.gz ZTHVMYMYHIRRIJ-SFHVURJKSA-N 1 3 286.463 3.739 20 0 CHADHO C[C@@H]1[C@@H](N)CCC[N@@H+]1Cc1cccc2c3ccccc3oc21 ZINC001236419412 1130934513 /nfs/dbraw/zinc/93/45/13/1130934513.db2.gz INSOLOLECCMIBI-DYVFJYSZSA-N 1 3 294.398 3.898 20 0 CHADHO C[C@@H]1[C@@H](N)CCC[N@H+]1Cc1cccc2c3ccccc3oc21 ZINC001236419412 1130934519 /nfs/dbraw/zinc/93/45/19/1130934519.db2.gz INSOLOLECCMIBI-DYVFJYSZSA-N 1 3 294.398 3.898 20 0 CHADHO C[C@@H]1[C@H](N)CCC[N@@H+]1Cc1cccc2c3ccccc3oc21 ZINC001236419411 1130935121 /nfs/dbraw/zinc/93/51/21/1130935121.db2.gz INSOLOLECCMIBI-CXAGYDPISA-N 1 3 294.398 3.898 20 0 CHADHO C[C@@H]1[C@H](N)CCC[N@H+]1Cc1cccc2c3ccccc3oc21 ZINC001236419411 1130935126 /nfs/dbraw/zinc/93/51/26/1130935126.db2.gz INSOLOLECCMIBI-CXAGYDPISA-N 1 3 294.398 3.898 20 0 CHADHO Cc1c(C)c(C)c(C[N@H+]2CCC[C@@H](N)[C@H]2C)c(C)c1C ZINC001236421398 1130935482 /nfs/dbraw/zinc/93/54/82/1130935482.db2.gz QRRJPLBXVFBYAG-SJLPKXTDSA-N 1 3 274.452 3.540 20 0 CHADHO Cc1c(C)c(C)c(C[N@@H+]2CCC[C@@H](N)[C@H]2C)c(C)c1C ZINC001236421398 1130935484 /nfs/dbraw/zinc/93/54/84/1130935484.db2.gz QRRJPLBXVFBYAG-SJLPKXTDSA-N 1 3 274.452 3.540 20 0 CHADHO CC(C)C[NH2+]Cc1ccc(-c2cncc(CN(C)C)c2)cc1 ZINC001236436206 1130941274 /nfs/dbraw/zinc/94/12/74/1130941274.db2.gz LOZRMZUZQXZJBM-UHFFFAOYSA-N 1 3 297.446 3.556 20 0 CHADHO CC(C)C[NH2+]Cc1ccc(-c2ccc3[nH]c(N)nc3c2)cc1 ZINC001236437396 1130941821 /nfs/dbraw/zinc/94/18/21/1130941821.db2.gz XYKWOGMNUJHBBR-UHFFFAOYSA-N 1 3 294.402 3.558 20 0 CHADHO CC(C)C[NH2+]Cc1ccc(-c2ccc3nc(N)[nH]c3c2)cc1 ZINC001236437396 1130941825 /nfs/dbraw/zinc/94/18/25/1130941825.db2.gz XYKWOGMNUJHBBR-UHFFFAOYSA-N 1 3 294.402 3.558 20 0 CHADHO Cc1sccc1C[N@H+](CC(C)(C)C)C1CCNCC1 ZINC001236459411 1130947134 /nfs/dbraw/zinc/94/71/34/1130947134.db2.gz NDQNYVFLBKJGRT-UHFFFAOYSA-N 1 3 280.481 3.657 20 0 CHADHO Cc1sccc1C[N@@H+](CC(C)(C)C)C1CCNCC1 ZINC001236459411 1130947136 /nfs/dbraw/zinc/94/71/36/1130947136.db2.gz NDQNYVFLBKJGRT-UHFFFAOYSA-N 1 3 280.481 3.657 20 0 CHADHO C[C@]1(C[NH3+])CCN(Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001236604810 1130983266 /nfs/dbraw/zinc/98/32/66/1130983266.db2.gz OKFRJINKPOVIRD-LJQANCHMSA-N 1 3 298.405 3.663 20 0 CHADHO C[C@]1(C[NH3+])CCN(Cc2ccc(C3CCCCC3)cc2)C1 ZINC001236617391 1130984867 /nfs/dbraw/zinc/98/48/67/1130984867.db2.gz VBBIVTOMQFCLJJ-LJQANCHMSA-N 1 3 286.463 3.905 20 0 CHADHO CC(C)c1cccc(C[N@H+](C2CCC2)C2CCNCC2)c1 ZINC001236636350 1130986461 /nfs/dbraw/zinc/98/64/61/1130986461.db2.gz DALRBCLGTIKAFP-UHFFFAOYSA-N 1 3 286.463 3.917 20 0 CHADHO CC(C)c1cccc(C[N@@H+](C2CCC2)C2CCNCC2)c1 ZINC001236636350 1130986464 /nfs/dbraw/zinc/98/64/64/1130986464.db2.gz DALRBCLGTIKAFP-UHFFFAOYSA-N 1 3 286.463 3.917 20 0 CHADHO CC(C)c1cccc(CN(C2CCC2)C2CC[NH2+]CC2)c1 ZINC001236636350 1130986468 /nfs/dbraw/zinc/98/64/68/1130986468.db2.gz DALRBCLGTIKAFP-UHFFFAOYSA-N 1 3 286.463 3.917 20 0 CHADHO CCC[C@@H](Cc1ccccc1)[N@H+](CCC)CCCNC ZINC001236662962 1130990473 /nfs/dbraw/zinc/99/04/73/1130990473.db2.gz MFZJFUXHKDWJKE-SFHVURJKSA-N 1 3 276.468 3.719 20 0 CHADHO CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)CCCNC ZINC001236662962 1130990479 /nfs/dbraw/zinc/99/04/79/1130990479.db2.gz MFZJFUXHKDWJKE-SFHVURJKSA-N 1 3 276.468 3.719 20 0 CHADHO CCCN(Cc1ccc2ccccc2c1)C[C@@H]1CC[NH2+]C1 ZINC001236834832 1131019212 /nfs/dbraw/zinc/01/92/12/1131019212.db2.gz IPBRTCVLGXWYCF-QGZVFWFLSA-N 1 3 282.431 3.661 20 0 CHADHO CCCN(Cc1ccc2ccccc2c1)C[C@H]1CC[NH2+]C1 ZINC001236834831 1131019838 /nfs/dbraw/zinc/01/98/38/1131019838.db2.gz IPBRTCVLGXWYCF-KRWDZBQOSA-N 1 3 282.431 3.661 20 0 CHADHO CCCN(Cc1cc(C)c(Cl)c(C)c1)C[C@@H]1CC[NH2+]C1 ZINC001236843708 1131020454 /nfs/dbraw/zinc/02/04/54/1131020454.db2.gz PVXGYBQSCQJQPO-OAHLLOKOSA-N 1 3 294.870 3.778 20 0 CHADHO CCCN(Cc1cccc(C(C)C)c1)C[C@H]1CC[NH2+]C1 ZINC001236842566 1131020921 /nfs/dbraw/zinc/02/09/21/1131020921.db2.gz FNJQNZZSJSFNRC-KRWDZBQOSA-N 1 3 274.452 3.632 20 0 CHADHO [NH3+]CCCCCCN1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001237058210 1131043217 /nfs/dbraw/zinc/04/32/17/1131043217.db2.gz XUDANKPFUKUBMY-MRXNPFEDSA-N 1 3 282.378 3.621 20 0 CHADHO Cc1ccc(-c2ccc(CN3CCC[C@](C)(C[NH3+])C3)cc2)o1 ZINC001237059277 1131043563 /nfs/dbraw/zinc/04/35/63/1131043563.db2.gz SGHCVVLVIJTVMM-LJQANCHMSA-N 1 3 298.430 3.816 20 0 CHADHO Cc1cccc(-c2ccc(C[N@H+]3C[C@@H](N)C[C@H]3C)cc2)c1 ZINC001237203246 1131071087 /nfs/dbraw/zinc/07/10/87/1131071087.db2.gz BVBLUPJHZIAWOH-BEFAXECRSA-N 1 3 280.415 3.584 20 0 CHADHO Cc1cccc(-c2ccc(C[N@@H+]3C[C@@H](N)C[C@H]3C)cc2)c1 ZINC001237203246 1131071092 /nfs/dbraw/zinc/07/10/92/1131071092.db2.gz BVBLUPJHZIAWOH-BEFAXECRSA-N 1 3 280.415 3.584 20 0 CHADHO CCc1cc(CN2CCC(C[NH+](C)C)CC2)ccc1Cl ZINC001237746076 1131138525 /nfs/dbraw/zinc/13/85/25/1131138525.db2.gz RYBYXXNYYAPREB-UHFFFAOYSA-N 1 3 294.870 3.676 20 0 CHADHO C[C@@H](C[NH3+])CN[C@@H](C)c1ccccc1SC(C)(C)C ZINC000817962407 1131192966 /nfs/dbraw/zinc/19/29/66/1131192966.db2.gz LERTWCPZCWZQGA-STQMWFEESA-N 1 3 280.481 3.823 20 0 CHADHO C[C@H]([NH2+]CC1(N)CCC1)c1ccc(SC(F)F)cc1 ZINC000817965051 1131193457 /nfs/dbraw/zinc/19/34/57/1131193457.db2.gz ODVBRYRMCUJUJP-JTQLQIEISA-N 1 3 286.391 3.533 20 0 CHADHO CCCCCC(C)(C)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246229086 1131415744 /nfs/dbraw/zinc/41/57/44/1131415744.db2.gz HZUSNEQQGLTZJG-QDMKHBRRSA-N 1 3 252.446 3.608 20 0 CHADHO CCCC[C@H]1C[C@@H]([NH2+][C@H](C)C2CCCCC2)CCN1 ZINC001246252802 1131433568 /nfs/dbraw/zinc/43/35/68/1131433568.db2.gz WRWUTVDZOOMBON-PVAVHDDUSA-N 1 3 266.473 3.856 20 0 CHADHO C[C@@H](CCN)[NH2+][C@@H](C)CCc1ccc(Cl)c(Cl)c1 ZINC001246302212 1131454536 /nfs/dbraw/zinc/45/45/36/1131454536.db2.gz WPAZGVGBLWPVSS-QWRGUYRKSA-N 1 3 289.250 3.641 20 0 CHADHO CCCC[C@H]1C[C@@H]([NH2+]CC(C)(C)CC(F)(F)F)CCN1 ZINC001246447109 1131503124 /nfs/dbraw/zinc/50/31/24/1131503124.db2.gz ONVCDFWGRQITDW-STQMWFEESA-N 1 3 294.405 3.865 20 0 CHADHO CCCCCC[C@@H](CC)[NH2+][C@H](C(C)C)C1CNC1 ZINC001246519215 1131545633 /nfs/dbraw/zinc/54/56/33/1131545633.db2.gz QYTFGLMZJQLENO-HZPDHXFCSA-N 1 3 254.462 3.569 20 0 CHADHO CCCCCC[C@H](CC)[N@H+]1CCC[C@@H](CN)[C@H]1C ZINC001246559390 1131621286 /nfs/dbraw/zinc/62/12/86/1131621286.db2.gz ANKJRNYOQYSXHF-PMPSAXMXSA-N 1 3 254.462 3.795 20 0 CHADHO CCCCCC[C@H](CC)[N@@H+]1CCC[C@@H](CN)[C@H]1C ZINC001246559390 1131621285 /nfs/dbraw/zinc/62/12/85/1131621285.db2.gz ANKJRNYOQYSXHF-PMPSAXMXSA-N 1 3 254.462 3.795 20 0 CHADHO CN1CC[C@@]2(CC[N@H+](Cc3ccc(F)c4ccccc34)C2)C1 ZINC001139891503 1131647339 /nfs/dbraw/zinc/64/73/39/1131647339.db2.gz ATPMXHBLQRXMMP-LJQANCHMSA-N 1 3 298.405 3.507 20 0 CHADHO CN1CC[C@@]2(CC[N@@H+](Cc3ccc(F)c4ccccc34)C2)C1 ZINC001139891503 1131647341 /nfs/dbraw/zinc/64/73/41/1131647341.db2.gz ATPMXHBLQRXMMP-LJQANCHMSA-N 1 3 298.405 3.507 20 0 CHADHO CC(C)(C)N1CCC([NH2+]Cc2cccc3c2CCC3)CC1 ZINC000845927983 1131671739 /nfs/dbraw/zinc/67/17/39/1131671739.db2.gz KWFONXAXFGJNHB-UHFFFAOYSA-N 1 3 286.463 3.528 20 0 CHADHO [NH3+]CCCCCCN1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000846217623 1131700825 /nfs/dbraw/zinc/70/08/25/1131700825.db2.gz GAONBLFLJUOIPT-INIZCTEOSA-N 1 3 282.378 3.621 20 0 CHADHO CCCCC[C@H](C)[N@H+](C(C)C)[C@@H]1CCCNCC1 ZINC001246593118 1131707102 /nfs/dbraw/zinc/70/71/02/1131707102.db2.gz LHNYFHCDSBNLRR-JKSUJKDBSA-N 1 3 254.462 3.808 20 0 CHADHO CCCCC[C@H](C)[N@@H+](C(C)C)[C@@H]1CCCNCC1 ZINC001246593118 1131707106 /nfs/dbraw/zinc/70/71/06/1131707106.db2.gz LHNYFHCDSBNLRR-JKSUJKDBSA-N 1 3 254.462 3.808 20 0 CHADHO CCCC[C@H]1C[C@H]([N@H+](C)[C@H]2CC[C@H](C)CC2)CCN1 ZINC001246995022 1131838469 /nfs/dbraw/zinc/83/84/69/1131838469.db2.gz FELLKIDXSUHQBZ-LUKYLMHMSA-N 1 3 266.473 3.808 20 0 CHADHO CN1CC[C@]2(CC[N@H+](Cc3cccc(C(C)(C)C)c3)C2)C1 ZINC001141106302 1132020434 /nfs/dbraw/zinc/02/04/34/1132020434.db2.gz WTQOWRKVURYETJ-IBGZPJMESA-N 1 3 286.463 3.512 20 0 CHADHO CN1CC[C@]2(CC[N@@H+](Cc3cccc(C(C)(C)C)c3)C2)C1 ZINC001141106302 1132020445 /nfs/dbraw/zinc/02/04/45/1132020445.db2.gz WTQOWRKVURYETJ-IBGZPJMESA-N 1 3 286.463 3.512 20 0 CHADHO C[C@H](CCCC(C)(C)O)[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001171623144 1132067524 /nfs/dbraw/zinc/06/75/24/1132067524.db2.gz LXEDBMVIRUAAPQ-CQSZACIVSA-N 1 3 298.515 3.557 20 0 CHADHO CN1C(C)(C)CC([N@H+](C)CC2CC(F)(F)C2)CC1(C)C ZINC001171639239 1132080759 /nfs/dbraw/zinc/08/07/59/1132080759.db2.gz ASMQKSBIRPHFRN-UHFFFAOYSA-N 1 3 288.426 3.615 20 0 CHADHO CN1C(C)(C)CC([N@@H+](C)CC2CC(F)(F)C2)CC1(C)C ZINC001171639239 1132080767 /nfs/dbraw/zinc/08/07/67/1132080767.db2.gz ASMQKSBIRPHFRN-UHFFFAOYSA-N 1 3 288.426 3.615 20 0 CHADHO C[C@@H]1CCN1[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171975470 1132116908 /nfs/dbraw/zinc/11/69/08/1132116908.db2.gz DCWFEUXTHBFQFX-NVXWUHKLSA-N 1 3 272.436 3.524 20 0 CHADHO C[C@@H]1CCN1[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171975470 1132116912 /nfs/dbraw/zinc/11/69/12/1132116912.db2.gz DCWFEUXTHBFQFX-NVXWUHKLSA-N 1 3 272.436 3.524 20 0 CHADHO CC1CN([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172078807 1132122993 /nfs/dbraw/zinc/12/29/93/1132122993.db2.gz IYQKJVOBRWCDHO-REPLKXPHSA-N 1 3 284.447 3.524 20 0 CHADHO CC1CN([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172078807 1132122997 /nfs/dbraw/zinc/12/29/97/1132122997.db2.gz IYQKJVOBRWCDHO-REPLKXPHSA-N 1 3 284.447 3.524 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@H]3CCCC[C@@H]31)C2 ZINC001172127036 1132125969 /nfs/dbraw/zinc/12/59/69/1132125969.db2.gz GNFDJNPAYOPJTF-SFFUCWETSA-N 1 3 276.468 3.656 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@H]3CCCC[C@@H]31)C2 ZINC001172127036 1132125974 /nfs/dbraw/zinc/12/59/74/1132125974.db2.gz GNFDJNPAYOPJTF-SFFUCWETSA-N 1 3 276.468 3.656 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC3(CC[C@@H](F)C3)CC1)C2 ZINC001172129051 1132127679 /nfs/dbraw/zinc/12/76/79/1132127679.db2.gz VUTYLZNIYAFSHU-WCXIOVBPSA-N 1 3 294.458 3.606 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@H]3CCCC[C@@H]31)C2 ZINC001172123509 1132135565 /nfs/dbraw/zinc/13/55/65/1132135565.db2.gz GNFDJNPAYOPJTF-ZBRFXRBCSA-N 1 3 276.468 3.656 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@H]3CCCC[C@@H]31)C2 ZINC001172123509 1132135567 /nfs/dbraw/zinc/13/55/67/1132135567.db2.gz GNFDJNPAYOPJTF-ZBRFXRBCSA-N 1 3 276.468 3.656 20 0 CHADHO CCCCN(C)CCC[NH2+][C@@H]1CC[C@H](C)[C@H](C)C1 ZINC001172358134 1132187054 /nfs/dbraw/zinc/18/70/54/1132187054.db2.gz DONTXSRYFVDXGB-ARFHVFGLSA-N 1 3 254.462 3.523 20 0 CHADHO C[C@@H]1CC[C@H]([NH+]2CCC(N3CCCCC3)CC2)C[C@@H]1C ZINC001172366705 1132192063 /nfs/dbraw/zinc/19/20/63/1132192063.db2.gz OWUBRQQCYGHMGT-RYRKJORJSA-N 1 3 278.484 3.761 20 0 CHADHO CC[C@H](CC(C)C)[NH2+]CCCN1CCC(C)CC1 ZINC001172384845 1132210548 /nfs/dbraw/zinc/21/05/48/1132210548.db2.gz JZXHJCKBAOTYEG-MRXNPFEDSA-N 1 3 254.462 3.523 20 0 CHADHO CN(C)CCC[N@H+](C)Cc1ccc2c(c1)Cc1ccccc1-2 ZINC001141734878 1132244776 /nfs/dbraw/zinc/24/47/76/1132244776.db2.gz MNMOZPOUNYTLQN-UHFFFAOYSA-N 1 3 294.442 3.641 20 0 CHADHO CN(C)CCC[N@@H+](C)Cc1ccc2c(c1)Cc1ccccc1-2 ZINC001141734878 1132244785 /nfs/dbraw/zinc/24/47/85/1132244785.db2.gz MNMOZPOUNYTLQN-UHFFFAOYSA-N 1 3 294.442 3.641 20 0 CHADHO CC(C)[N@H+](CCCN)[C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172531851 1132245374 /nfs/dbraw/zinc/24/53/74/1132245374.db2.gz BPGVDPNUNNRIFN-QZTJIDSGSA-N 1 3 274.452 3.772 20 0 CHADHO CC(C)[N@@H+](CCCN)[C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172531851 1132245377 /nfs/dbraw/zinc/24/53/77/1132245377.db2.gz BPGVDPNUNNRIFN-QZTJIDSGSA-N 1 3 274.452 3.772 20 0 CHADHO CCC[N@H+](CCCN)C1CCC2(CCCC2)CC1 ZINC001172724310 1132297658 /nfs/dbraw/zinc/29/76/58/1132297658.db2.gz FLGRQJBPVDFCIT-UHFFFAOYSA-N 1 3 252.446 3.550 20 0 CHADHO CCC[N@@H+](CCCN)C1CCC2(CCCC2)CC1 ZINC001172724310 1132297664 /nfs/dbraw/zinc/29/76/64/1132297664.db2.gz FLGRQJBPVDFCIT-UHFFFAOYSA-N 1 3 252.446 3.550 20 0 CHADHO CCCC[N@H+](C)CCCN[C@@H]1Cc2ccc(Cl)cc2C1 ZINC001172708478 1132308359 /nfs/dbraw/zinc/30/83/59/1132308359.db2.gz GZASJWKEDMJSFZ-QGZVFWFLSA-N 1 3 294.870 3.519 20 0 CHADHO CCCC[N@@H+](C)CCCN[C@@H]1Cc2ccc(Cl)cc2C1 ZINC001172708478 1132308361 /nfs/dbraw/zinc/30/83/61/1132308361.db2.gz GZASJWKEDMJSFZ-QGZVFWFLSA-N 1 3 294.870 3.519 20 0 CHADHO CCCCN(C)CCC[NH2+][C@@H]1Cc2ccc(Cl)cc2C1 ZINC001172708478 1132308367 /nfs/dbraw/zinc/30/83/67/1132308367.db2.gz GZASJWKEDMJSFZ-QGZVFWFLSA-N 1 3 294.870 3.519 20 0 CHADHO Cc1oc2ccccc2c1CNCc1ccc(CC[NH3+])cc1 ZINC000841032374 1132322226 /nfs/dbraw/zinc/32/22/26/1132322226.db2.gz SNEQZIOZBLOJMK-UHFFFAOYSA-N 1 3 294.398 3.532 20 0 CHADHO c1c2c[nH]ccc-2nc1C[N@@H+]1CCC[C@@H](c2ccccc2)C1 ZINC001232013874 1132410151 /nfs/dbraw/zinc/41/01/51/1132410151.db2.gz DYCUEBCFIRZWAC-MRXNPFEDSA-N 1 3 291.398 3.943 20 0 CHADHO c1c2c[nH]ccc-2nc1C[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC001232013874 1132410155 /nfs/dbraw/zinc/41/01/55/1132410155.db2.gz DYCUEBCFIRZWAC-MRXNPFEDSA-N 1 3 291.398 3.943 20 0 CHADHO CC[C@@H]1CC[C@@H]([N@H+](CCCN)C2CCCCC2)C1 ZINC001173265663 1132431835 /nfs/dbraw/zinc/43/18/35/1132431835.db2.gz UUMARGQPWSJHOW-GDBMZVCRSA-N 1 3 252.446 3.549 20 0 CHADHO CC[C@@H]1CC[C@@H]([N@@H+](CCCN)C2CCCCC2)C1 ZINC001173265663 1132431838 /nfs/dbraw/zinc/43/18/38/1132431838.db2.gz UUMARGQPWSJHOW-GDBMZVCRSA-N 1 3 252.446 3.549 20 0 CHADHO CC[C@H]1CC[C@H]([NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC001173266466 1132432859 /nfs/dbraw/zinc/43/28/59/1132432859.db2.gz FSMKRSAKZKJQPS-HOCLYGCPSA-N 1 3 264.457 3.562 20 0 CHADHO CC[C@@H]1CC[C@@H]([NH+]2CCC(N3CCCCC3)CC2)C1 ZINC001173272908 1132437418 /nfs/dbraw/zinc/43/74/18/1132437418.db2.gz LDZOIASLTWYLQO-NVXWUHKLSA-N 1 3 264.457 3.515 20 0 CHADHO CC[C@@H]1CC[C@@H](N2CCC([NH+]3CCCCC3)CC2)C1 ZINC001173272908 1132437423 /nfs/dbraw/zinc/43/74/23/1132437423.db2.gz LDZOIASLTWYLQO-NVXWUHKLSA-N 1 3 264.457 3.515 20 0 CHADHO CN1CC2(C1)CC[NH+]([C@@H]1CCCC3(CCCCC3)C1)CC2 ZINC001173349393 1132474035 /nfs/dbraw/zinc/47/40/35/1132474035.db2.gz OZNVTNBIJOVWDN-QGZVFWFLSA-N 1 3 290.495 3.907 20 0 CHADHO Cc1nc(NCC[PH+](C(C)C)C(C)C)cc(N(C)C)n1 ZINC001162358304 1133071609 /nfs/dbraw/zinc/07/16/09/1133071609.db2.gz MESXBZBYSGUWRE-UHFFFAOYSA-N 1 3 296.399 3.562 20 0 CHADHO CC[C@@H]1CCCC[C@H]1C[N@@H+]1CC[C@H](CN(CC)CC)C1 ZINC001204549958 1133461370 /nfs/dbraw/zinc/46/13/70/1133461370.db2.gz DHVHGCWIWLGDPA-KURKYZTESA-N 1 3 280.500 3.867 20 0 CHADHO CC[C@@H]1CCCC[C@H]1C[N@H+]1CC[C@H](CN(CC)CC)C1 ZINC001204549958 1133461374 /nfs/dbraw/zinc/46/13/74/1133461374.db2.gz DHVHGCWIWLGDPA-KURKYZTESA-N 1 3 280.500 3.867 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CCC[C@H](N)CC1 ZINC001205093470 1133527937 /nfs/dbraw/zinc/52/79/37/1133527937.db2.gz AWGVOTBFJYRDIW-QGZUEGPWSA-N 1 3 252.446 3.716 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CCC[C@H](N)CC1 ZINC001205093470 1133527942 /nfs/dbraw/zinc/52/79/42/1133527942.db2.gz AWGVOTBFJYRDIW-QGZUEGPWSA-N 1 3 252.446 3.716 20 0 CHADHO [NH3+][C@@H]1CCCN(Cc2ccc3oc4ccccc4c3c2)CC1 ZINC001205101230 1133530341 /nfs/dbraw/zinc/53/03/41/1133530341.db2.gz BUAOKXROHNIQBK-OAHLLOKOSA-N 1 3 294.398 3.899 20 0 CHADHO Cc1ccc(-c2ccc(CN3CCC[C@H]([NH3+])CC3)cc2)o1 ZINC001205110309 1133531310 /nfs/dbraw/zinc/53/13/10/1133531310.db2.gz RSXFNSMGYNQCOK-KRWDZBQOSA-N 1 3 284.403 3.568 20 0 CHADHO Cc1csc2sc(CN3C[C@H](C)[C@H](C[NH3+])C3)c(C)c12 ZINC001205145761 1133536406 /nfs/dbraw/zinc/53/64/06/1133536406.db2.gz FWNKTEMSJYLZGC-JOYOIKCWSA-N 1 3 294.489 3.606 20 0 CHADHO C[C@H]1CN(Cc2cc3c(s2)CC[NH2+]C3)Cc2ccccc21 ZINC001205164439 1133539698 /nfs/dbraw/zinc/53/96/98/1133539698.db2.gz GBOHWPMDKIWUCB-ZDUSSCGKSA-N 1 3 298.455 3.513 20 0 CHADHO C[C@@]1([NH3+])CCCN(Cc2ccc3ccsc3c2)CC1 ZINC001205281522 1133554486 /nfs/dbraw/zinc/55/44/86/1133554486.db2.gz UIXATDJABFCJAS-MRXNPFEDSA-N 1 3 274.433 3.605 20 0 CHADHO Cc1ccc(Cl)c(CN2CC[C@H](C)[C@@H](C[NH3+])CC2)c1F ZINC001205618929 1133596353 /nfs/dbraw/zinc/59/63/53/1133596353.db2.gz ZGRIFBCSPOAFGM-WCQYABFASA-N 1 3 298.833 3.594 20 0 CHADHO C[C@H]1CC[C@H](CN)[N@H+](Cc2cccc3c(F)cccc23)C1 ZINC001205856554 1133623515 /nfs/dbraw/zinc/62/35/15/1133623515.db2.gz WUUWVUPEXPADRT-DZGCQCFKSA-N 1 3 286.394 3.538 20 0 CHADHO C[C@H]1CC[C@H](CN)[N@@H+](Cc2cccc3c(F)cccc23)C1 ZINC001205856554 1133623516 /nfs/dbraw/zinc/62/35/16/1133623516.db2.gz WUUWVUPEXPADRT-DZGCQCFKSA-N 1 3 286.394 3.538 20 0 CHADHO C[C@H]1[C@@H](CN)CCC[N@@H+]1CC1(c2ccccc2)CCCC1 ZINC001205901778 1133628278 /nfs/dbraw/zinc/62/82/78/1133628278.db2.gz GFRWADXMHYEEQF-DLBZAZTESA-N 1 3 286.463 3.558 20 0 CHADHO C[C@H]1[C@@H](CN)CCC[N@H+]1CC1(c2ccccc2)CCCC1 ZINC001205901778 1133628282 /nfs/dbraw/zinc/62/82/82/1133628282.db2.gz GFRWADXMHYEEQF-DLBZAZTESA-N 1 3 286.463 3.558 20 0 CHADHO N[C@@H]1CCCC[N@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001205931548 1133632711 /nfs/dbraw/zinc/63/27/11/1133632711.db2.gz LCWWRJQYSMUPEN-GOSISDBHSA-N 1 3 280.415 3.667 20 0 CHADHO N[C@@H]1CCCC[N@@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001205931548 1133632715 /nfs/dbraw/zinc/63/27/15/1133632715.db2.gz LCWWRJQYSMUPEN-GOSISDBHSA-N 1 3 280.415 3.667 20 0 CHADHO Cc1cccc(-c2ccc(C[N@@H+]3CCCC[C@@H](N)C3)cc2)c1 ZINC001205938930 1133633122 /nfs/dbraw/zinc/63/31/22/1133633122.db2.gz LZJFAKPAPCIPMW-HXUWFJFHSA-N 1 3 294.442 3.975 20 0 CHADHO Cc1cccc(-c2ccc(C[N@H+]3CCCC[C@@H](N)C3)cc2)c1 ZINC001205938930 1133633126 /nfs/dbraw/zinc/63/31/26/1133633126.db2.gz LZJFAKPAPCIPMW-HXUWFJFHSA-N 1 3 294.442 3.975 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@@H+]1CCCC[C@H](N)C1 ZINC001205932388 1133633293 /nfs/dbraw/zinc/63/32/93/1133633293.db2.gz RGZPSLRATZBYBX-SFHVURJKSA-N 1 3 294.442 3.975 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@H+]1CCCC[C@H](N)C1 ZINC001205932388 1133633296 /nfs/dbraw/zinc/63/32/96/1133633296.db2.gz RGZPSLRATZBYBX-SFHVURJKSA-N 1 3 294.442 3.975 20 0 CHADHO Cc1ccc(F)c(CN2CCC[C@H](C[NH3+])[C@H](C)C2)c1Cl ZINC001205992085 1133638877 /nfs/dbraw/zinc/63/88/77/1133638877.db2.gz DKHSBJHTCABDMH-CHWSQXEVSA-N 1 3 298.833 3.594 20 0 CHADHO C[C@H]1CNCCC[N@@H+]1Cc1cccc2c3ccccc3oc21 ZINC001206257733 1133677555 /nfs/dbraw/zinc/67/75/55/1133677555.db2.gz IYAPVAWZZQUEJU-AWEZNQCLSA-N 1 3 294.398 3.770 20 0 CHADHO C[C@H]1CNCCC[N@H+]1Cc1cccc2c3ccccc3oc21 ZINC001206257733 1133677557 /nfs/dbraw/zinc/67/75/57/1133677557.db2.gz IYAPVAWZZQUEJU-AWEZNQCLSA-N 1 3 294.398 3.770 20 0 CHADHO C[C@H]1CNCC[N@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001206276753 1133680972 /nfs/dbraw/zinc/68/09/72/1133680972.db2.gz HZMPCSBEHDTPJK-HNNXBMFYSA-N 1 3 298.405 3.534 20 0 CHADHO C[C@H]1CNCC[N@@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001206276753 1133680974 /nfs/dbraw/zinc/68/09/74/1133680974.db2.gz HZMPCSBEHDTPJK-HNNXBMFYSA-N 1 3 298.405 3.534 20 0 CHADHO CCCCc1ccc(C[N@@H+]2CCCC[C@@](F)(CN)C2)cc1 ZINC001206360755 1133694859 /nfs/dbraw/zinc/69/48/59/1133694859.db2.gz ATBANBJYUCHLRI-GOSISDBHSA-N 1 3 292.442 3.682 20 0 CHADHO CCCCc1ccc(C[N@H+]2CCCC[C@@](F)(CN)C2)cc1 ZINC001206360755 1133694861 /nfs/dbraw/zinc/69/48/61/1133694861.db2.gz ATBANBJYUCHLRI-GOSISDBHSA-N 1 3 292.442 3.682 20 0 CHADHO CCC[NH+]1C[C@@H]2CN(CCCC3CCCCC3)C[C@H]2C1 ZINC001207608427 1133830628 /nfs/dbraw/zinc/83/06/28/1133830628.db2.gz NPFBJWPRQUEDKK-QZTJIDSGSA-N 1 3 278.484 3.621 20 0 CHADHO CCCN1C[C@@H]2C[NH+](CCCC3CCCCC3)C[C@H]2C1 ZINC001207608427 1133830635 /nfs/dbraw/zinc/83/06/35/1133830635.db2.gz NPFBJWPRQUEDKK-QZTJIDSGSA-N 1 3 278.484 3.621 20 0 CHADHO C1=C[C@@H]2C[C@H]1C[C@H]2C[N@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001207627231 1133831798 /nfs/dbraw/zinc/83/17/98/1133831798.db2.gz UNYOHMFZXPXQFZ-ZSYWTGECSA-N 1 3 288.479 3.539 20 0 CHADHO C1=C[C@@H]2C[C@H]1C[C@H]2C[N@@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001207627231 1133831805 /nfs/dbraw/zinc/83/18/05/1133831805.db2.gz UNYOHMFZXPXQFZ-ZSYWTGECSA-N 1 3 288.479 3.539 20 0 CHADHO C1=C[C@@H]2C[C@H]1C[C@@H]2C[N@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001207627228 1133833228 /nfs/dbraw/zinc/83/32/28/1133833228.db2.gz UNYOHMFZXPXQFZ-MANSERQUSA-N 1 3 288.479 3.539 20 0 CHADHO C1=C[C@@H]2C[C@H]1C[C@@H]2C[N@@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001207627228 1133833234 /nfs/dbraw/zinc/83/32/34/1133833234.db2.gz UNYOHMFZXPXQFZ-MANSERQUSA-N 1 3 288.479 3.539 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+]C1CCC(C)(C)CC1 ZINC001207858088 1133854975 /nfs/dbraw/zinc/85/49/75/1133854975.db2.gz DBMDWVVJFSNQPD-AWEZNQCLSA-N 1 3 254.462 3.665 20 0 CHADHO CN(C)C1CC[NH+](CC2(c3ccccc3)CCCC2)CC1 ZINC001208770679 1133941821 /nfs/dbraw/zinc/94/18/21/1133941821.db2.gz DJRSSEMHJFLCTQ-UHFFFAOYSA-N 1 3 286.463 3.524 20 0 CHADHO CN1CC2(C1)CC[NH+](CC1(c3ccccc3)CCCC1)CC2 ZINC001208777266 1133945194 /nfs/dbraw/zinc/94/51/94/1133945194.db2.gz HBTMGSTYAKOINV-UHFFFAOYSA-N 1 3 298.474 3.526 20 0 CHADHO c1ccc(C[N@H+]2CC[C@H](CN3CCC4(CCC4)CC3)C2)cc1 ZINC001208940181 1133968023 /nfs/dbraw/zinc/96/80/23/1133968023.db2.gz AVXPZMKVHRNORC-LJQANCHMSA-N 1 3 298.474 3.775 20 0 CHADHO c1ccc(C[N@@H+]2CC[C@H](CN3CCC4(CCC4)CC3)C2)cc1 ZINC001208940181 1133968027 /nfs/dbraw/zinc/96/80/27/1133968027.db2.gz AVXPZMKVHRNORC-LJQANCHMSA-N 1 3 298.474 3.775 20 0 CHADHO c1ccc(CN2CC[C@H](C[NH+]3CCC4(CCC4)CC3)C2)cc1 ZINC001208940181 1133968032 /nfs/dbraw/zinc/96/80/32/1133968032.db2.gz AVXPZMKVHRNORC-LJQANCHMSA-N 1 3 298.474 3.775 20 0 CHADHO CCc1ccc(C[N@H+](C)CCCN2CCCCC2)cc1 ZINC001209450024 1134024230 /nfs/dbraw/zinc/02/42/30/1134024230.db2.gz DXYZXXGKHFSLTG-UHFFFAOYSA-N 1 3 274.452 3.557 20 0 CHADHO CCc1ccc(C[N@@H+](C)CCCN2CCCCC2)cc1 ZINC001209450024 1134024234 /nfs/dbraw/zinc/02/42/34/1134024234.db2.gz DXYZXXGKHFSLTG-UHFFFAOYSA-N 1 3 274.452 3.557 20 0 CHADHO CC[NH+](CC)Cc1ccc(F)c(Nc2ccncc2C)c1 ZINC001215723796 1134667104 /nfs/dbraw/zinc/66/71/04/1134667104.db2.gz XBJRLRQAZSECFJ-UHFFFAOYSA-N 1 3 287.382 3.536 20 0 CHADHO CC1=CC[C@@H](CC[N@@H+]2CCC[C@]23CCCNC3)C1(C)C ZINC001222230725 1135211141 /nfs/dbraw/zinc/21/11/41/1135211141.db2.gz CLCSMWHVEIMCFS-WMZOPIPTSA-N 1 3 276.468 3.587 20 0 CHADHO CC1=CC[C@@H](CC[N@H+]2CCC[C@]23CCCNC3)C1(C)C ZINC001222230725 1135211146 /nfs/dbraw/zinc/21/11/46/1135211146.db2.gz CLCSMWHVEIMCFS-WMZOPIPTSA-N 1 3 276.468 3.587 20 0 CHADHO c1ccc(C2(C[N@@H+]3CCC[C@@]34CCCNC4)CCCC2)cc1 ZINC001222231375 1135211803 /nfs/dbraw/zinc/21/18/03/1135211803.db2.gz LKHZQDFPKWZKER-HXUWFJFHSA-N 1 3 298.474 3.716 20 0 CHADHO c1ccc(C2(C[N@H+]3CCC[C@@]34CCCNC4)CCCC2)cc1 ZINC001222231375 1135211808 /nfs/dbraw/zinc/21/18/08/1135211808.db2.gz LKHZQDFPKWZKER-HXUWFJFHSA-N 1 3 298.474 3.716 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@@H+]1CCC[C@]2(CCCNC2)C1 ZINC001222259384 1135215783 /nfs/dbraw/zinc/21/57/83/1135215783.db2.gz OJUCDPHUSYLGGW-ROUUACIJSA-N 1 3 278.484 3.835 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@H+]1CCC[C@]2(CCCNC2)C1 ZINC001222259384 1135215784 /nfs/dbraw/zinc/21/57/84/1135215784.db2.gz OJUCDPHUSYLGGW-ROUUACIJSA-N 1 3 278.484 3.835 20 0 CHADHO c1cc(CN2CCC[C@@]3(CCC[NH2+]C3)C2)c2cccccc1-2 ZINC001222276092 1135217632 /nfs/dbraw/zinc/21/76/32/1135217632.db2.gz BDNMGWCITLOGKB-HXUWFJFHSA-N 1 3 294.442 3.757 20 0 CHADHO CSc1ccccc1CN1CCC[C@@]12CCC[NH2+]CC2 ZINC001222314508 1135224194 /nfs/dbraw/zinc/22/41/94/1135224194.db2.gz GYCIQEQBCLKONY-QGZVFWFLSA-N 1 3 290.476 3.517 20 0 CHADHO CC(C)CC[C@@H]([NH2+]CCCN(C)C(C)C)C1CC1 ZINC000310726038 260226046 /nfs/dbraw/zinc/22/60/46/260226046.db2.gz UHLQKUKUSREQMG-MRXNPFEDSA-N 1 3 254.462 3.521 20 0 CHADHO CSc1ccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000091959898 260267091 /nfs/dbraw/zinc/26/70/91/260267091.db2.gz LJMYAGNKCUUPPZ-IPYPFGDCSA-N 1 3 278.465 3.542 20 0 CHADHO CCCC[C@@H]([NH2+]C[C@H](C)CN(C)C)c1ccccc1 ZINC000311854316 262342537 /nfs/dbraw/zinc/34/25/37/262342537.db2.gz TUSBPGRUHSMJMU-DOTOQJQBSA-N 1 3 262.441 3.705 20 0 CHADHO CCCC[C@@H](NC[C@H](C)C[NH+](C)C)c1ccccc1 ZINC000311854316 262342538 /nfs/dbraw/zinc/34/25/38/262342538.db2.gz TUSBPGRUHSMJMU-DOTOQJQBSA-N 1 3 262.441 3.705 20 0 CHADHO Cc1ccc([C@H](C)NC2CC[NH+](C(C)C)CC2)s1 ZINC000020189366 171055847 /nfs/dbraw/zinc/05/58/47/171055847.db2.gz XESQLVWWRGDOAV-ZDUSSCGKSA-N 1 3 266.454 3.580 20 0 CHADHO CC(C)CC[C@@H](C)[NH2+]CCCN1CCCC[C@@H]1C ZINC000020545054 171243033 /nfs/dbraw/zinc/24/30/33/171243033.db2.gz OJFUJKXEAOUBNN-CVEARBPZSA-N 1 3 254.462 3.665 20 0 CHADHO C[C@H]1CCCCN1CCC[NH2+]C1CCCCCCC1 ZINC000021813436 171330999 /nfs/dbraw/zinc/33/09/99/171330999.db2.gz KYRHJXXKOYQUQZ-INIZCTEOSA-N 1 3 266.473 3.953 20 0 CHADHO CC(C)C[C@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccccc1 ZINC000037649388 260115148 /nfs/dbraw/zinc/11/51/48/260115148.db2.gz DBPKWUUGGDONMT-LPHOPBHVSA-N 1 3 286.463 3.848 20 0 CHADHO CC(C)C[C@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccccc1 ZINC000037649388 260115149 /nfs/dbraw/zinc/11/51/49/260115149.db2.gz DBPKWUUGGDONMT-LPHOPBHVSA-N 1 3 286.463 3.848 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCCC[C@@H]1c1ccccc1)CN(C)C ZINC000394246690 260192836 /nfs/dbraw/zinc/19/28/36/260192836.db2.gz SPAPFVUCEVFOLM-KBAYOESNSA-N 1 3 274.452 3.500 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1)CN(C)C ZINC000310780139 260228483 /nfs/dbraw/zinc/22/84/83/260228483.db2.gz RKKPHQQMPNSYTL-QWRGUYRKSA-N 1 3 289.250 3.842 20 0 CHADHO CSc1ccc([C@H](C)N[C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000091959898 260267089 /nfs/dbraw/zinc/26/70/89/260267089.db2.gz LJMYAGNKCUUPPZ-IPYPFGDCSA-N 1 3 278.465 3.542 20 0 CHADHO CC[C@@H](N[C@H]1CC[N@H+](C)[C@H](C)C1)c1cccc(Cl)c1 ZINC000091959943 260267448 /nfs/dbraw/zinc/26/74/48/260267448.db2.gz GPADXURDIJDRIU-UHOFOFEASA-N 1 3 280.843 3.863 20 0 CHADHO CC[C@@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc(Cl)c1 ZINC000091959943 260267449 /nfs/dbraw/zinc/26/74/49/260267449.db2.gz GPADXURDIJDRIU-UHOFOFEASA-N 1 3 280.843 3.863 20 0 CHADHO CC(C)c1ccc(CNC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC000088163754 260278803 /nfs/dbraw/zinc/27/88/03/260278803.db2.gz OINBHHCNJNKYFC-YQQQUEKLSA-N 1 3 286.463 3.915 20 0 CHADHO CC(C)c1ccc(CNC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC000088163754 260278804 /nfs/dbraw/zinc/27/88/04/260278804.db2.gz OINBHHCNJNKYFC-YQQQUEKLSA-N 1 3 286.463 3.915 20 0 CHADHO C[C@@H]1CC[C@H](NC[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc21 ZINC000126540365 260353712 /nfs/dbraw/zinc/35/37/12/260353712.db2.gz OVBOQTJATACSEQ-VCBZYWHSSA-N 1 3 284.447 3.699 20 0 CHADHO C[C@@H]1CC[C@H](NC[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc21 ZINC000126540365 260353714 /nfs/dbraw/zinc/35/37/14/260353714.db2.gz OVBOQTJATACSEQ-VCBZYWHSSA-N 1 3 284.447 3.699 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN(CCCc2ccccc2C)C1 ZINC000084678397 260366483 /nfs/dbraw/zinc/36/64/83/260366483.db2.gz KCDLZPWGCSLLJQ-GOSISDBHSA-N 1 3 288.479 3.591 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN(CCCc2ccccc2C)C1 ZINC000084678397 260366484 /nfs/dbraw/zinc/36/64/84/260366484.db2.gz KCDLZPWGCSLLJQ-GOSISDBHSA-N 1 3 288.479 3.591 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+](CCCc2ccccc2C)C1 ZINC000084678397 260366485 /nfs/dbraw/zinc/36/64/85/260366485.db2.gz KCDLZPWGCSLLJQ-GOSISDBHSA-N 1 3 288.479 3.591 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+](CCCc2ccccc2C)C1 ZINC000084678397 260366487 /nfs/dbraw/zinc/36/64/87/260366487.db2.gz KCDLZPWGCSLLJQ-GOSISDBHSA-N 1 3 288.479 3.591 20 0 CHADHO c1ccc2c(c1)CCCC[C@@H]2N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000130217932 260394487 /nfs/dbraw/zinc/39/44/87/260394487.db2.gz KGYBEUXMEKWTNH-LMMKCTJWSA-N 1 3 284.447 3.671 20 0 CHADHO c1ccc2c(c1)CCCC[C@@H]2N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000130217932 260394489 /nfs/dbraw/zinc/39/44/89/260394489.db2.gz KGYBEUXMEKWTNH-LMMKCTJWSA-N 1 3 284.447 3.671 20 0 CHADHO CC(C)(C)C[C@H](NC[C@H]1CCC[NH2+]C1)c1ccccc1 ZINC000130956814 260399367 /nfs/dbraw/zinc/39/93/67/260399367.db2.gz SDLQXNNVOHSQMG-RDJZCZTQSA-N 1 3 274.452 3.753 20 0 CHADHO CC(C)(C)C[C@H]([NH2+]C[C@H]1CCCNC1)c1ccccc1 ZINC000130956814 260399369 /nfs/dbraw/zinc/39/93/69/260399369.db2.gz SDLQXNNVOHSQMG-RDJZCZTQSA-N 1 3 274.452 3.753 20 0 CHADHO C[C@@H](NCCCCC[NH+]1CCCCC1)c1cncc(F)c1 ZINC000164640410 261355860 /nfs/dbraw/zinc/35/58/60/261355860.db2.gz MVAUWUWEFUHDHK-OAHLLOKOSA-N 1 3 293.430 3.528 20 0 CHADHO C[C@@H]([NH2+][C@@H](CCN(C)C)C(C)(C)C)c1ccc(Cl)nc1 ZINC000179127594 261766486 /nfs/dbraw/zinc/76/64/86/261766486.db2.gz AVTQNUMXYZSXLP-OCCSQVGLSA-N 1 3 297.874 3.752 20 0 CHADHO C[C@@H](N[C@@H](C)CCCC[NH3+])c1ccccc1Cl ZINC000310566614 262167557 /nfs/dbraw/zinc/16/75/57/262167557.db2.gz XUQCODZHCSMJRC-NWDGAFQWSA-N 1 3 254.805 3.508 20 0 CHADHO C[C@@H](NCCC[N@H+](C)Cc1ccccc1)c1ccccc1 ZINC000019913239 262205776 /nfs/dbraw/zinc/20/57/76/262205776.db2.gz ZOTQZBRAMBYFHA-QGZVFWFLSA-N 1 3 282.431 3.859 20 0 CHADHO C[C@@H](NCCC[N@@H+](C)Cc1ccccc1)c1ccccc1 ZINC000019913239 262205778 /nfs/dbraw/zinc/20/57/78/262205778.db2.gz ZOTQZBRAMBYFHA-QGZVFWFLSA-N 1 3 282.431 3.859 20 0 CHADHO N[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCCC2(F)F)c2ccccc21 ZINC000390669871 262237723 /nfs/dbraw/zinc/23/77/23/262237723.db2.gz RTQRAOTVVMYRQY-KCPJHIHWSA-N 1 3 280.362 3.546 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@H](C)c1ccc2c(c1)CCC2 ZINC000221913757 262322771 /nfs/dbraw/zinc/32/27/71/262322771.db2.gz FLTMJAXRTFEVCJ-OAHLLOKOSA-N 1 3 274.452 3.556 20 0 CHADHO CC(C)CN1CCC([NH2+][C@@H]2CCCc3sccc32)CC1 ZINC000221943899 262332805 /nfs/dbraw/zinc/33/28/05/262332805.db2.gz SUFXFQKACPZIKD-MRXNPFEDSA-N 1 3 292.492 3.836 20 0 CHADHO CCCN(CCC[NH3+])[C@@H](C)c1cc2ccccc2o1 ZINC000414687749 263032618 /nfs/dbraw/zinc/03/26/18/263032618.db2.gz HZGWKUVFSZGDCS-ZDUSSCGKSA-N 1 3 260.381 3.555 20 0 CHADHO CC(C)(N)C[NH2+]Cc1ccc(-c2ccccc2Cl)s1 ZINC000414803676 263051523 /nfs/dbraw/zinc/05/15/23/263051523.db2.gz MLSMHCPPHZTBCJ-UHFFFAOYSA-N 1 3 294.851 3.895 20 0 CHADHO Cc1cccc(C)c1CNCc1ccc([C@H](C)[NH3+])cc1 ZINC000414803438 263051551 /nfs/dbraw/zinc/05/15/51/263051551.db2.gz CQPQEDMCLSRDOT-HNNXBMFYSA-N 1 3 268.404 3.613 20 0 CHADHO CC1(c2ccccc2)CCC([NH2+][C@@H]2CCC[C@H]2CN)CC1 ZINC000414807069 263052230 /nfs/dbraw/zinc/05/22/30/263052230.db2.gz QRJLICGQVIIAEB-WEOZKBJRSA-N 1 3 286.463 3.604 20 0 CHADHO NC[C@H]1CCCC[C@@H]1[NH2+]CCCc1c(F)cccc1Cl ZINC000414811458 263053124 /nfs/dbraw/zinc/05/31/24/263053124.db2.gz WJBRQPVZGNKSIB-WBMJQRKESA-N 1 3 298.833 3.519 20 0 CHADHO Clc1ccc([C@@H]2CCC[C@H]2[NH2+]C[C@H]2CCCNC2)cc1 ZINC000414822778 263055258 /nfs/dbraw/zinc/05/52/58/263055258.db2.gz COPPJEVEVZPULR-RRQGHBQHSA-N 1 3 292.854 3.565 20 0 CHADHO C[C@H]1C[C@@H](c2ccccc2)C[C@@H](NC2C[C@H]3CC[C@@H](C2)[NH2+]3)C1 ZINC000414822923 263055666 /nfs/dbraw/zinc/05/56/66/263055666.db2.gz CZTJCCGBIZRVLN-ADDOXTHTSA-N 1 3 298.474 3.831 20 0 CHADHO C[C@H](CC[NH3+])NCc1ccc(-c2ccccc2Cl)s1 ZINC000414880787 263096409 /nfs/dbraw/zinc/09/64/09/263096409.db2.gz KDXVZIPRHHTGFJ-LLVKDONJSA-N 1 3 294.851 3.895 20 0 CHADHO C[C@@H](CC(C)(C)c1ccccc1)[NH2+]C[C@]1(C)CCCNC1 ZINC000414906059 263112932 /nfs/dbraw/zinc/11/29/32/263112932.db2.gz LYFVHWNHYHCROA-QFBILLFUSA-N 1 3 288.479 3.722 20 0 CHADHO CCC[C@@H](CCc1ccccc1)[NH2+][C@@H]1CCCNCC1 ZINC000414906325 263113217 /nfs/dbraw/zinc/11/32/17/263113217.db2.gz ARKUPRXUPKNDHZ-ZWKOTPCHSA-N 1 3 274.452 3.520 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+][C@@H]1CCC[C@H](N)C1 ZINC000414907081 263114161 /nfs/dbraw/zinc/11/41/61/263114161.db2.gz AIRVTLOSQNVHLR-RCCFBDPRSA-N 1 3 274.452 3.647 20 0 CHADHO CC1(c2ccccc2)CCC([NH2+][C@H]2CCC[C@@H](N)C2)CC1 ZINC000414928991 263135163 /nfs/dbraw/zinc/13/51/63/263135163.db2.gz QXBDKGSACGNRQD-RRENTHDGSA-N 1 3 286.463 3.746 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+][C@H]1CCN[C@@H](C)C1 ZINC000414944330 263153628 /nfs/dbraw/zinc/15/36/28/263153628.db2.gz GRRXVQRCXRYAPI-JQHSSLGASA-N 1 3 274.452 3.518 20 0 CHADHO CC(C)C[C@H](C[NH2+][C@@H]1CCN[C@H](C)C1)c1ccccc1 ZINC000414952958 263158146 /nfs/dbraw/zinc/15/81/46/263158146.db2.gz RGUKBQRRVGODDP-KBAYOESNSA-N 1 3 274.452 3.546 20 0 CHADHO CC(C)C[C@H](CN[C@@H]1CC[NH2+][C@H](C)C1)c1ccccc1 ZINC000414952958 263158147 /nfs/dbraw/zinc/15/81/47/263158147.db2.gz RGUKBQRRVGODDP-KBAYOESNSA-N 1 3 274.452 3.546 20 0 CHADHO c1cc(-c2ccccc2)oc1CNCCC[C@@H]1CCC[NH2+]1 ZINC000414969726 263171183 /nfs/dbraw/zinc/17/11/83/263171183.db2.gz JIMCILHMYUWOQQ-MRXNPFEDSA-N 1 3 284.403 3.568 20 0 CHADHO CC[C@@H]([NH3+])CN[C@H](CC)Cc1ccc(Cl)cc1Cl ZINC000414981037 263179992 /nfs/dbraw/zinc/17/99/92/263179992.db2.gz BGFCLMKETYKBKC-CHWSQXEVSA-N 1 3 289.250 3.641 20 0 CHADHO CC[C@@H]([NH3+])CN[C@@H](CC)Cc1ccc(Cl)cc1Cl ZINC000414981038 263180128 /nfs/dbraw/zinc/18/01/28/263180128.db2.gz BGFCLMKETYKBKC-OLZOCXBDSA-N 1 3 289.250 3.641 20 0 CHADHO CCC1([NH2+]C2CCN([C@H]3CCCC[C@H]3C)CC2)CC1 ZINC000453290029 263221521 /nfs/dbraw/zinc/22/15/21/263221521.db2.gz NAQOLSHILFLDIR-ZBFHGGJFSA-N 1 3 264.457 3.562 20 0 CHADHO CCC1(NC2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)CC1 ZINC000453290029 263221522 /nfs/dbraw/zinc/22/15/22/263221522.db2.gz NAQOLSHILFLDIR-ZBFHGGJFSA-N 1 3 264.457 3.562 20 0 CHADHO C[C@H](CCC[NH3+])NCc1cc(C(F)(F)F)ccc1Cl ZINC000415023212 263256051 /nfs/dbraw/zinc/25/60/51/263256051.db2.gz MLEWXWAFLWKQPL-SECBINFHSA-N 1 3 294.748 3.576 20 0 CHADHO FC(F)c1ccc(CN2CCCC[C@H]2[C@H]2CC[NH2+]C2)cc1 ZINC000415034769 263257107 /nfs/dbraw/zinc/25/71/07/263257107.db2.gz DBMGOTMTJCXNAY-HOTGVXAUSA-N 1 3 294.389 3.588 20 0 CHADHO [NH3+]CCC[C@@H](NCc1ccc(Cl)cc1)c1ccccc1 ZINC000415061947 263258982 /nfs/dbraw/zinc/25/89/82/263258982.db2.gz ZHDPIHPXSTYYKV-QGZVFWFLSA-N 1 3 288.822 3.910 20 0 CHADHO c1ccc(C(CC[NH2+]C2CCNCC2)c2ccccc2)cc1 ZINC000415089443 263272300 /nfs/dbraw/zinc/27/23/00/263272300.db2.gz XSQZAMQEHSISJA-UHFFFAOYSA-N 1 3 294.442 3.550 20 0 CHADHO c1ccc(C(CCNC2CC[NH2+]CC2)c2ccccc2)cc1 ZINC000415089443 263272302 /nfs/dbraw/zinc/27/23/02/263272302.db2.gz XSQZAMQEHSISJA-UHFFFAOYSA-N 1 3 294.442 3.550 20 0 CHADHO CCCc1cccc(CN2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)c1 ZINC000518837993 265122209 /nfs/dbraw/zinc/12/22/09/265122209.db2.gz GPHVFNSDAQVLRX-MOPGFXCFSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1cccc(CN2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)c1 ZINC000518837993 265122212 /nfs/dbraw/zinc/12/22/12/265122212.db2.gz GPHVFNSDAQVLRX-MOPGFXCFSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1cccc(C[N@@H+]2CCC[C@@H]3CN(C)CC[C@@H]32)c1 ZINC000518837993 265122214 /nfs/dbraw/zinc/12/22/14/265122214.db2.gz GPHVFNSDAQVLRX-MOPGFXCFSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1cccc(C[N@H+]2CCC[C@@H]3CN(C)CC[C@@H]32)c1 ZINC000518837993 265122216 /nfs/dbraw/zinc/12/22/16/265122216.db2.gz GPHVFNSDAQVLRX-MOPGFXCFSA-N 1 3 286.463 3.555 20 0 CHADHO Cc1oc2ccccc2c1C[N@H+]1CCC[C@H]2CN(C)CC[C@H]21 ZINC000519033708 265300518 /nfs/dbraw/zinc/30/05/18/265300518.db2.gz ZRQLAKIURNVAEH-MAUKXSAKSA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1C[N@@H+]1CCC[C@H]2CN(C)CC[C@H]21 ZINC000519033708 265300519 /nfs/dbraw/zinc/30/05/19/265300519.db2.gz ZRQLAKIURNVAEH-MAUKXSAKSA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1CN1CCC[C@H]2C[N@H+](C)CC[C@H]21 ZINC000519033708 265300523 /nfs/dbraw/zinc/30/05/23/265300523.db2.gz ZRQLAKIURNVAEH-MAUKXSAKSA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1CN1CCC[C@H]2C[N@@H+](C)CC[C@H]21 ZINC000519033708 265300525 /nfs/dbraw/zinc/30/05/25/265300525.db2.gz ZRQLAKIURNVAEH-MAUKXSAKSA-N 1 3 298.430 3.657 20 0 CHADHO CC[NH+](CC)CC1CCN([C@H](C)c2cccc(F)c2)CC1 ZINC000519225046 265370400 /nfs/dbraw/zinc/37/04/00/265370400.db2.gz NNYHILLZROGQBB-OAHLLOKOSA-N 1 3 292.442 3.941 20 0 CHADHO CCN1CC[C@H]([N@H+](C)Cc2ccc(SC)s2)C[C@@H]1C ZINC000356130771 266056490 /nfs/dbraw/zinc/05/64/90/266056490.db2.gz DYGTUPBKBGXNRM-STQMWFEESA-N 1 3 298.521 3.775 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)Cc2ccc(SC)s2)C[C@@H]1C ZINC000356130771 266056493 /nfs/dbraw/zinc/05/64/93/266056493.db2.gz DYGTUPBKBGXNRM-STQMWFEESA-N 1 3 298.521 3.775 20 0 CHADHO CC[N@H+](CC[C@@H]1CCCCN1C)Cc1cccc(F)c1 ZINC000356853181 266191422 /nfs/dbraw/zinc/19/14/22/266191422.db2.gz OAIGCTCLAIPZOI-KRWDZBQOSA-N 1 3 278.415 3.522 20 0 CHADHO CC[N@@H+](CC[C@@H]1CCCCN1C)Cc1cccc(F)c1 ZINC000356853181 266191427 /nfs/dbraw/zinc/19/14/27/266191427.db2.gz OAIGCTCLAIPZOI-KRWDZBQOSA-N 1 3 278.415 3.522 20 0 CHADHO CC(C)[NH2+]CCCN[C@H]1C[C@@H](c2ccccc2)C1(C)C ZINC000580062376 327687038 /nfs/dbraw/zinc/68/70/38/327687038.db2.gz QCDASIZLFUVKQI-IRXDYDNUSA-N 1 3 274.452 3.546 20 0 CHADHO [NH3+]Cc1ccc(CN[C@@H](CC2CC2)c2ccccc2)cc1 ZINC000563154458 327931194 /nfs/dbraw/zinc/93/11/94/327931194.db2.gz YSCZABMHJMQTNP-IBGZPJMESA-N 1 3 280.415 3.776 20 0 CHADHO CC(C)[C@@H](NCc1ccc(C[NH3+])cc1)c1ccccc1 ZINC000567893688 327938065 /nfs/dbraw/zinc/93/80/65/327938065.db2.gz JTFHMMFDVQYOQJ-GOSISDBHSA-N 1 3 268.404 3.632 20 0 CHADHO CC(C)Cc1ccc([C@H](C)[NH2+][C@@H]2CCNC[C@H]2C)cc1 ZINC000261683800 328006153 /nfs/dbraw/zinc/00/61/53/328006153.db2.gz GZCPOIBJENGWCQ-RVKKMQEKSA-N 1 3 274.452 3.534 20 0 CHADHO c1ccc([C@H](CC2CC2)NCCC[NH+]2CCCC2)cc1 ZINC000531688788 328023969 /nfs/dbraw/zinc/02/39/69/328023969.db2.gz NEVXZDQSUUKXBH-SFHVURJKSA-N 1 3 272.436 3.603 20 0 CHADHO c1ccc([C@H](CC2CC2)[NH2+]CCCN2CCCC2)cc1 ZINC000531688788 328023970 /nfs/dbraw/zinc/02/39/70/328023970.db2.gz NEVXZDQSUUKXBH-SFHVURJKSA-N 1 3 272.436 3.603 20 0 CHADHO c1ccc([C@H](CC2CC2)NC2CC[NH+](CC3CC3)CC2)cc1 ZINC000531700334 328025820 /nfs/dbraw/zinc/02/58/20/328025820.db2.gz JQGVXEMTAXQVTC-FQEVSTJZSA-N 1 3 298.474 3.992 20 0 CHADHO C[C@H](NCCCCC[NH+]1CCCC1)c1cccc(F)c1F ZINC000563669671 328083385 /nfs/dbraw/zinc/08/33/85/328083385.db2.gz FBZQIEOHIKPRBR-AWEZNQCLSA-N 1 3 296.405 3.882 20 0 CHADHO Cc1ccc2c(c1)[C@H](NC1CC[NH+](C3CCC3)CC1)CC2 ZINC000268812605 328185996 /nfs/dbraw/zinc/18/59/96/328185996.db2.gz BGHLTXQHEDXMEX-LJQANCHMSA-N 1 3 284.447 3.589 20 0 CHADHO CCN(Cc1cc2ccccc2s1)[C@@H]1CCC[NH2+]CC1 ZINC000414717351 328216201 /nfs/dbraw/zinc/21/62/01/328216201.db2.gz PUASMHDXWDBHTK-OAHLLOKOSA-N 1 3 288.460 3.865 20 0 CHADHO CSc1ccccc1C[C@H](C)NCC1([NH3+])CCCCC1 ZINC000414843865 328234067 /nfs/dbraw/zinc/23/40/67/328234067.db2.gz OVDZHKSZBRONHX-AWEZNQCLSA-N 1 3 292.492 3.591 20 0 CHADHO Cc1ccc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)N3C)cc1Cl ZINC000289722311 328256017 /nfs/dbraw/zinc/25/60/17/328256017.db2.gz PJXAGZZUAWVOOT-XYPWUTKMSA-N 1 3 292.854 3.705 20 0 CHADHO Cc1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)N3C)cc1Cl ZINC000289722311 328256018 /nfs/dbraw/zinc/25/60/18/328256018.db2.gz PJXAGZZUAWVOOT-XYPWUTKMSA-N 1 3 292.854 3.705 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+][C@@H]1CCN[C@@H](C)C1 ZINC000414944329 328278646 /nfs/dbraw/zinc/27/86/46/328278646.db2.gz GRRXVQRCXRYAPI-CGTJXYLNSA-N 1 3 274.452 3.518 20 0 CHADHO Clc1ccc(CNCCC[C@H]2CCC[NH2+]2)c(Cl)c1 ZINC000414960846 328282397 /nfs/dbraw/zinc/28/23/97/328282397.db2.gz ATEUGSJMHBFAIK-ZDUSSCGKSA-N 1 3 287.234 3.615 20 0 CHADHO [NH3+][C@H]1CCC[C@H](CNCc2c(Cl)oc3ccccc32)C1 ZINC000414995358 328290580 /nfs/dbraw/zinc/29/05/80/328290580.db2.gz FLKAVNQHRMWJEU-RYUDHWBXSA-N 1 3 292.810 3.693 20 0 CHADHO c1ccc(-c2cccc(CCN[C@H]3CCC[NH2+]CC3)c2)cc1 ZINC000415082693 328302702 /nfs/dbraw/zinc/30/27/02/328302702.db2.gz DSIAJQSQXZOPNL-FQEVSTJZSA-N 1 3 294.442 3.628 20 0 CHADHO c1ccc(-c2cccc(CC[NH2+][C@H]3CCCNCC3)c2)cc1 ZINC000415082693 328302703 /nfs/dbraw/zinc/30/27/03/328302703.db2.gz DSIAJQSQXZOPNL-FQEVSTJZSA-N 1 3 294.442 3.628 20 0 CHADHO Cc1ccsc1[C@@H](C)[NH2+]C[C@H](C)CN1CCCCC1 ZINC000070091862 328386935 /nfs/dbraw/zinc/38/69/35/328386935.db2.gz PIKHIAGYVFTMAA-DZGCQCFKSA-N 1 3 280.481 3.829 20 0 CHADHO C[C@@H](c1ccccc1Cl)N1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000584172991 327057402 /nfs/dbraw/zinc/05/74/02/327057402.db2.gz OIFUVJASVIQRHJ-DZGCQCFKSA-N 1 3 292.854 3.723 20 0 CHADHO CCN(CC)CCC[NH2+][C@H](C)c1c(C)cccc1C ZINC000558723171 327117218 /nfs/dbraw/zinc/11/72/18/327117218.db2.gz JZSVLSJSCBDSCT-MRXNPFEDSA-N 1 3 262.441 3.686 20 0 CHADHO CC(C)C[C@H](C)C[N@@H+]1CCC[C@@H](N2CCCC2)CC1 ZINC000410378045 327188788 /nfs/dbraw/zinc/18/87/88/327188788.db2.gz KASZIEKUFYVOLV-DLBZAZTESA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)C[C@H](C)C[N@H+]1CCC[C@@H](N2CCCC2)CC1 ZINC000410378045 327188790 /nfs/dbraw/zinc/18/87/90/327188790.db2.gz KASZIEKUFYVOLV-DLBZAZTESA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)C[C@H](C)CN1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000410378045 327188792 /nfs/dbraw/zinc/18/87/92/327188792.db2.gz KASZIEKUFYVOLV-DLBZAZTESA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)C[C@H](CN1CC[C@@]2(CC[NH2+]C2)C1)c1ccccc1 ZINC000566230421 327248566 /nfs/dbraw/zinc/24/85/66/327248566.db2.gz QMRJEALFWLCNNA-RTBURBONSA-N 1 3 286.463 3.502 20 0 CHADHO C[C@H](NCc1ccc(C[NH3+])cc1)c1ccc(F)c(Cl)c1 ZINC000564988345 327340071 /nfs/dbraw/zinc/34/00/71/327340071.db2.gz CELZXJXEYRGTHT-NSHDSACASA-N 1 3 292.785 3.789 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@H]1N[C@@H](CC(C)(C)C)c1ccccc1 ZINC000261807156 327352908 /nfs/dbraw/zinc/35/29/08/327352908.db2.gz RWULJKZPYOXVNA-OIISXLGYSA-N 1 3 274.452 3.752 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@@H](CC(C)(C)C)c1ccccc1 ZINC000261807156 327352909 /nfs/dbraw/zinc/35/29/09/327352909.db2.gz RWULJKZPYOXVNA-OIISXLGYSA-N 1 3 274.452 3.752 20 0 CHADHO FCCC[C@H]1CCC[C@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000374603626 328994675 /nfs/dbraw/zinc/99/46/75/328994675.db2.gz NGAPDLURNCUBII-CRAIPNDOSA-N 1 3 296.474 3.901 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@@H](c2ccccc2)C1)[C@H]1CCCNC1 ZINC000582600295 329113909 /nfs/dbraw/zinc/11/39/09/329113909.db2.gz OMVWTSBWRDODDV-WZGPROSRSA-N 1 3 286.463 3.691 20 0 CHADHO C[C@@H](NCC[C@H]1CCC[NH2+]C1)c1c(F)cccc1Cl ZINC000420404241 329764065 /nfs/dbraw/zinc/76/40/65/329764065.db2.gz MAYLUMCVZCLTOX-VXGBXAGGSA-N 1 3 284.806 3.519 20 0 CHADHO CC[C@H](C)C[NH2+]C1CCN([C@H]2CCCC[C@H]2C)CC1 ZINC000421393023 329820659 /nfs/dbraw/zinc/82/06/59/329820659.db2.gz YIRZCKJCRZDQEK-UXLLHSPISA-N 1 3 266.473 3.665 20 0 CHADHO CC[NH+]1CCC(CCN[C@@H](C)c2ccncc2Cl)CC1 ZINC000421838211 330092500 /nfs/dbraw/zinc/09/25/00/330092500.db2.gz UXFIAMQRROKGHE-ZDUSSCGKSA-N 1 3 295.858 3.508 20 0 CHADHO CCC[C@H](NCc1ccc(C[NH3+])cc1)c1ccc(OC)cc1 ZINC000580445788 330139670 /nfs/dbraw/zinc/13/96/70/330139670.db2.gz FAWHDAUTNCQTTB-IBGZPJMESA-N 1 3 298.430 3.785 20 0 CHADHO CCN(Cc1cccc(C2CC2)c1)[C@@H]1CCC[NH2+]CC1 ZINC000422551177 330148981 /nfs/dbraw/zinc/14/89/81/330148981.db2.gz CYYTUGILBWPQNJ-GOSISDBHSA-N 1 3 272.436 3.528 20 0 CHADHO Cc1ccc(CN[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c(C)c1 ZINC000422691774 330150794 /nfs/dbraw/zinc/15/07/94/330150794.db2.gz IYGRTDMZVMSHFD-VQTJNVASSA-N 1 3 294.442 3.886 20 0 CHADHO c1ccc2cc(CN[C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)ccc2c1 ZINC000422706515 330151167 /nfs/dbraw/zinc/15/11/67/330151167.db2.gz UPCICSIYTGYEHE-HSALFYBXSA-N 1 3 294.442 3.850 20 0 CHADHO CCSc1ccc([C@H](C)N[C@@H](C)C[C@@H](C)[NH3+])cc1 ZINC000422720887 330152089 /nfs/dbraw/zinc/15/20/89/330152089.db2.gz UBYQFERLZWCMGG-AGIUHOORSA-N 1 3 266.454 3.575 20 0 CHADHO CC[C@H](N[C@@H](C)C[C@H](C)[NH3+])c1ccc(Cl)s1 ZINC000422730324 330152445 /nfs/dbraw/zinc/15/24/45/330152445.db2.gz LZTIPJCZROWZSV-GUBZILKMSA-N 1 3 260.834 3.568 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H](c1ccc(Cl)cc1)C1CC1 ZINC000422757627 330153657 /nfs/dbraw/zinc/15/36/57/330153657.db2.gz HWAOMKAEOGQESN-RWSFTLGLSA-N 1 3 266.816 3.507 20 0 CHADHO CCc1ccc([C@@H](NC2C[C@H]3CC[C@@H](C2)[NH2+]3)C(C)C)cc1 ZINC000422761145 330153836 /nfs/dbraw/zinc/15/38/36/330153836.db2.gz HFJQKHDVEURLNO-SWDXFRIISA-N 1 3 286.463 3.819 20 0 CHADHO [NH3+]C[C@H]1CCCC[C@H]1NCCSc1ccc(Cl)cc1 ZINC000422765211 330154116 /nfs/dbraw/zinc/15/41/16/330154116.db2.gz KRBBWUSQBGOLHN-IUODEOHRSA-N 1 3 298.883 3.539 20 0 CHADHO NC[C@H]1CCCC[C@H]1[NH2+]CCSc1ccc(Cl)cc1 ZINC000422765211 330154117 /nfs/dbraw/zinc/15/41/17/330154117.db2.gz KRBBWUSQBGOLHN-IUODEOHRSA-N 1 3 298.883 3.539 20 0 CHADHO CCC[C@H](N[C@@H](C)[C@H]1CCC[NH2+]C1)c1ccccc1 ZINC000422771581 330154149 /nfs/dbraw/zinc/15/41/49/330154149.db2.gz WCQOUTBUKKGUEL-XIRDDKMYSA-N 1 3 260.425 3.506 20 0 CHADHO CCC[C@H]([NH2+][C@@H](C)[C@H]1CCCNC1)c1ccccc1 ZINC000422771581 330154151 /nfs/dbraw/zinc/15/41/51/330154151.db2.gz WCQOUTBUKKGUEL-XIRDDKMYSA-N 1 3 260.425 3.506 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](C)c1ccc(-c2ccncc2)cc1 ZINC000422804259 330155859 /nfs/dbraw/zinc/15/58/59/330155859.db2.gz FAHVYACSAMWVLX-ZNMIVQPWSA-N 1 3 283.419 3.525 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)[C@@H]1CCCNC1)[C@H](C)C1CCCCC1 ZINC000422822798 330156481 /nfs/dbraw/zinc/15/64/81/330156481.db2.gz KQGIAVFJVAYDTA-QSJFSLAZSA-N 1 3 266.473 3.569 20 0 CHADHO CC(C)[C@H](CN[C@@H]1C[C@H]([NH3+])c2ccccc21)c1cccnc1 ZINC000422835548 330156887 /nfs/dbraw/zinc/15/68/87/330156887.db2.gz PPLFDFCPLFDHDB-GBESFXJTSA-N 1 3 295.430 3.556 20 0 CHADHO CCCC[C@@H](CCC)[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000422840999 330157122 /nfs/dbraw/zinc/15/71/22/330157122.db2.gz UZUBBECBQPXECF-DZGCQCFKSA-N 1 3 277.456 3.858 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@H](c1ccc(F)cc1)C1CCCC1 ZINC000422789586 330157445 /nfs/dbraw/zinc/15/74/45/330157445.db2.gz UIZNLZHECHVKLH-DCGLDWPTSA-N 1 3 278.415 3.772 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@H](c1cccc(F)c1)C1CCCC1 ZINC000422879411 330158828 /nfs/dbraw/zinc/15/88/28/330158828.db2.gz VIIHJNAKMYOQCD-DCGLDWPTSA-N 1 3 278.415 3.772 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]CC1CCC(c2ccccc2)CC1 ZINC000422892387 330159284 /nfs/dbraw/zinc/15/92/84/330159284.db2.gz YEVXLSWZVGJTAS-WMTDPASSSA-N 1 3 274.452 3.676 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]CC1(c2cccc(F)c2)CCCCC1 ZINC000422908384 330159742 /nfs/dbraw/zinc/15/97/42/330159742.db2.gz YJIICGFPKOPBOQ-GJZGRUSLSA-N 1 3 292.442 3.743 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCC1(c2cccc(F)c2)CCCCC1 ZINC000422908384 330159744 /nfs/dbraw/zinc/15/97/44/330159744.db2.gz YJIICGFPKOPBOQ-GJZGRUSLSA-N 1 3 292.442 3.743 20 0 CHADHO COc1ccc(-c2ccc(CN[C@H](C)C[C@H](C)[NH3+])cc2)cc1 ZINC000422917560 330160378 /nfs/dbraw/zinc/16/03/78/330160378.db2.gz GHTHFJSKEILJHF-LSDHHAIUSA-N 1 3 298.430 3.578 20 0 CHADHO Cc1cccc(C)c1CCN[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422925221 330160786 /nfs/dbraw/zinc/16/07/86/330160786.db2.gz AQJXEMMSGRONTQ-RBUKOAKNSA-N 1 3 280.415 3.580 20 0 CHADHO CCC(CC)(CC)C[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000422926773 330160928 /nfs/dbraw/zinc/16/09/28/330160928.db2.gz DYTOMBIGIZGKOR-ZDUSSCGKSA-N 1 3 277.456 3.716 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@@H](C)C(c1ccccc1)c1ccccc1 ZINC000422934097 330161126 /nfs/dbraw/zinc/16/11/26/330161126.db2.gz FHGUYWWUKMLJBN-ULQDDVLXSA-N 1 3 296.458 3.922 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C(CC(C)C)CC(C)C ZINC000422938321 330161475 /nfs/dbraw/zinc/16/14/75/330161475.db2.gz DQCFFQRYGBOWHI-OAHLLOKOSA-N 1 3 291.483 3.960 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCC1(Sc2ccccc2)CCCC1 ZINC000422901384 330162174 /nfs/dbraw/zinc/16/21/74/330162174.db2.gz BXHBQMUVSINCHU-HUUCEWRRSA-N 1 3 292.492 3.807 20 0 CHADHO C[C@@H](N)C[C@@H](C)[NH2+]CC1(Sc2ccccc2)CCCC1 ZINC000422901384 330162176 /nfs/dbraw/zinc/16/21/76/330162176.db2.gz BXHBQMUVSINCHU-HUUCEWRRSA-N 1 3 292.492 3.807 20 0 CHADHO COc1ccccc1[C@@H](N[C@H](C)CCC[NH3+])c1ccccc1 ZINC000422958324 330164251 /nfs/dbraw/zinc/16/42/51/330164251.db2.gz PGSWXFJRHJPTSQ-BEFAXECRSA-N 1 3 298.430 3.502 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]C[C@@H]1CCC(C)(C)c2ccccc21 ZINC000423020072 330165550 /nfs/dbraw/zinc/16/55/50/330165550.db2.gz YORIIUHDYAXVQG-KKUMJFAQSA-N 1 3 274.452 3.557 20 0 CHADHO CC(C)c1ccc2c(c1)[C@@H]([NH2+]C1CCNCC1)CCC2 ZINC000423027272 330166008 /nfs/dbraw/zinc/16/60/08/330166008.db2.gz RGYTYHVDRVLKKN-SFHVURJKSA-N 1 3 272.436 3.529 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@@H](C)C1(c2ccccc2)CCCC1 ZINC000423048114 330167088 /nfs/dbraw/zinc/16/70/88/330167088.db2.gz HRGKZECHMVUPEQ-JYJNAYRXSA-N 1 3 274.452 3.602 20 0 CHADHO Cc1cc(C[NH2+][C@@H]2CCC[C@H]2N)ccc1-c1ccccc1 ZINC000423066776 330168193 /nfs/dbraw/zinc/16/81/93/330168193.db2.gz XVMPBMUZSULZSI-RTBURBONSA-N 1 3 280.415 3.631 20 0 CHADHO c1cc(C2CC2)ccc1CN[C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000423072779 330168548 /nfs/dbraw/zinc/16/85/48/330168548.db2.gz JUZJHQCWKIJSAB-IPMKNSEASA-N 1 3 284.447 3.574 20 0 CHADHO Cc1ccc(C2(CNC3C[C@H]4CC[C@@H](C3)[NH2+]4)CCC2)cc1C ZINC000423082416 330168848 /nfs/dbraw/zinc/16/88/48/330168848.db2.gz FEUCDWLKJNDCRY-DFNIBXOVSA-N 1 3 298.474 3.598 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423099404 330170148 /nfs/dbraw/zinc/17/01/48/330170148.db2.gz UCXFKMOWZMYLLY-OTRWWLKZSA-N 1 3 292.854 3.693 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@@H]1CCC[C@@H](C)[C@H]1C ZINC000423105666 330170632 /nfs/dbraw/zinc/17/06/32/330170632.db2.gz ZEDLKBWCIXUPHU-NYTXWWLZSA-N 1 3 289.467 3.572 20 0 CHADHO [NH3+][C@H]1CCCCC[C@H]1NCCc1cc2ccccc2s1 ZINC000423132577 330171811 /nfs/dbraw/zinc/17/18/11/330171811.db2.gz JIMJTNXGPIGGIF-JKSUJKDBSA-N 1 3 288.460 3.693 20 0 CHADHO C[C@@H](N[C@@H](C)C[C@H](C)[NH3+])c1ccc(F)c2ccccc21 ZINC000423132422 330171862 /nfs/dbraw/zinc/17/18/62/330171862.db2.gz UNZQJEGVSSQPTK-RWMBFGLXSA-N 1 3 274.383 3.755 20 0 CHADHO CC(C)(C)C1CC([NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCCN2)C1 ZINC000423140400 330172241 /nfs/dbraw/zinc/17/22/41/330172241.db2.gz YCHITEXXISTQEL-GADNRMJZSA-N 1 3 278.484 3.712 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423142554 330172476 /nfs/dbraw/zinc/17/24/76/330172476.db2.gz ANEQGSREAJBTEL-WSMBLCCSSA-N 1 3 292.854 3.693 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NCC[C@@H]2CCc3ccccc32)c2ccccc21 ZINC000423146258 330172601 /nfs/dbraw/zinc/17/26/01/330172601.db2.gz OWPWDSBTCTUNKV-CWFSZBLJSA-N 1 3 292.426 3.841 20 0 CHADHO Clc1ccc([C@@H]2CCC[C@@H]([NH2+]C3CCNCC3)C2)cc1 ZINC000423150797 330172816 /nfs/dbraw/zinc/17/28/16/330172816.db2.gz CJOKIYYXQBHKEF-RHSMWYFYSA-N 1 3 292.854 3.708 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]C[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000423153560 330173162 /nfs/dbraw/zinc/17/31/62/330173162.db2.gz HTGBOIGNPVQZLI-UOVPBQLFSA-N 1 3 274.452 3.676 20 0 CHADHO [NH3+]C1(CN[C@@H]2CC[C@H](c3ccccc3)C2)CCCCC1 ZINC000423175314 330174688 /nfs/dbraw/zinc/17/46/88/330174688.db2.gz DQNLMUVRCGYNDT-DLBZAZTESA-N 1 3 272.436 3.574 20 0 CHADHO [NH3+]C1(CN[C@H]2CC[C@@H](c3ccccc3)C2)CCCCC1 ZINC000423175317 330174771 /nfs/dbraw/zinc/17/47/71/330174771.db2.gz DQNLMUVRCGYNDT-SJORKVTESA-N 1 3 272.436 3.574 20 0 CHADHO Cc1ccc(C[C@H](NCC2([NH3+])CCCCC2)C2CC2)cc1 ZINC000423176099 330174836 /nfs/dbraw/zinc/17/48/36/330174836.db2.gz GBAPDTOIAHCMES-SFHVURJKSA-N 1 3 286.463 3.567 20 0 CHADHO C[C@@H](Cc1coc2ccccc12)NCC1([NH3+])CCCCC1 ZINC000423181680 330175362 /nfs/dbraw/zinc/17/53/62/330175362.db2.gz PETBAXSWBNDXFG-AWEZNQCLSA-N 1 3 286.419 3.615 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2N[C@H](C)[C@H]1CCC[NH2+]C1 ZINC000423211848 330177877 /nfs/dbraw/zinc/17/78/77/330177877.db2.gz HLBFDCNLNUOJNU-AIANPOQGSA-N 1 3 272.436 3.521 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+][C@H](C)[C@H]1CCCNC1 ZINC000423211848 330177879 /nfs/dbraw/zinc/17/78/79/330177879.db2.gz HLBFDCNLNUOJNU-AIANPOQGSA-N 1 3 272.436 3.521 20 0 CHADHO Cc1cc(C)c([C@H](C)N[C@@H](C)[C@H]2CCC[NH2+]C2)cc1C ZINC000423210886 330178087 /nfs/dbraw/zinc/17/80/87/330178087.db2.gz GOWDQHODINRQSM-ULQDDVLXSA-N 1 3 274.452 3.651 20 0 CHADHO Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)[C@H]2CCCNC2)cc1C ZINC000423210886 330178088 /nfs/dbraw/zinc/17/80/88/330178088.db2.gz GOWDQHODINRQSM-ULQDDVLXSA-N 1 3 274.452 3.651 20 0 CHADHO Cc1cc(OCCC[C@H](C)[NH2+]CC[C@H](C)N)ccc1Cl ZINC000423224682 330180178 /nfs/dbraw/zinc/18/01/78/330180178.db2.gz JWEQKSJTXYAWGQ-KBPBESRZSA-N 1 3 298.858 3.523 20 0 CHADHO Cc1ccccc1[C@@H](NCC[C@H](C)[NH3+])C1CCCC1 ZINC000423226594 330180433 /nfs/dbraw/zinc/18/04/33/330180433.db2.gz RKAAASMYKBJFGA-YOEHRIQHSA-N 1 3 260.425 3.553 20 0 CHADHO Cc1ccsc1[C@@H](C)N[C@@H](C[NH3+])C1CCCCC1 ZINC000423259163 330183329 /nfs/dbraw/zinc/18/33/29/330183329.db2.gz DDFYZWHWHORPCK-OCCSQVGLSA-N 1 3 266.454 3.615 20 0 CHADHO CC(C)[C@H](N)C[NH2+][C@H](C)c1ccc(F)c2ccccc21 ZINC000423275436 330184937 /nfs/dbraw/zinc/18/49/37/330184937.db2.gz NFTCPJVIGCUNIT-SJKOYZFVSA-N 1 3 274.383 3.613 20 0 CHADHO CC(C)[C@H]([NH2+]CC(C)(C)N)c1ccc(C(F)(F)F)cc1 ZINC000423280814 330185407 /nfs/dbraw/zinc/18/54/07/330185407.db2.gz AJPVFGVKBZJLMY-ZDUSSCGKSA-N 1 3 288.357 3.729 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2ccsc2)cc1 ZINC000423290506 330186910 /nfs/dbraw/zinc/18/69/10/330186910.db2.gz DHLKSJFMEYWKPM-RYUDHWBXSA-N 1 3 260.406 3.619 20 0 CHADHO CO[C@H](c1ccccc1)[C@@H](C)NCc1ccc([C@H](C)[NH3+])cc1 ZINC000423292412 330187353 /nfs/dbraw/zinc/18/73/53/330187353.db2.gz MWPFYBGHDQRWFI-KHYOSLBOSA-N 1 3 298.430 3.572 20 0 CHADHO Cc1nc(C)c([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)s1 ZINC000423292838 330187601 /nfs/dbraw/zinc/18/76/01/330187601.db2.gz ORATZSGWEYHZOP-GHMZBOCLSA-N 1 3 289.448 3.630 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H](c2cccnc2)C2CCC2)cc1 ZINC000423292893 330187622 /nfs/dbraw/zinc/18/76/22/330187622.db2.gz OVUROUXQXHHLLH-KUHUBIRLSA-N 1 3 295.430 3.732 20 0 CHADHO CC(C)[C@H](NCc1ccc([C@H](C)[NH3+])cc1)c1cccnc1 ZINC000423296258 330188296 /nfs/dbraw/zinc/18/82/96/330188296.db2.gz YTDGLBTVTTVSPU-KSSFIOAISA-N 1 3 283.419 3.588 20 0 CHADHO CCCC[C@@H](CN)[NH2+][C@@H](C)c1cc2ccccc2o1 ZINC000423297981 330188765 /nfs/dbraw/zinc/18/87/65/330188765.db2.gz MQADDLXJPRUWDM-JSGCOSHPSA-N 1 3 260.381 3.601 20 0 CHADHO C[C@H](C[NH3+])CN[C@@H](C)c1ccc(-c2ccccc2)s1 ZINC000423302657 330188951 /nfs/dbraw/zinc/18/89/51/330188951.db2.gz HQWRJLNPLCOLBO-OLZOCXBDSA-N 1 3 274.433 3.661 20 0 CHADHO C[C@H](CN)C[NH2+][C@H]1CCC[C@H](c2ccc(Cl)cc2)C1 ZINC000423306550 330189307 /nfs/dbraw/zinc/18/93/07/330189307.db2.gz LTPODZDPOAKKRX-INWMFGNUSA-N 1 3 280.843 3.551 20 0 CHADHO C[C@@H](C[NH3+])CN[C@@H](C)c1cccc(OCc2ccccc2)c1 ZINC000423304624 330189313 /nfs/dbraw/zinc/18/93/13/330189313.db2.gz ZGSBGIQXMZWCFK-HOTGVXAUSA-N 1 3 298.430 3.511 20 0 CHADHO CC(C)[C@@H](NC[C@H](C)C[NH3+])c1ccc(C(F)(F)F)cc1 ZINC000423310612 330189592 /nfs/dbraw/zinc/18/95/92/330189592.db2.gz SCGLXJBMRFOUEP-BXUZGUMPSA-N 1 3 288.357 3.587 20 0 CHADHO C[C@H](C[NH3+])CN[C@H](c1cc2ccccc2o1)C(C)(C)C ZINC000423313716 330189792 /nfs/dbraw/zinc/18/97/92/330189792.db2.gz XGMFMRJLHACYRD-MLGOLLRUSA-N 1 3 274.408 3.704 20 0 CHADHO CCC[C@H](NC[C@@]1(C)CCC[NH2+]C1)c1ccccc1 ZINC000423316976 330190089 /nfs/dbraw/zinc/19/00/89/330190089.db2.gz AZLSMDNPNMODST-IRXDYDNUSA-N 1 3 260.425 3.507 20 0 CHADHO CCC[C@H]([NH2+]C[C@@]1(C)CCCNC1)c1ccccc1 ZINC000423316976 330190091 /nfs/dbraw/zinc/19/00/91/330190091.db2.gz AZLSMDNPNMODST-IRXDYDNUSA-N 1 3 260.425 3.507 20 0 CHADHO C[C@H](NC[C@@]1(C)CCC[NH2+]C1)c1cccc2ccccc21 ZINC000423318680 330190171 /nfs/dbraw/zinc/19/01/71/330190171.db2.gz CWGRBCUSDWIZDM-KXBFYZLASA-N 1 3 282.431 3.880 20 0 CHADHO C[C@H]([NH2+]C[C@@]1(C)CCCNC1)c1cccc2ccccc21 ZINC000423318680 330190173 /nfs/dbraw/zinc/19/01/73/330190173.db2.gz CWGRBCUSDWIZDM-KXBFYZLASA-N 1 3 282.431 3.880 20 0 CHADHO C[C@@H]([NH2+]CC1(N)CCC1)c1ccc(-c2ccccc2)s1 ZINC000423327919 330190997 /nfs/dbraw/zinc/19/09/97/330190997.db2.gz NHLZPTBNDCHULC-CYBMUJFWSA-N 1 3 286.444 3.947 20 0 CHADHO C[C@H](NCC1=CC[NH2+]CC1)c1cc2cc(Cl)ccc2o1 ZINC000423342479 330192072 /nfs/dbraw/zinc/19/20/72/330192072.db2.gz KZHVYHUIRNAEJR-NSHDSACASA-N 1 3 290.794 3.657 20 0 CHADHO Clc1cccc([C@@H]2CCC[C@@H](NC[C@@H]3CC[NH2+]C3)C2)c1 ZINC000423351867 330192780 /nfs/dbraw/zinc/19/27/80/330192780.db2.gz ZSLITBMRCFPXSN-FRFSOERESA-N 1 3 292.854 3.565 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@H](N)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423359205 330193611 /nfs/dbraw/zinc/19/36/11/330193611.db2.gz CWBHFNBXLSMOKR-IEECTRCBSA-N 1 3 298.883 3.753 20 0 CHADHO Clc1ccc([C@@H]2CC[C@H](NCC[C@H]3CCC[NH2+]3)C2)cc1 ZINC000423362945 330193994 /nfs/dbraw/zinc/19/39/94/330193994.db2.gz UGAPFSGOYNPNGI-OIISXLGYSA-N 1 3 292.854 3.708 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](N[C@H]2CCCc3c(Cl)cccc32)C1 ZINC000423364389 330194180 /nfs/dbraw/zinc/19/41/80/330194180.db2.gz AMOVIXHGYNHUGV-HSMVNMDESA-N 1 3 278.827 3.577 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+]C2CCC3(CCCCC3)CC2)C1 ZINC000423364840 330194306 /nfs/dbraw/zinc/19/43/06/330194306.db2.gz JYNMMQXPIMYWRJ-ZBFHGGJFSA-N 1 3 264.457 3.739 20 0 CHADHO CC[C@H](C)C[C@H](CC)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423364380 330194443 /nfs/dbraw/zinc/19/44/43/330194443.db2.gz VUJMABWJNJGGDT-GUYCJALGSA-N 1 3 260.425 3.594 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](N[C@H]2CCc3c2ccc(Cl)c3Cl)C1 ZINC000423366805 330194680 /nfs/dbraw/zinc/19/46/80/330194680.db2.gz CHGZUCYNJUYGSI-BFVZDQMLSA-N 1 3 299.245 3.840 20 0 CHADHO CC(C)C[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1cccs1 ZINC000423371021 330194950 /nfs/dbraw/zinc/19/49/50/330194950.db2.gz HGISZUGBOJJGJS-MCIONIFRSA-N 1 3 266.454 3.565 20 0 CHADHO Cc1cc(C)c([C@H](C)N[C@@H]2CCC[C@H]([NH3+])C2)cc1C ZINC000423372093 330195175 /nfs/dbraw/zinc/19/51/75/330195175.db2.gz GTDVSWLAURWAAA-HRCADAONSA-N 1 3 260.425 3.532 20 0 CHADHO Clc1ccc2c(c1)CC[C@H]2NCc1ccc2c(c1)C[NH2+]C2 ZINC000423372784 330195192 /nfs/dbraw/zinc/19/51/92/330195192.db2.gz HCWLDTIKXBQYFT-GOSISDBHSA-N 1 3 298.817 3.720 20 0 CHADHO Cc1ccccc1[C@H](N[C@@H]1CC[NH2+][C@@H](C)C1)C1CCCC1 ZINC000423372416 330195303 /nfs/dbraw/zinc/19/53/03/330195303.db2.gz GGVXGZXTJYURQE-KVSKMBFKSA-N 1 3 286.463 3.956 20 0 CHADHO Cc1ccccc1[C@H]([NH2+][C@@H]1CCN[C@@H](C)C1)C1CCCC1 ZINC000423372416 330195305 /nfs/dbraw/zinc/19/53/05/330195305.db2.gz GGVXGZXTJYURQE-KVSKMBFKSA-N 1 3 286.463 3.956 20 0 CHADHO COc1ccc2cc([C@H](C)N[C@@H]3CCC[C@H]([NH3+])C3)ccc2c1 ZINC000423372110 330195313 /nfs/dbraw/zinc/19/53/13/330195313.db2.gz GTPKJCNDXPTUJZ-DOPJRALCSA-N 1 3 298.430 3.769 20 0 CHADHO C[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1cccc(-c2ccncc2)c1 ZINC000423372947 330195396 /nfs/dbraw/zinc/19/53/96/330195396.db2.gz HKRNZOBCYMSKNZ-JVPBZIDWSA-N 1 3 295.430 3.669 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1ccc2ccccc2c1 ZINC000423403931 330196478 /nfs/dbraw/zinc/19/64/78/330196478.db2.gz XKXCRAWUNDXJND-DOPJRALCSA-N 1 3 268.404 3.760 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423403889 330196483 /nfs/dbraw/zinc/19/64/83/330196483.db2.gz SHQLBOMZYTWZEO-CSMYWGQOSA-N 1 3 292.854 3.769 20 0 CHADHO CC[C@@H](Cc1ccc(C)cc1)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423406134 330196777 /nfs/dbraw/zinc/19/67/77/330196777.db2.gz YPKCXGSIJLRHNU-FQEVSTJZSA-N 1 3 294.442 3.709 20 0 CHADHO Cc1ccc2c(c1)[C@H](NCc1ccc3c(c1)C[NH2+]C3)[C@@H](C)C2 ZINC000423375893 330198575 /nfs/dbraw/zinc/19/85/75/330198575.db2.gz IXNUHVNRMUBWGC-VBKZILBWSA-N 1 3 292.426 3.621 20 0 CHADHO CC(C)[C@@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1ccc(Cl)cc1 ZINC000423384929 330199770 /nfs/dbraw/zinc/19/97/70/330199770.db2.gz QOGLLJVFLYTFAP-DAXOMENPSA-N 1 3 280.843 3.767 20 0 CHADHO C[C@H]([NH2+][C@H]1CCN[C@H](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423388662 330199943 /nfs/dbraw/zinc/19/99/43/330199943.db2.gz UNHGCUUDRHENTE-QNWJLWSRSA-N 1 3 298.883 3.624 20 0 CHADHO C[C@H](N[C@H]1CC[NH2+][C@H](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423388662 330199944 /nfs/dbraw/zinc/19/99/44/330199944.db2.gz UNHGCUUDRHENTE-QNWJLWSRSA-N 1 3 298.883 3.624 20 0 CHADHO CCC[C@H](C)[C@@H](CC)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423392296 330200379 /nfs/dbraw/zinc/20/03/79/330200379.db2.gz PXZRGWKUFSEXIT-SUMWQHHRSA-N 1 3 260.425 3.594 20 0 CHADHO CCCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423393165 330200652 /nfs/dbraw/zinc/20/06/52/330200652.db2.gz QPNLIXUYMUCOLB-CRAIPNDOSA-N 1 3 272.436 3.738 20 0 CHADHO C[C@H]([NH2+]Cc1ccc2c(c1)CNC2)C1CCCCCC1 ZINC000423394320 330200728 /nfs/dbraw/zinc/20/07/28/330200728.db2.gz RELGOVUAKHUYQX-AWEZNQCLSA-N 1 3 272.436 3.738 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@@H]2CCC(C)(C)c3ccccc32)CCN1 ZINC000423394444 330200768 /nfs/dbraw/zinc/20/07/68/330200768.db2.gz ZRMZNIREDFSCGN-JKIFEVAISA-N 1 3 272.436 3.529 20 0 CHADHO C[C@@H](N)[C@H](C)[NH2+][C@@H](C)c1cccc(-c2ccccc2)c1 ZINC000423434571 330201144 /nfs/dbraw/zinc/20/11/44/330201144.db2.gz CZOMIAJSXBASKF-ILXRZTDVSA-N 1 3 268.404 3.740 20 0 CHADHO CC(C)[C@H]([NH2+][C@@H](C)[C@H](C)N)c1cccc(C(F)(F)F)c1 ZINC000423449447 330202726 /nfs/dbraw/zinc/20/27/26/330202726.db2.gz RMPAAZCJBSOMJZ-MJVIPROJSA-N 1 3 288.357 3.728 20 0 CHADHO C[C@@H](CCC[NH3+])N[C@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000423451975 330202844 /nfs/dbraw/zinc/20/28/44/330202844.db2.gz JCJLOXGNZSBCGC-ZANVPECISA-N 1 3 287.234 3.698 20 0 CHADHO CC[C@@H]([NH3+])CN[C@H](C)C(c1ccccc1)c1ccccc1 ZINC000423457423 330203765 /nfs/dbraw/zinc/20/37/65/330203765.db2.gz FQBQHDSRGPQIFC-CRAIPNDOSA-N 1 3 282.431 3.534 20 0 CHADHO CC[C@H](N)C[NH2+][C@@H](C)c1ccc(SC(C)C)cc1 ZINC000423465029 330204453 /nfs/dbraw/zinc/20/44/53/330204453.db2.gz MJHYRGOGLFEYLO-JSGCOSHPSA-N 1 3 266.454 3.575 20 0 CHADHO C[C@H](N)[C@H](C)[NH2+][C@@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423468577 330204852 /nfs/dbraw/zinc/20/48/52/330204852.db2.gz ONTPAOMUJRKMFI-PGUXBMHVSA-N 1 3 266.816 3.507 20 0 CHADHO CC[C@@H](C)[C@H](C)[NH2+]C[C@@H]1CNCC[C@@H]1c1ccc(F)cc1 ZINC000423476799 330205592 /nfs/dbraw/zinc/20/55/92/330205592.db2.gz RNJVPBKKWDWSLW-YQYZPQCESA-N 1 3 292.442 3.543 20 0 CHADHO C[C@H](N[C@@H](CCC[NH3+])c1ccccc1)c1ccccc1 ZINC000423504676 330208730 /nfs/dbraw/zinc/20/87/30/330208730.db2.gz NRQSPBZDPFOIFK-YJBOKZPZSA-N 1 3 268.404 3.817 20 0 CHADHO Cc1ccc([C@@H](C)N[C@@H](CCC[NH3+])c2ccccc2)o1 ZINC000423511533 330209353 /nfs/dbraw/zinc/20/93/53/330209353.db2.gz UAOIQOJDHCZJCT-ZBFHGGJFSA-N 1 3 272.392 3.719 20 0 CHADHO CCc1cccnc1[C@H](C)N[C@@H](CCC[NH3+])c1ccccc1 ZINC000423525456 330210003 /nfs/dbraw/zinc/21/00/03/330210003.db2.gz YIQPEBQSRGIXKD-YJBOKZPZSA-N 1 3 297.446 3.775 20 0 CHADHO Clc1cccc([C@H]2CC[C@@H]([NH2+]CCCNC3CC3)C2)c1 ZINC000423543037 330211136 /nfs/dbraw/zinc/21/11/36/330211136.db2.gz BNZFRAFJUHPBNK-WMLDXEAASA-N 1 3 292.854 3.708 20 0 CHADHO CCC(F)(F)C(C)(C)C[NH2+][C@@H]1CCC[C@H](N(C)C)C1 ZINC000527670296 330269947 /nfs/dbraw/zinc/26/99/47/330269947.db2.gz NFDIDDDRGPRPKF-OLZOCXBDSA-N 1 3 276.415 3.520 20 0 CHADHO CC[C@H](N[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cc(C)ccc1C ZINC000527817797 330282805 /nfs/dbraw/zinc/28/28/05/330282805.db2.gz CMXISNXUNAQDHN-SCTDSRPQSA-N 1 3 286.463 3.971 20 0 CHADHO CC[C@H](N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(C)ccc1C ZINC000527817797 330282806 /nfs/dbraw/zinc/28/28/06/330282806.db2.gz CMXISNXUNAQDHN-SCTDSRPQSA-N 1 3 286.463 3.971 20 0 CHADHO CC(C)c1cccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC000527864595 330285356 /nfs/dbraw/zinc/28/53/56/330285356.db2.gz JLSOBHCONSWPNG-RVKKMQEKSA-N 1 3 274.452 3.943 20 0 CHADHO CC(C)c1cccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1 ZINC000527864595 330285357 /nfs/dbraw/zinc/28/53/57/330285357.db2.gz JLSOBHCONSWPNG-RVKKMQEKSA-N 1 3 274.452 3.943 20 0 CHADHO Cc1ccccc1C1CC(NCCC[NH+]2CCCCC2)C1 ZINC000036843484 330293186 /nfs/dbraw/zinc/29/31/86/330293186.db2.gz MRDREIDJNAYILV-UHFFFAOYSA-N 1 3 286.463 3.707 20 0 CHADHO C[C@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccc2c(c1)CCCC2 ZINC000044534229 330329749 /nfs/dbraw/zinc/32/97/49/330329749.db2.gz FBYWFVDSHKSONJ-HOTGVXAUSA-N 1 3 286.463 3.558 20 0 CHADHO C[C@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccc2c(c1)CCCC2 ZINC000044534229 330329750 /nfs/dbraw/zinc/32/97/50/330329750.db2.gz FBYWFVDSHKSONJ-HOTGVXAUSA-N 1 3 286.463 3.558 20 0 CHADHO CC[C@H](NC[C@H]1CCC[N@H+](C)C1)c1ccc(Cl)cc1 ZINC000044534527 330329931 /nfs/dbraw/zinc/32/99/31/330329931.db2.gz GLGNASSGKSZMHC-CJNGLKHVSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1 ZINC000044534527 330329932 /nfs/dbraw/zinc/32/99/32/330329932.db2.gz GLGNASSGKSZMHC-CJNGLKHVSA-N 1 3 280.843 3.723 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CCCC[C@H]1N)c1ccc(C(F)(F)F)cc1 ZINC000424337463 330343531 /nfs/dbraw/zinc/34/35/31/330343531.db2.gz RVBHCTCKGBGCOL-LERXQTSPSA-N 1 3 286.341 3.626 20 0 CHADHO [NH3+][C@@H]1C[C@@H](N[C@@H]2CCC[C@H](C3CC3)C2)c2ccccc21 ZINC000424385629 330349587 /nfs/dbraw/zinc/34/95/87/330349587.db2.gz WNQDNXVLNCLWDP-MJSCVDMRSA-N 1 3 270.420 3.690 20 0 CHADHO C[C@H](CNCc1cccc2ccccc21)C[NH+]1CCCC1 ZINC000057993872 330380260 /nfs/dbraw/zinc/38/02/60/330380260.db2.gz PUGUJDAQBQDSTK-MRXNPFEDSA-N 1 3 282.431 3.661 20 0 CHADHO C[C@H](C[NH2+]Cc1cccc2ccccc21)CN1CCCC1 ZINC000057993872 330380261 /nfs/dbraw/zinc/38/02/61/330380261.db2.gz PUGUJDAQBQDSTK-MRXNPFEDSA-N 1 3 282.431 3.661 20 0 CHADHO C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]Cc1cccc(CN(C)C)c1 ZINC000434778795 330645146 /nfs/dbraw/zinc/64/51/46/330645146.db2.gz XXIDGQPTEVACBI-PBHICJAKSA-N 1 3 274.452 3.663 20 0 CHADHO C[C@H](CCCC(F)(F)F)[NH2+]C[C@H](C)CN1CCCCC1 ZINC000163377097 331029405 /nfs/dbraw/zinc/02/94/05/331029405.db2.gz ZQPYSYNTEXVQHB-UONOGXRCSA-N 1 3 294.405 3.819 20 0 CHADHO CCC[C@@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)C1CCC1 ZINC000453107623 331089798 /nfs/dbraw/zinc/08/97/98/331089798.db2.gz LQPBUZGAQHNSKV-DOTOQJQBSA-N 1 3 266.473 3.665 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)c1ccsc1 ZINC000453139560 331093387 /nfs/dbraw/zinc/09/33/87/331093387.db2.gz RSDWXMNENIOIIH-KKUMJFAQSA-N 1 3 266.454 3.662 20 0 CHADHO CC[C@@]1(C(C)C)C[C@H]1NC1CC[NH+](C(C)(C)C)CC1 ZINC000453435712 331131549 /nfs/dbraw/zinc/13/15/49/331131549.db2.gz KZZYBCPYKHIRDF-WBVHZDCISA-N 1 3 266.473 3.664 20 0 CHADHO CN(C)[C@H]1CCC[C@@H]([NH2+]C2CC(C)(c3ccccc3)C2)C1 ZINC000459432640 331281152 /nfs/dbraw/zinc/28/11/52/331281152.db2.gz UAILNEZRRSLLLG-RRENTHDGSA-N 1 3 286.463 3.569 20 0 CHADHO C[NH+](C)[C@H]1CCC[C@@H](NC2CC(C)(c3ccccc3)C2)C1 ZINC000459432640 331281153 /nfs/dbraw/zinc/28/11/53/331281153.db2.gz UAILNEZRRSLLLG-RRENTHDGSA-N 1 3 286.463 3.569 20 0 CHADHO C[C@@H](NCC[C@@H]1CCC[N@H+](C)C1)c1cc2ccccc2o1 ZINC000459732677 331296700 /nfs/dbraw/zinc/29/67/00/331296700.db2.gz MNMMNLOFENQHJF-CABCVRRESA-N 1 3 286.419 3.815 20 0 CHADHO C[C@@H](NCC[C@@H]1CCC[N@@H+](C)C1)c1cc2ccccc2o1 ZINC000459732677 331296701 /nfs/dbraw/zinc/29/67/01/331296701.db2.gz MNMMNLOFENQHJF-CABCVRRESA-N 1 3 286.419 3.815 20 0 CHADHO CC[C@H](NCCC1CC[NH+](C)CC1)c1ccccc1F ZINC000166050292 331306454 /nfs/dbraw/zinc/30/64/54/331306454.db2.gz QBXLORZIVMMEMS-KRWDZBQOSA-N 1 3 278.415 3.598 20 0 CHADHO Cc1cccc2c1ncc(C)c2N(C)CC1CC[NH+](C)CC1 ZINC000462509045 331323060 /nfs/dbraw/zinc/32/30/60/331323060.db2.gz IIZMHRKJRIFRKQ-UHFFFAOYSA-N 1 3 297.446 3.630 20 0 CHADHO CCCN(CCC)CCC[NH2+][C@H]1CCC[C@H](C)C1 ZINC000462776491 331328431 /nfs/dbraw/zinc/32/84/31/331328431.db2.gz SNTAYEQQXFBNHD-HOTGVXAUSA-N 1 3 254.462 3.667 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCCC1)[C@H](C)c1ccc(Cl)cc1 ZINC000474888569 331602912 /nfs/dbraw/zinc/60/29/12/331602912.db2.gz PKBUHKACDCRAJD-LSDHHAIUSA-N 1 3 294.870 3.908 20 0 CHADHO CC1CCN(CCC[NH2+][C@H]2CS[C@H](C(C)(C)C)C2)CC1 ZINC000488445277 332009330 /nfs/dbraw/zinc/00/93/30/332009330.db2.gz DXIRGLCLBZTTOX-CVEARBPZSA-N 1 3 298.540 3.618 20 0 CHADHO CC1CC[NH+](CCCN[C@H]2CS[C@H](C(C)(C)C)C2)CC1 ZINC000488445277 332009331 /nfs/dbraw/zinc/00/93/31/332009331.db2.gz DXIRGLCLBZTTOX-CVEARBPZSA-N 1 3 298.540 3.618 20 0 CHADHO C(CN1C[C@@H]2CCCC[C@H]2C1)C[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC000489356389 332048461 /nfs/dbraw/zinc/04/84/61/332048461.db2.gz DUUZPDVZKQEWHP-FNCFJJJESA-N 1 3 290.495 3.621 20 0 CHADHO C(CN1C[C@H]2CCCC[C@@H]2C1)C[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC000489356389 332048463 /nfs/dbraw/zinc/04/84/63/332048463.db2.gz DUUZPDVZKQEWHP-FNCFJJJESA-N 1 3 290.495 3.621 20 0 CHADHO Cc1ccc2c(c1)[C@H]([NH2+]CCCN(C)C(C)C)[C@H](C)C2 ZINC000491379486 332200601 /nfs/dbraw/zinc/20/06/01/332200601.db2.gz IYNFFJLSLUVEMK-CRAIPNDOSA-N 1 3 274.452 3.548 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCCN1)c1ccccc1 ZINC000251121961 334356994 /nfs/dbraw/zinc/35/69/94/334356994.db2.gz RHBKXUHYFOHPTB-NXWXRZEISA-N 1 3 286.463 3.691 20 0 CHADHO CN(C)[C@H]1CCC[N@H+](Cc2ccc(C3CCC3)cc2)CC1 ZINC000513246850 333010823 /nfs/dbraw/zinc/01/08/23/333010823.db2.gz DQGQEAMJHLFYTC-IBGZPJMESA-N 1 3 286.463 3.870 20 0 CHADHO CN(C)[C@H]1CCC[N@@H+](Cc2ccc(C3CCC3)cc2)CC1 ZINC000513246850 333010825 /nfs/dbraw/zinc/01/08/25/333010825.db2.gz DQGQEAMJHLFYTC-IBGZPJMESA-N 1 3 286.463 3.870 20 0 CHADHO C[C@H](Cc1ccoc1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000513340835 333014757 /nfs/dbraw/zinc/01/47/57/333014757.db2.gz NZDFGTLRSGLLDR-OAHLLOKOSA-N 1 3 290.451 3.597 20 0 CHADHO C[C@H](Cc1ccoc1)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000513340835 333014759 /nfs/dbraw/zinc/01/47/59/333014759.db2.gz NZDFGTLRSGLLDR-OAHLLOKOSA-N 1 3 290.451 3.597 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H](C)C2CCCCC2)C1 ZINC000177299197 333057232 /nfs/dbraw/zinc/05/72/32/333057232.db2.gz CPGXIRYLKOORBA-JKSUJKDBSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@@H](NCc1ccc(C[NH+](C)C)cc1)c1ccsc1 ZINC000178382869 333071993 /nfs/dbraw/zinc/07/19/93/333071993.db2.gz UZJXQECQGHHPED-CYBMUJFWSA-N 1 3 274.433 3.661 20 0 CHADHO C[C@H](CN[C@@H](c1cccs1)C1CCCC1)C[NH+](C)C ZINC000311825350 333073060 /nfs/dbraw/zinc/07/30/60/333073060.db2.gz ODHJAEPKCHOCOT-CZUORRHYSA-N 1 3 280.481 3.767 20 0 CHADHO C[C@@H](CN[C@@H](c1cccs1)C1CCCC1)C[NH+](C)C ZINC000311825351 333073124 /nfs/dbraw/zinc/07/31/24/333073124.db2.gz ODHJAEPKCHOCOT-XJKSGUPXSA-N 1 3 280.481 3.767 20 0 CHADHO Cc1cccc([C@@H](C)[NH2+]CCCN2CCCC[C@H]2C)c1 ZINC000312051831 333076084 /nfs/dbraw/zinc/07/60/84/333076084.db2.gz STIGOBVCIFICMA-IAGOWNOFSA-N 1 3 274.452 3.910 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccccc1)CN1CCCC1 ZINC000516880647 333085133 /nfs/dbraw/zinc/08/51/33/333085133.db2.gz ZFHMTRYCNYZVBT-CAMMJAKZSA-N 1 3 286.463 3.500 20 0 CHADHO C[C@@H]1C[C@@H](C)C[NH+](CCCCNCc2ccc(Cl)o2)C1 ZINC000517537124 333101502 /nfs/dbraw/zinc/10/15/02/333101502.db2.gz FKSMCXHHWXDCNT-ZIAGYGMSSA-N 1 3 298.858 3.781 20 0 CHADHO C[C@H](N[C@@H]1CCc2ccccc21)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183185104 333119504 /nfs/dbraw/zinc/11/95/04/333119504.db2.gz IBMJUXDJSANWFL-XAUMDUMWSA-N 1 3 298.474 3.917 20 0 CHADHO C[C@H](N[C@@H]1CCc2ccccc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183185104 333119505 /nfs/dbraw/zinc/11/95/05/333119505.db2.gz IBMJUXDJSANWFL-XAUMDUMWSA-N 1 3 298.474 3.917 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCc2ccccc21)[C@@H]1CCCN(C2CCC2)C1 ZINC000183185104 333119507 /nfs/dbraw/zinc/11/95/07/333119507.db2.gz IBMJUXDJSANWFL-XAUMDUMWSA-N 1 3 298.474 3.917 20 0 CHADHO CC(C)CN1CCC[C@@H](C[NH2+][C@@H]2CCC23CCCC3)C1 ZINC000189178465 333183688 /nfs/dbraw/zinc/18/36/88/333183688.db2.gz ULUBGNVEPUJOCT-DLBZAZTESA-N 1 3 278.484 3.667 20 0 CHADHO C[C@@H](NCCCC[NH+](C)C)c1cccc(Cl)c1Cl ZINC000222903226 333201963 /nfs/dbraw/zinc/20/19/63/333201963.db2.gz IMSKZATWHMJJIS-LLVKDONJSA-N 1 3 289.250 3.986 20 0 CHADHO C[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)c1ccc(C(F)(F)F)cc1 ZINC000222949949 333202795 /nfs/dbraw/zinc/20/27/95/333202795.db2.gz RJEYASWRWPXBPC-GDLCADMTSA-N 1 3 286.341 3.626 20 0 CHADHO CCN(C[C@@H]1CCC[NH2+]C1)[C@@H](C)c1cc2ccccc2o1 ZINC000226437119 333261022 /nfs/dbraw/zinc/26/10/22/333261022.db2.gz CBARAJXPEPIUGS-LSDHHAIUSA-N 1 3 286.419 3.815 20 0 CHADHO NCCC[N@@H+](Cc1ccnc2ccccc12)CC1CCCC1 ZINC000576040793 335144378 /nfs/dbraw/zinc/14/43/78/335144378.db2.gz TXQMAZUYALOALE-UHFFFAOYSA-N 1 3 297.446 3.576 20 0 CHADHO NCCC[N@H+](Cc1ccnc2ccccc12)CC1CCCC1 ZINC000576040793 335144379 /nfs/dbraw/zinc/14/43/79/335144379.db2.gz TXQMAZUYALOALE-UHFFFAOYSA-N 1 3 297.446 3.576 20 0 CHADHO [NH3+]CCCN(Cc1ccnc2ccccc12)CC1CCCC1 ZINC000576040793 335144380 /nfs/dbraw/zinc/14/43/80/335144380.db2.gz TXQMAZUYALOALE-UHFFFAOYSA-N 1 3 297.446 3.576 20 0 CHADHO CCc1ccc([C@H](CC(C)C)N2CCC([NH3+])CC2)cc1 ZINC000530209282 333528128 /nfs/dbraw/zinc/52/81/28/333528128.db2.gz WFKNDFPKIKFAHB-SFHVURJKSA-N 1 3 274.452 3.759 20 0 CHADHO CCC[C@@H](CC)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000134111211 334080681 /nfs/dbraw/zinc/08/06/81/334080681.db2.gz CMUJLEKWAZIFEG-OAHLLOKOSA-N 1 3 266.473 3.952 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H]2CCc3cc(Cl)ccc32)C1 ZINC000246996351 334273521 /nfs/dbraw/zinc/27/35/21/334273521.db2.gz KLAHBVARYCKHHI-DYVFJYSZSA-N 1 3 292.854 3.649 20 0 CHADHO CC(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCN3CCC[C@H]3C2)CC1 ZINC000245917963 334223975 /nfs/dbraw/zinc/22/39/75/334223975.db2.gz FWDOFLLNBOUGFO-OWSLCNJRSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@H](NCCC[NH+](C)C)c1ccc(F)c2ccccc21 ZINC000550994920 334235673 /nfs/dbraw/zinc/23/56/73/334235673.db2.gz WHHRZRQMEBMFCA-ZDUSSCGKSA-N 1 3 274.383 3.581 20 0 CHADHO C[C@@H]([NH2+]C[C@H](C)CN1CCCC1)c1cccc(C2CC2)c1 ZINC000551008507 334236084 /nfs/dbraw/zinc/23/60/84/334236084.db2.gz WNQMQZCHZUBNFJ-JKSUJKDBSA-N 1 3 286.463 3.947 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC(C)(C)C(C)(C)C)CC1 ZINC000551228320 334241112 /nfs/dbraw/zinc/24/11/12/334241112.db2.gz FUKWLWNIWCOZST-UHFFFAOYSA-N 1 3 268.489 3.911 20 0 CHADHO Cc1cccc([C@H](C)[NH2+][C@H]2CCC[C@@H](N(C)C)C2)c1 ZINC000247089759 334275601 /nfs/dbraw/zinc/27/56/01/334275601.db2.gz NXCPMRSAAZUBKN-BHYGNILZSA-N 1 3 260.425 3.518 20 0 CHADHO CCSc1ccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000247156235 334276653 /nfs/dbraw/zinc/27/66/53/334276653.db2.gz XLNWJCIKHAXCTA-OFQRWUPVSA-N 1 3 292.492 3.932 20 0 CHADHO CCSc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000247156235 334276655 /nfs/dbraw/zinc/27/66/55/334276655.db2.gz XLNWJCIKHAXCTA-OFQRWUPVSA-N 1 3 292.492 3.932 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H](C)c2ccc(F)cc2)C1 ZINC000247116059 334276004 /nfs/dbraw/zinc/27/60/04/334276004.db2.gz UFIIKVQODBVLKB-HUUCEWRRSA-N 1 3 278.415 3.597 20 0 CHADHO CC(C)[C@H]1CC[C@H]1NCCC[NH+](C(C)C)C(C)C ZINC000552046539 334281109 /nfs/dbraw/zinc/28/11/09/334281109.db2.gz KEWFJFUNLRRMNY-HZPDHXFCSA-N 1 3 254.462 3.520 20 0 CHADHO CC(C)[C@H]1CC[C@H]1[NH2+]CCCN(C(C)C)C(C)C ZINC000552046539 334281110 /nfs/dbraw/zinc/28/11/10/334281110.db2.gz KEWFJFUNLRRMNY-HZPDHXFCSA-N 1 3 254.462 3.520 20 0 CHADHO CCN(CC)C[C@H]1CC[N@@H+]([C@H](C)c2ccccc2C)C1 ZINC000248147784 334295938 /nfs/dbraw/zinc/29/59/38/334295938.db2.gz QJWYENWLEKEFIT-IAGOWNOFSA-N 1 3 274.452 3.720 20 0 CHADHO CCN(CC)C[C@H]1CC[N@H+]([C@H](C)c2ccccc2C)C1 ZINC000248147784 334295939 /nfs/dbraw/zinc/29/59/39/334295939.db2.gz QJWYENWLEKEFIT-IAGOWNOFSA-N 1 3 274.452 3.720 20 0 CHADHO CC[C@H](C)[C@H](C)[NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000248406658 334300250 /nfs/dbraw/zinc/30/02/50/334300250.db2.gz SRSNCUSBUFXBTA-CAOSSQGBSA-N 1 3 266.473 3.664 20 0 CHADHO C[N@@H+]1CC[C@H](NCc2cccc3ccccc32)[C@@H]2CCC[C@@H]21 ZINC000552248727 334308620 /nfs/dbraw/zinc/30/86/20/334308620.db2.gz QWCKWZYFQGGAGQ-UFYCRDLUSA-N 1 3 294.442 3.802 20 0 CHADHO C[N@H+]1CC[C@H](NCc2cccc3ccccc32)[C@@H]2CCC[C@@H]21 ZINC000552248727 334308621 /nfs/dbraw/zinc/30/86/21/334308621.db2.gz QWCKWZYFQGGAGQ-UFYCRDLUSA-N 1 3 294.442 3.802 20 0 CHADHO C[C@H](CCC1CC1)[NH2+][C@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000248971558 334323603 /nfs/dbraw/zinc/32/36/03/334323603.db2.gz GQYDRUHKGQBFHQ-INMHGKMJSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]C2CC(C)(C)NC(C)(C)C2)C[C@H]1C ZINC000251784574 334369506 /nfs/dbraw/zinc/36/95/06/334369506.db2.gz LHAADSDLVLKVSU-MCIONIFRSA-N 1 3 266.473 3.710 20 0 CHADHO COc1cccc([C@@H](C)[NH2+]CCCN2CCCC[C@H]2C)c1 ZINC000252094308 334373473 /nfs/dbraw/zinc/37/34/73/334373473.db2.gz FDXRLHVYSHFSOA-HZPDHXFCSA-N 1 3 290.451 3.610 20 0 CHADHO C[NH+](C)Cc1cccc(CN[C@H](c2ccccc2)C2CC2)c1 ZINC000091281249 334374960 /nfs/dbraw/zinc/37/49/60/334374960.db2.gz SUDKCSFAJYFWMV-HXUWFJFHSA-N 1 3 294.442 3.989 20 0 CHADHO C[NH+](C)[C@@H]1CCC[C@H](N[C@@H](c2ccccc2)C2CC2)C1 ZINC000091367796 334377446 /nfs/dbraw/zinc/37/74/46/334377446.db2.gz VBVOAJBPUYKOGA-KSZLIROESA-N 1 3 272.436 3.600 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@@H](c2ccccc2)C2CC2)C1 ZINC000091367796 334377447 /nfs/dbraw/zinc/37/74/47/334377447.db2.gz VBVOAJBPUYKOGA-KSZLIROESA-N 1 3 272.436 3.600 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](CC(C)C)c2ccccc2)C1 ZINC000252438743 334380075 /nfs/dbraw/zinc/38/00/75/334380075.db2.gz FZZYYOODDSSKCO-FUHWJXTLSA-N 1 3 274.452 3.705 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](CC(C)C)c2ccccc2)C1 ZINC000252438743 334380077 /nfs/dbraw/zinc/38/00/77/334380077.db2.gz FZZYYOODDSSKCO-FUHWJXTLSA-N 1 3 274.452 3.705 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](CC(C)C)c2ccccc2)C1 ZINC000252438743 334380079 /nfs/dbraw/zinc/38/00/79/334380079.db2.gz FZZYYOODDSSKCO-FUHWJXTLSA-N 1 3 274.452 3.705 20 0 CHADHO CC(C)CC[NH+]1CCC(CN[C@@H](C)c2cncs2)CC1 ZINC000163579821 334870494 /nfs/dbraw/zinc/87/04/94/334870494.db2.gz NCAUHSPKJFJLOG-AWEZNQCLSA-N 1 3 295.496 3.552 20 0 CHADHO CCc1cccc(C[NH2+]C2CCN(C3CCCC3)CC2)c1 ZINC000576285185 335183257 /nfs/dbraw/zinc/18/32/57/335183257.db2.gz YOFBQZJZWHNVNI-UHFFFAOYSA-N 1 3 286.463 3.746 20 0 CHADHO CCCC[C@H]([NH2+]CC1=CCN(C)CC1)c1ccccc1 ZINC000344299712 335246466 /nfs/dbraw/zinc/24/64/66/335246466.db2.gz PLCMSIPGAKGPRJ-SFHVURJKSA-N 1 3 272.436 3.769 20 0 CHADHO CC(C)Oc1ccc([C@H](C)NCc2ccc(C[NH3+])cc2)cc1 ZINC000580552075 335279024 /nfs/dbraw/zinc/27/90/24/335279024.db2.gz NYWYLUFREYDTBQ-HNNXBMFYSA-N 1 3 298.430 3.783 20 0 CHADHO C[C@H](NCCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccoc1 ZINC000178111776 335415939 /nfs/dbraw/zinc/41/59/39/335415939.db2.gz KJCQGVYRYRLZBK-OAGGEKHMSA-N 1 3 278.440 3.688 20 0 CHADHO CC[C@H]([NH2+]C1CCN(c2ccncc2)CC1)C1CCCC1 ZINC000382816843 336097650 /nfs/dbraw/zinc/09/76/50/336097650.db2.gz DPWGMHUTHCCOKL-SFHVURJKSA-N 1 3 287.451 3.609 20 0 CHADHO CC(C)(C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCCN1)C1CCC1 ZINC000385029569 336135998 /nfs/dbraw/zinc/13/59/98/336135998.db2.gz KFSYCGIAXSQPKJ-BRWVUGGUSA-N 1 3 278.484 3.713 20 0 CHADHO CSCC1CCC([NH2+]C2CC(C)(C)NC(C)(C)C2)CC1 ZINC000385769204 336156023 /nfs/dbraw/zinc/15/60/23/336156023.db2.gz ZUCBNPMPEJJHFI-UHFFFAOYSA-N 1 3 298.540 3.807 20 0 CHADHO CC(C)N1CCC([NH2+]Cc2ccc3sccc3c2)CC1 ZINC000289933541 519673324 /nfs/dbraw/zinc/67/33/24/519673324.db2.gz VPWLYBSZRDOQLW-UHFFFAOYSA-N 1 3 288.460 3.864 20 0 CHADHO CC(C)c1ccc([C@@H](C)N2CCC[C@H](C[NH3+])C2)cc1 ZINC000044527962 519839231 /nfs/dbraw/zinc/83/92/31/519839231.db2.gz OMWGBVDAZZWZOQ-HUUCEWRRSA-N 1 3 260.425 3.542 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CCC[C@H](C[NH3+])C2)cc1 ZINC000044527963 519839808 /nfs/dbraw/zinc/83/98/08/519839808.db2.gz OMWGBVDAZZWZOQ-LSDHHAIUSA-N 1 3 260.425 3.542 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N[C@H](C)c1ccc(Cl)cn1 ZINC000274906803 520630314 /nfs/dbraw/zinc/63/03/14/520630314.db2.gz MJAZQYYRKFAOIW-ZIAGYGMSSA-N 1 3 297.874 3.896 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N[C@@H](C)c1ccc(Cl)cn1 ZINC000274906801 520631622 /nfs/dbraw/zinc/63/16/22/520631622.db2.gz MJAZQYYRKFAOIW-KGLIPLIRSA-N 1 3 297.874 3.896 20 0 CHADHO CC1CC[NH+](CCCCNCc2ccc(Cl)o2)CC1 ZINC000340427060 521002551 /nfs/dbraw/zinc/00/25/51/521002551.db2.gz PMBJLXRJWODJMO-UHFFFAOYSA-N 1 3 284.831 3.535 20 0 CHADHO CCN1CC[C@@H](C[NH2+]C2CC(c3ccc(Cl)cc3)C2)C1 ZINC000037644378 521710437 /nfs/dbraw/zinc/71/04/37/521710437.db2.gz BSPJABYFHHNXSH-KTAKPFMOSA-N 1 3 292.854 3.517 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H]2C[C@H](C)Sc3sccc32)C1 ZINC000130351777 521711230 /nfs/dbraw/zinc/71/12/30/521711230.db2.gz PXDPUMRDVMYDQR-SGMGOOAPSA-N 1 3 296.505 3.605 20 0 CHADHO C[C@@H]1CCCC[N@@H+]1CCCCNCc1ccc(Cl)o1 ZINC000340424513 524101909 /nfs/dbraw/zinc/10/19/09/524101909.db2.gz FOOQXIDNQWQFBY-CYBMUJFWSA-N 1 3 284.831 3.677 20 0 CHADHO C[C@@H]1CCCC[N@H+]1CCCCNCc1ccc(Cl)o1 ZINC000340424513 524101917 /nfs/dbraw/zinc/10/19/17/524101917.db2.gz FOOQXIDNQWQFBY-CYBMUJFWSA-N 1 3 284.831 3.677 20 0 CHADHO Cc1ccc([C@@H](NC[C@H]2CC[N@@H+](C3CC3)C2)C2CC2)cc1 ZINC000037648850 525775784 /nfs/dbraw/zinc/77/57/84/525775784.db2.gz UODNGVXQSFUFQB-DNVCBOLYSA-N 1 3 284.447 3.520 20 0 CHADHO Cc1ccc([C@@H](NC[C@H]2CC[N@H+](C3CC3)C2)C2CC2)cc1 ZINC000037648850 525775791 /nfs/dbraw/zinc/77/57/91/525775791.db2.gz UODNGVXQSFUFQB-DNVCBOLYSA-N 1 3 284.447 3.520 20 0 CHADHO Cc1oc2ccccc2c1CN(C)[C@@H]1CC[N@@H+](C)C[C@H]1C ZINC000290395753 526786005 /nfs/dbraw/zinc/78/60/05/526786005.db2.gz JBEVLEWOYNJBDR-CXAGYDPISA-N 1 3 286.419 3.513 20 0 CHADHO Cc1oc2ccccc2c1CN(C)[C@@H]1CC[N@H+](C)C[C@H]1C ZINC000290395753 526786007 /nfs/dbraw/zinc/78/60/07/526786007.db2.gz JBEVLEWOYNJBDR-CXAGYDPISA-N 1 3 286.419 3.513 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@@H](CC)c2cccc(C)c2)C1 ZINC000353525335 528254920 /nfs/dbraw/zinc/25/49/20/528254920.db2.gz YINCEHORGCMJOV-WMZOPIPTSA-N 1 3 274.452 3.768 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@@H](CC)c2cccc(C)c2)C1 ZINC000353525335 528254926 /nfs/dbraw/zinc/25/49/26/528254926.db2.gz YINCEHORGCMJOV-WMZOPIPTSA-N 1 3 274.452 3.768 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H](CC)c2cccc(C)c2)C1 ZINC000353525335 528254928 /nfs/dbraw/zinc/25/49/28/528254928.db2.gz YINCEHORGCMJOV-WMZOPIPTSA-N 1 3 274.452 3.768 20 0 CHADHO CCCC[C@H](C)[C@H](C)[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000579877965 1117979761 /nfs/dbraw/zinc/97/97/61/1117979761.db2.gz YMOACVAIBDUHCM-ULQDDVLXSA-N 1 3 268.489 3.911 20 0 CHADHO C[C@H]1C[C@H](C)CN(CCC[NH2+]C2CCC(C)(C)CC2)C1 ZINC001648814930 1118223684 /nfs/dbraw/zinc/22/36/84/1118223684.db2.gz VJSXCSHNLDLDGD-HOTGVXAUSA-N 1 3 280.500 3.913 20 0 CHADHO CC[C@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)[C@H]1CC1(C)C ZINC000414111334 1119902147 /nfs/dbraw/zinc/90/21/47/1119902147.db2.gz IYKZWWOTWWFCER-XHSDSOJGSA-N 1 3 266.473 3.521 20 0 CHADHO CC(C)=CCC[C@H](C)[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663467861 1120981793 /nfs/dbraw/zinc/98/17/93/1120981793.db2.gz IIMJNEXYMLJVTI-WMZOPIPTSA-N 1 3 278.484 3.833 20 0 CHADHO Cc1c(F)ccc(CN2CCC[C@](C)(C[NH3+])CC2)c1Cl ZINC001206325750 1121779735 /nfs/dbraw/zinc/77/97/35/1121779735.db2.gz IUFOBTPGALDWDF-INIZCTEOSA-N 1 3 298.833 3.738 20 0 CHADHO CCCC[C@@H]1C[C@@H](N[C@@H]2CC23CCCCC3)CC[NH2+]1 ZINC001246334721 1131475436 /nfs/dbraw/zinc/47/54/36/1131475436.db2.gz PNKZNMGZEBJQOD-OWCLPIDISA-N 1 3 264.457 3.610 20 0 CHADHO C[C@H]1CC[C@H](C)C1[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001171629208 1132061403 /nfs/dbraw/zinc/06/14/03/1132061403.db2.gz PQROKQAFOCXNOV-STQMWFEESA-N 1 3 266.473 3.662 20 0 CHADHO C[NH+]1C(C)(C)CC(NCCc2ccsc2)CC1(C)C ZINC001171619504 1132065917 /nfs/dbraw/zinc/06/59/17/1132065917.db2.gz NDCAMBRBHMMTRX-UHFFFAOYSA-N 1 3 280.481 3.532 20 0 CHADHO CC[C@@H](C)OCC[C@@H](C)[NH+]1C(C)(C)CC(N)CC1(C)C ZINC001172320713 1132158276 /nfs/dbraw/zinc/15/82/76/1132158276.db2.gz ZSAQFWQHGLRDSP-ZIAGYGMSSA-N 1 3 284.488 3.560 20 0 CHADHO CCc1ccc(C[C@H](C)[NH2+]CCCN(CC)CC)cc1 ZINC001173238708 1132439919 /nfs/dbraw/zinc/43/99/19/1132439919.db2.gz WDFFQTQHHRVLCR-INIZCTEOSA-N 1 3 276.468 3.502 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CCC[C@H](CN)[C@@H]1C ZINC001205902588 1133629063 /nfs/dbraw/zinc/62/90/63/1133629063.db2.gz KSIXHALIWPXQDF-PPPANMTLSA-N 1 3 266.473 3.962 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CCC[C@H](CN)[C@@H]1C ZINC001205902588 1133629068 /nfs/dbraw/zinc/62/90/68/1133629068.db2.gz KSIXHALIWPXQDF-PPPANMTLSA-N 1 3 266.473 3.962 20 0 CHADHO Cc1ccc(CN2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)s1 ZINC000246192579 1125609329 /nfs/dbraw/zinc/60/93/29/1125609329.db2.gz LIWIMHBMJLTZFX-WMLDXEAASA-N 1 3 290.476 3.505 20 0 CHADHO Cc1ccc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)s1 ZINC000246192579 1125609332 /nfs/dbraw/zinc/60/93/32/1125609332.db2.gz LIWIMHBMJLTZFX-WMLDXEAASA-N 1 3 290.476 3.505 20 0 CHADHO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)s1 ZINC000247156471 1125655274 /nfs/dbraw/zinc/65/52/74/1125655274.db2.gz RSRSTIPJWHDMNS-BFHYXJOUSA-N 1 3 266.454 3.580 20 0 CHADHO Cc1ccccc1C1CC(N(C[C@@H]2CCC[NH2+]C2)C2CC2)C1 ZINC000261809250 1125744812 /nfs/dbraw/zinc/74/48/12/1125744812.db2.gz HNFFOPNXVZSQCU-LRYGQEGESA-N 1 3 298.474 3.705 20 0 CHADHO Cc1ccccc1C1CC([N@H+](C[C@@H]2CCCNC2)C2CC2)C1 ZINC000261809250 1125744816 /nfs/dbraw/zinc/74/48/16/1125744816.db2.gz HNFFOPNXVZSQCU-LRYGQEGESA-N 1 3 298.474 3.705 20 0 CHADHO Cc1ccccc1C1CC([N@@H+](C[C@@H]2CCCNC2)C2CC2)C1 ZINC000261809250 1125744821 /nfs/dbraw/zinc/74/48/21/1125744821.db2.gz HNFFOPNXVZSQCU-LRYGQEGESA-N 1 3 298.474 3.705 20 0 CHADHO CN1CCCC[C@H]1CC[N@H+](C)[C@@H]1CCc2ccc(F)cc21 ZINC000483062962 1126766390 /nfs/dbraw/zinc/76/63/90/1126766390.db2.gz LFMSEUISFLKLOZ-FUHWJXTLSA-N 1 3 290.426 3.619 20 0 CHADHO CN1CCCC[C@H]1CC[N@@H+](C)[C@@H]1CCc2ccc(F)cc21 ZINC000483062962 1126766393 /nfs/dbraw/zinc/76/63/93/1126766393.db2.gz LFMSEUISFLKLOZ-FUHWJXTLSA-N 1 3 290.426 3.619 20 0 CHADHO C[NH+](C)CC[C@H](N[C@H]1CCc2cc(F)ccc21)C(C)(C)C ZINC000483175388 1126771051 /nfs/dbraw/zinc/77/10/51/1126771051.db2.gz ICWCYXJIJZJTIS-IRXDYDNUSA-N 1 3 292.442 3.769 20 0 CHADHO CCN(C)C[C@H]1CC[N@H+](Cc2c(C)ccc3ccccc32)C1 ZINC000483216791 1126773153 /nfs/dbraw/zinc/77/31/53/1126773153.db2.gz BLXKLPUPTRKGCV-QGZVFWFLSA-N 1 3 296.458 3.922 20 0 CHADHO CCN(C)C[C@H]1CC[N@@H+](Cc2c(C)ccc3ccccc32)C1 ZINC000483216791 1126773157 /nfs/dbraw/zinc/77/31/57/1126773157.db2.gz BLXKLPUPTRKGCV-QGZVFWFLSA-N 1 3 296.458 3.922 20 0 CHADHO CC[N@H+](C)C[C@H]1CCN(Cc2c(C)ccc3ccccc32)C1 ZINC000483216791 1126773161 /nfs/dbraw/zinc/77/31/61/1126773161.db2.gz BLXKLPUPTRKGCV-QGZVFWFLSA-N 1 3 296.458 3.922 20 0 CHADHO CC[N@@H+](C)C[C@H]1CCN(Cc2c(C)ccc3ccccc32)C1 ZINC000483216791 1126773165 /nfs/dbraw/zinc/77/31/65/1126773165.db2.gz BLXKLPUPTRKGCV-QGZVFWFLSA-N 1 3 296.458 3.922 20 0 CHADHO CC1=C(C)CN(C/C=C\C[N@@H+]2CCC(C)=C(C)C2)CC1 ZINC000483336380 1126781651 /nfs/dbraw/zinc/78/16/51/1126781651.db2.gz DVJWQPYOECCTSZ-WAYWQWQTSA-N 1 3 274.452 3.627 20 0 CHADHO CC1=C(C)CN(C/C=C\C[N@H+]2CCC(C)=C(C)C2)CC1 ZINC000483336380 1126781654 /nfs/dbraw/zinc/78/16/54/1126781654.db2.gz DVJWQPYOECCTSZ-WAYWQWQTSA-N 1 3 274.452 3.627 20 0 CHADHO Cc1cc([C@H](C)[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)cc(C)c1F ZINC000484473173 1126820296 /nfs/dbraw/zinc/82/02/96/1126820296.db2.gz LVXRCOBJDATHQG-USXIJHARSA-N 1 3 292.442 3.966 20 0 CHADHO CC(C)=CCCC1=CC[C@H](C[N@@H+]2CC[C@@H](CN)C2)CC1 ZINC001235751234 1130776099 /nfs/dbraw/zinc/77/60/99/1130776099.db2.gz XHZLKCGVLVOYFH-ROUUACIJSA-N 1 3 276.468 3.740 20 0 CHADHO CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@@H](CN)C2)CC1 ZINC001235751234 1130776101 /nfs/dbraw/zinc/77/61/01/1130776101.db2.gz XHZLKCGVLVOYFH-ROUUACIJSA-N 1 3 276.468 3.740 20 0 CHADHO CCC[C@@H](NC[C@@H]1CC[N@H+](CC)C1)c1ccsc1 ZINC000191208470 1126948967 /nfs/dbraw/zinc/94/89/67/1126948967.db2.gz HLCSCXOAOCYUNW-DZGCQCFKSA-N 1 3 266.454 3.521 20 0 CHADHO CCC[C@@H](NC[C@@H]1CC[N@@H+](CC)C1)c1ccsc1 ZINC000191208470 1126948970 /nfs/dbraw/zinc/94/89/70/1126948970.db2.gz HLCSCXOAOCYUNW-DZGCQCFKSA-N 1 3 266.454 3.521 20 0 CHADHO CCC[C@@H]([NH2+]C[C@@H]1CCN(CC)C1)c1ccsc1 ZINC000191208470 1126948973 /nfs/dbraw/zinc/94/89/73/1126948973.db2.gz HLCSCXOAOCYUNW-DZGCQCFKSA-N 1 3 266.454 3.521 20 0 CHADHO C[C@H]([NH2+]C1CCN(CC2CCCC2)CC1)[C@H]1CC1(C)C ZINC000486989566 1127014800 /nfs/dbraw/zinc/01/48/00/1127014800.db2.gz UKBQPKWOUZGXMX-WMLDXEAASA-N 1 3 278.484 3.665 20 0 CHADHO C[C@@H](NCCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(F)cn1 ZINC000271288036 1127074205 /nfs/dbraw/zinc/07/42/05/1127074205.db2.gz DNPLEIMHASGEDU-LSDHHAIUSA-N 1 3 293.430 3.526 20 0 CHADHO C[C@@H](NCCCC[N@H+]1CCCC[C@@H]1C)c1ccc(F)cn1 ZINC000271288036 1127074208 /nfs/dbraw/zinc/07/42/08/1127074208.db2.gz DNPLEIMHASGEDU-LSDHHAIUSA-N 1 3 293.430 3.526 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCNC2(CCC2)C1)c1cccc(Cl)c1 ZINC000666993921 1127138408 /nfs/dbraw/zinc/13/84/08/1127138408.db2.gz STUVPUQFPJDRMQ-CZUORRHYSA-N 1 3 292.854 3.708 20 0 CHADHO CC[C@@H]1c2ccccc2CCN1C1CC[NH+](CC2CC2)CC1 ZINC001168387739 1127215552 /nfs/dbraw/zinc/21/55/52/1127215552.db2.gz RXWCYTBVKSZWBU-HXUWFJFHSA-N 1 3 298.474 3.870 20 0 CHADHO Cc1oc2ccccc2c1CN1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000355215369 1127325839 /nfs/dbraw/zinc/32/58/39/1127325839.db2.gz ZDTYUMDFQTWFLG-CRAIPNDOSA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1CN1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000355215369 1127325842 /nfs/dbraw/zinc/32/58/42/1127325842.db2.gz ZDTYUMDFQTWFLG-CRAIPNDOSA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1C[N@@H+]1CC[C@@H]2[C@H](CCCN2C)C1 ZINC000355215369 1127325843 /nfs/dbraw/zinc/32/58/43/1127325843.db2.gz ZDTYUMDFQTWFLG-CRAIPNDOSA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1C[N@H+]1CC[C@@H]2[C@H](CCCN2C)C1 ZINC000355215369 1127325846 /nfs/dbraw/zinc/32/58/46/1127325846.db2.gz ZDTYUMDFQTWFLG-CRAIPNDOSA-N 1 3 298.430 3.657 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1N[C@H]1CCCc2ccc(F)cc21 ZINC000359031663 1127445428 /nfs/dbraw/zinc/44/54/28/1127445428.db2.gz QCJRJQAEKILSNT-COCCGSRQSA-N 1 3 290.426 3.521 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1N[C@H]1CCCc2ccc(F)cc21 ZINC000359031663 1127445430 /nfs/dbraw/zinc/44/54/30/1127445430.db2.gz QCJRJQAEKILSNT-COCCGSRQSA-N 1 3 290.426 3.521 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H]2CCCCc3ccccc32)C1 ZINC000360233679 1127493622 /nfs/dbraw/zinc/49/36/22/1127493622.db2.gz JHDJXUCXYBQPQT-APWZRJJASA-N 1 3 286.463 3.776 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H]2CCCCc3ccccc32)C1 ZINC000360233679 1127493623 /nfs/dbraw/zinc/49/36/23/1127493623.db2.gz JHDJXUCXYBQPQT-APWZRJJASA-N 1 3 286.463 3.776 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H]2CCCCc3ccccc32)C1 ZINC000360233679 1127493624 /nfs/dbraw/zinc/49/36/24/1127493624.db2.gz JHDJXUCXYBQPQT-APWZRJJASA-N 1 3 286.463 3.776 20 0 CHADHO CCCCCN1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000605186833 1127731282 /nfs/dbraw/zinc/73/12/82/1127731282.db2.gz ZQQHPVHJCOPWSM-QGZVFWFLSA-N 1 3 266.473 3.621 20 0 CHADHO Cc1ccccc1C1CC([NH2+]C[C@H](C)CN2CCCC2)C1 ZINC000062078497 1127732281 /nfs/dbraw/zinc/73/22/81/1127732281.db2.gz RJBMFAQUEIEZDW-ZLPCBKJTSA-N 1 3 286.463 3.563 20 0 CHADHO CC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCCN(CC(C)C)C1 ZINC000540147242 1127963175 /nfs/dbraw/zinc/96/31/75/1127963175.db2.gz HUZCLOZOELOZCM-BBWFWOEESA-N 1 3 266.473 3.523 20 0 CHADHO CC[C@H]([NH2+]CC[C@H]1CCCN1C)C(C)(C)c1ccccc1 ZINC000540526861 1127983058 /nfs/dbraw/zinc/98/30/58/1127983058.db2.gz YIASJNMVJGIUJH-MSOLQXFVSA-N 1 3 288.479 3.817 20 0 CHADHO CCc1cccc(CN2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000469730907 1128051193 /nfs/dbraw/zinc/05/11/93/1128051193.db2.gz GZHMBKKLLZJADJ-ICSRJNTNSA-N 1 3 298.474 3.698 20 0 CHADHO CCc1cccc(CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000469730907 1128051198 /nfs/dbraw/zinc/05/11/98/1128051198.db2.gz GZHMBKKLLZJADJ-ICSRJNTNSA-N 1 3 298.474 3.698 20 0 CHADHO CC[C@@H](c1ccccc1)N1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000470958926 1128084055 /nfs/dbraw/zinc/08/40/55/1128084055.db2.gz LXFYLSXUFZWCFY-HKUYNNGSSA-N 1 3 286.463 3.801 20 0 CHADHO CC[C@@H](c1ccccc1)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000470958926 1128084058 /nfs/dbraw/zinc/08/40/58/1128084058.db2.gz LXFYLSXUFZWCFY-HKUYNNGSSA-N 1 3 286.463 3.801 20 0 CHADHO CCC[C@H](CC)[NH2+]C1CCN(C[C@@H]2CC=CCC2)CC1 ZINC001257254301 1128098462 /nfs/dbraw/zinc/09/84/62/1128098462.db2.gz PCYKPBDXFZQGLE-SJORKVTESA-N 1 3 278.484 3.975 20 0 CHADHO CC(C)=C1CC[C@@H](C)C[C@@H]1N[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000924694763 1128110046 /nfs/dbraw/zinc/11/00/46/1128110046.db2.gz GYWFSAALJSSJLU-CBZIJGRNSA-N 1 3 276.468 3.728 20 0 CHADHO CC(C)=C1CC[C@@H](C)C[C@@H]1N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000924694763 1128110049 /nfs/dbraw/zinc/11/00/49/1128110049.db2.gz GYWFSAALJSSJLU-CBZIJGRNSA-N 1 3 276.468 3.728 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NCC[C@@H]2CCCC2(F)F)c2ccccc21 ZINC000925734863 1128138723 /nfs/dbraw/zinc/13/87/23/1128138723.db2.gz BZNAONSPXJUKEQ-NILFDRSVSA-N 1 3 280.362 3.546 20 0 CHADHO CCC[C@@H](C)[NH2+]C1CCN(C[C@H]2CC=CCC2)CC1 ZINC001257314672 1128231874 /nfs/dbraw/zinc/23/18/74/1128231874.db2.gz OJSQUJXYPYGUBS-CVEARBPZSA-N 1 3 264.457 3.585 20 0 CHADHO CCCC[C@H](CCC)[NH2+][C@@H]1CCC[C@H](N(C)C)C1 ZINC000715232742 1128290292 /nfs/dbraw/zinc/29/02/92/1128290292.db2.gz ACJDYXHOCILAMT-XHSDSOJGSA-N 1 3 254.462 3.808 20 0 CHADHO CC(C)CCC[C@H](C)[NH2+][C@@H]1CCC[C@H](N(C)C)C1 ZINC000715232780 1128290467 /nfs/dbraw/zinc/29/04/67/1128290467.db2.gz AIQQNSVLOXTGOO-XHSDSOJGSA-N 1 3 254.462 3.664 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1)C(C)(C)C ZINC000670268947 1128379752 /nfs/dbraw/zinc/37/97/52/1128379752.db2.gz UKUGTSWUCKNPKG-JYJNAYRXSA-N 1 3 280.500 3.911 20 0 CHADHO CC[NH+]1CCC(N[C@H](c2ccc(F)cc2)C(C)(C)C)CC1 ZINC000037119052 1128416365 /nfs/dbraw/zinc/41/63/65/1128416365.db2.gz XZSJHLJMSRMCNN-QGZVFWFLSA-N 1 3 292.442 3.987 20 0 CHADHO COC(C)(C)CCC[C@@H](C)CC[N@H+](C)C[C@H]1CCCNC1 ZINC001235952430 1128410835 /nfs/dbraw/zinc/41/08/35/1128410835.db2.gz XQNZIJOVSYBHRL-SJORKVTESA-N 1 3 298.515 3.539 20 0 CHADHO COC(C)(C)CCC[C@@H](C)CC[N@@H+](C)C[C@H]1CCCNC1 ZINC001235952430 1128410838 /nfs/dbraw/zinc/41/08/38/1128410838.db2.gz XQNZIJOVSYBHRL-SJORKVTESA-N 1 3 298.515 3.539 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@@H](C)c2ccc(CC(C)C)cc2)C1 ZINC000037644108 1128433589 /nfs/dbraw/zinc/43/35/89/1128433589.db2.gz QIKIPVNJQLYJAN-WMZOPIPTSA-N 1 3 288.479 3.878 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@@H](C)c2ccc(CC(C)C)cc2)C1 ZINC000037644108 1128433591 /nfs/dbraw/zinc/43/35/91/1128433591.db2.gz QIKIPVNJQLYJAN-WMZOPIPTSA-N 1 3 288.479 3.878 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2ccc(CC(C)C)cc2)C1 ZINC000037644108 1128433594 /nfs/dbraw/zinc/43/35/94/1128433594.db2.gz QIKIPVNJQLYJAN-WMZOPIPTSA-N 1 3 288.479 3.878 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000037644542 1128433961 /nfs/dbraw/zinc/43/39/61/1128433961.db2.gz IVXJPYJDGXAGGP-SUMWQHHRSA-N 1 3 292.854 3.723 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000037644542 1128433963 /nfs/dbraw/zinc/43/39/63/1128433963.db2.gz IVXJPYJDGXAGGP-SUMWQHHRSA-N 1 3 292.854 3.723 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000037644542 1128433965 /nfs/dbraw/zinc/43/39/65/1128433965.db2.gz IVXJPYJDGXAGGP-SUMWQHHRSA-N 1 3 292.854 3.723 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000037644541 1128434087 /nfs/dbraw/zinc/43/40/87/1128434087.db2.gz IVXJPYJDGXAGGP-CXAGYDPISA-N 1 3 292.854 3.723 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000037644541 1128434090 /nfs/dbraw/zinc/43/40/90/1128434090.db2.gz IVXJPYJDGXAGGP-CXAGYDPISA-N 1 3 292.854 3.723 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000037644541 1128434093 /nfs/dbraw/zinc/43/40/93/1128434093.db2.gz IVXJPYJDGXAGGP-CXAGYDPISA-N 1 3 292.854 3.723 20 0 CHADHO Cc1ccc([C@@H](C)NC[C@@H](C)C[NH+]2CCCC2)c(C)c1 ZINC000062077942 1128436607 /nfs/dbraw/zinc/43/66/07/1128436607.db2.gz JQDRJODACDCIPH-NVXWUHKLSA-N 1 3 274.452 3.686 20 0 CHADHO CN1CCC[C@H]1CC[NH2+]C(C)(C)c1ccc(Cl)cc1 ZINC000556179776 1128560151 /nfs/dbraw/zinc/56/01/51/1128560151.db2.gz OWMIFNIJBOMHOX-HNNXBMFYSA-N 1 3 280.843 3.649 20 0 CHADHO CC[C@H](NCc1ccc(C[NH3+])cc1)c1cccc(F)c1 ZINC000566245869 1128540318 /nfs/dbraw/zinc/54/03/18/1128540318.db2.gz XGWSWZQSPUPJEM-KRWDZBQOSA-N 1 3 272.367 3.525 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H]([N@@H+]2CC[C@@]3(C2)CCCNC3)C1 ZINC000566230378 1128540773 /nfs/dbraw/zinc/54/07/73/1128540773.db2.gz KMJCHXRFFNPZHQ-UFYCRDLUSA-N 1 3 298.474 3.572 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H]([N@H+]2CC[C@@]3(C2)CCCNC3)C1 ZINC000566230378 1128540774 /nfs/dbraw/zinc/54/07/74/1128540774.db2.gz KMJCHXRFFNPZHQ-UFYCRDLUSA-N 1 3 298.474 3.572 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)C1 ZINC000566481468 1128545211 /nfs/dbraw/zinc/54/52/11/1128545211.db2.gz DDEWODXUURBRSY-DVOMOZLQSA-N 1 3 296.817 3.790 20 0 CHADHO CCN1CCC[C@H](C[NH2+][C@@H](C)c2cc3ccccc3o2)C1 ZINC000567718569 1128570137 /nfs/dbraw/zinc/57/01/37/1128570137.db2.gz GYAXLBMSWDYBOV-LSDHHAIUSA-N 1 3 286.419 3.815 20 0 CHADHO C[C@H](CCN1CCCCCC1)[NH+]1CCCCCC1 ZINC000470957586 1128615053 /nfs/dbraw/zinc/61/50/53/1128615053.db2.gz XRILGAGNLIFINC-MRXNPFEDSA-N 1 3 252.446 3.517 20 0 CHADHO C[C@H](CCC(C)(C)C)[NH2+]CCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000556583401 1128605640 /nfs/dbraw/zinc/60/56/40/1128605640.db2.gz IKKFKXACVQGVGK-IKGGRYGDSA-N 1 3 298.515 3.680 20 0 CHADHO C[C@H](N[C@@H](c1cccc(F)c1)C(C)(C)C)[C@@H]1CCC[NH2+]C1 ZINC000515828811 1128684168 /nfs/dbraw/zinc/68/41/68/1128684168.db2.gz YDROVNURPBVTEA-LXZKKBNFSA-N 1 3 292.442 3.891 20 0 CHADHO CCCCCCN1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246836605 1117748567 /nfs/dbraw/zinc/74/85/67/1117748567.db2.gz OKYYRLXRPXQXIA-RDJZCZTQSA-N 1 3 264.457 3.515 20 0 CHADHO CCCCCCN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246836605 1117748573 /nfs/dbraw/zinc/74/85/73/1117748573.db2.gz OKYYRLXRPXQXIA-RDJZCZTQSA-N 1 3 264.457 3.515 20 0 CHADHO Cc1ccc(C[C@@H]([NH2+][C@@H]2CCNC3(CCC3)C2)C2CC2)cc1 ZINC000643548178 1117798980 /nfs/dbraw/zinc/79/89/80/1117798980.db2.gz NMPDKVKYYYRQGF-RTBURBONSA-N 1 3 298.474 3.580 20 0 CHADHO Cc1ccc([C@@H](N[C@@H]2CC[NH2+]C3(CCC3)C2)C2CC2)cc1 ZINC000643549060 1117799994 /nfs/dbraw/zinc/79/99/94/1117799994.db2.gz ZRPHRSYYLZNMEF-QZTJIDSGSA-N 1 3 284.447 3.710 20 0 CHADHO C[C@H]1CC[C@@H](C[NH3+])CN1Cc1cccc(C(C)(C)C)c1 ZINC001206767587 1117819658 /nfs/dbraw/zinc/81/96/58/1117819658.db2.gz CCTPNOYAXJPDSU-HOCLYGCPSA-N 1 3 274.452 3.543 20 0 CHADHO CCCOc1ccc(CNCc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000579087357 1128737684 /nfs/dbraw/zinc/73/76/84/1128737684.db2.gz UVNLEKHLZXVLCD-OAHLLOKOSA-N 1 3 298.430 3.785 20 0 CHADHO CCC[C@@H](N[C@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1 ZINC000623339893 1117837583 /nfs/dbraw/zinc/83/75/83/1117837583.db2.gz OMLBFYYSRKPLRI-DLBZAZTESA-N 1 3 274.452 3.990 20 0 CHADHO CCC[C@@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1 ZINC000623339893 1117837588 /nfs/dbraw/zinc/83/75/88/1117837588.db2.gz OMLBFYYSRKPLRI-DLBZAZTESA-N 1 3 274.452 3.990 20 0 CHADHO CN1CC[C@H]([NH2+]Cc2ccc(C(C)(F)F)cc2)CC1(C)C ZINC000623532353 1117868862 /nfs/dbraw/zinc/86/88/62/1117868862.db2.gz OHSONNSFCZEHAB-HNNXBMFYSA-N 1 3 296.405 3.761 20 0 CHADHO CCCCc1ccc(CN2C[C@H](C[NH3+])CC[C@H]2C)s1 ZINC001206772190 1117871941 /nfs/dbraw/zinc/87/19/41/1117871941.db2.gz ZAOVVUXBIUSOFV-KGLIPLIRSA-N 1 3 280.481 3.650 20 0 CHADHO C[C@H](CCc1ccccc1)C[NH2+]C[C@H]1CCCCN(C)C1 ZINC000623657464 1117883570 /nfs/dbraw/zinc/88/35/70/1117883570.db2.gz RFWLRXFRSMGWEM-IEBWSBKVSA-N 1 3 288.479 3.577 20 0 CHADHO CC(C)Oc1ccc([C@H](C)[NH2+]CC[C@@H]2CCCN2C)cc1 ZINC000179535545 1117907923 /nfs/dbraw/zinc/90/79/23/1117907923.db2.gz YINPIIHMLYDOKZ-RDJZCZTQSA-N 1 3 290.451 3.609 20 0 CHADHO CC(C)Oc1cccc([C@@H](C)[NH2+]CC[C@H]2CCCN2C)c1 ZINC000179683896 1117910095 /nfs/dbraw/zinc/91/00/95/1117910095.db2.gz FZAVAMCPBADCGE-NVXWUHKLSA-N 1 3 290.451 3.609 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccc2c(c1)CCC2 ZINC000624120020 1117983450 /nfs/dbraw/zinc/98/34/50/1117983450.db2.gz PRCUPTUWRHBRQT-CVEARBPZSA-N 1 3 286.463 3.558 20 0 CHADHO CN1CCCC[C@@H](C[NH2+][C@@H]2CCCc3ccc(F)cc32)C1 ZINC000624121831 1117985075 /nfs/dbraw/zinc/98/50/75/1117985075.db2.gz DOZLAFFFIPFFIS-KBXCAEBGSA-N 1 3 290.426 3.525 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)C(C)(C)c1ccccc1 ZINC000624122077 1117985279 /nfs/dbraw/zinc/98/52/79/1117985279.db2.gz JFNKEVITKRHERS-IRXDYDNUSA-N 1 3 288.479 3.674 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1cccc(C2CC2)c1 ZINC000624124160 1117986747 /nfs/dbraw/zinc/98/67/47/1117986747.db2.gz YRKQCLSSAZHREB-CVEARBPZSA-N 1 3 286.463 3.947 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1nccc2ccccc21 ZINC000624123570 1117987172 /nfs/dbraw/zinc/98/71/72/1117987172.db2.gz OGXPHMDXKJZKOF-JKSUJKDBSA-N 1 3 297.446 3.617 20 0 CHADHO CCC[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccsc1 ZINC000624123681 1117987562 /nfs/dbraw/zinc/98/75/62/1117987562.db2.gz QHQKMALCDAODSC-GOEBONIOSA-N 1 3 280.481 3.911 20 0 CHADHO CCC[C@@H](NCC[C@H]1CCC[N@@H+]1C)c1ccccc1 ZINC000181788238 1118007062 /nfs/dbraw/zinc/00/70/62/1118007062.db2.gz FJUFIMFUAAPLOV-IAGOWNOFSA-N 1 3 260.425 3.602 20 0 CHADHO CCC[C@@H](NCC[C@H]1CCC[N@H+]1C)c1ccccc1 ZINC000181788238 1118007067 /nfs/dbraw/zinc/00/70/67/1118007067.db2.gz FJUFIMFUAAPLOV-IAGOWNOFSA-N 1 3 260.425 3.602 20 0 CHADHO CCC[C@@H]([NH2+]CC[C@H]1CCCN1C)c1ccccc1 ZINC000181788238 1118007072 /nfs/dbraw/zinc/00/70/72/1118007072.db2.gz FJUFIMFUAAPLOV-IAGOWNOFSA-N 1 3 260.425 3.602 20 0 CHADHO CC(C)[C@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccc(F)c(F)c1 ZINC000182073291 1118013117 /nfs/dbraw/zinc/01/31/17/1118013117.db2.gz QUJXBOKCFNIFSO-GUYCJALGSA-N 1 3 296.405 3.593 20 0 CHADHO CC(C)[C@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccc(F)c(F)c1 ZINC000182073291 1118013121 /nfs/dbraw/zinc/01/31/21/1118013121.db2.gz QUJXBOKCFNIFSO-GUYCJALGSA-N 1 3 296.405 3.593 20 0 CHADHO C[NH+]1CCC([C@@H]2CCN(Cc3ccsc3Cl)C2)CC1 ZINC000349149152 1118089049 /nfs/dbraw/zinc/08/90/49/1118089049.db2.gz LFQLLXCNQNKMMP-CYBMUJFWSA-N 1 3 298.883 3.565 20 0 CHADHO C[C@@H]1CN(CCCC[NH2+]C2CCCCCCC2)C[C@H](C)O1 ZINC000765404331 1118149104 /nfs/dbraw/zinc/14/91/04/1118149104.db2.gz CTUKYWSCQJZOHN-CALCHBBNSA-N 1 3 296.499 3.578 20 0 CHADHO COc1ccc2c(c1)nccc2NC1CC[NH+](C(C)C)CC1 ZINC000765456662 1118153100 /nfs/dbraw/zinc/15/31/00/1118153100.db2.gz UGEJPHZHQAXPDL-UHFFFAOYSA-N 1 3 299.418 3.528 20 0 CHADHO C[C@H](C[NH2+][C@H]1CC(C)(C)C[C@@H]1C)CN1CCCCC1 ZINC000235481546 1118158613 /nfs/dbraw/zinc/15/86/13/1118158613.db2.gz CIVFHUQMZLDJGZ-PMPSAXMXSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@@H]1CC[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)CS1 ZINC000655718330 1118193242 /nfs/dbraw/zinc/19/32/42/1118193242.db2.gz JKIUEZPRWGBBKT-GDBMZVCRSA-N 1 3 296.524 3.657 20 0 CHADHO C[C@H](CCN1CCCC2(CC2)C1)[N@@H+]1CCCC2(CC2)C1 ZINC000352279511 1118341807 /nfs/dbraw/zinc/34/18/07/1118341807.db2.gz JXGLJXSFBBRIDB-MRXNPFEDSA-N 1 3 276.468 3.517 20 0 CHADHO C[C@H](CCN1CCCC2(CC2)C1)[N@H+]1CCCC2(CC2)C1 ZINC000352279511 1118341813 /nfs/dbraw/zinc/34/18/13/1118341813.db2.gz JXGLJXSFBBRIDB-MRXNPFEDSA-N 1 3 276.468 3.517 20 0 CHADHO C[C@H](CC[N@@H+]1CCCC2(CC2)C1)N1CCCC2(CC2)C1 ZINC000352279511 1118341816 /nfs/dbraw/zinc/34/18/16/1118341816.db2.gz JXGLJXSFBBRIDB-MRXNPFEDSA-N 1 3 276.468 3.517 20 0 CHADHO C[C@H](CC[N@H+]1CCCC2(CC2)C1)N1CCCC2(CC2)C1 ZINC000352279511 1118341819 /nfs/dbraw/zinc/34/18/19/1118341819.db2.gz JXGLJXSFBBRIDB-MRXNPFEDSA-N 1 3 276.468 3.517 20 0 CHADHO Cc1ccc(CC[NH2+]C2CCN(C3CCCC3)CC2)cc1 ZINC000090015219 1118600592 /nfs/dbraw/zinc/60/05/92/1118600592.db2.gz SHXASSKEDQWAHH-UHFFFAOYSA-N 1 3 286.463 3.534 20 0 CHADHO C[C@@H](N[C@@H](C)c1c(F)cccc1Cl)C1CC[NH+](C)CC1 ZINC000090180458 1118623231 /nfs/dbraw/zinc/62/32/31/1118623231.db2.gz JEVFBZXAFWFQSY-NEPJUHHUSA-N 1 3 298.833 3.860 20 0 CHADHO C[NH2+]C[C@H]1CCCN(CCCc2cccc3ccccc32)C1 ZINC000430669652 1118722283 /nfs/dbraw/zinc/72/22/83/1118722283.db2.gz UFYRZQVMCWBDAM-QGZVFWFLSA-N 1 3 296.458 3.704 20 0 CHADHO C[C@H]([NH2+]CC1=CCCC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000401090821 1118778895 /nfs/dbraw/zinc/77/88/95/1118778895.db2.gz VLRPRKUJBQPAAI-QFBILLFUSA-N 1 3 284.447 3.597 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+][C@@H]2CCC[C@@H]2CCCF)C1 ZINC000510752891 1118806895 /nfs/dbraw/zinc/80/68/95/1118806895.db2.gz OCHDAKLUSZLKDA-KZNAEPCWSA-N 1 3 298.490 3.862 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+][C@H]2CCC[C@H]2CCCF)C1 ZINC000510752892 1118807206 /nfs/dbraw/zinc/80/72/06/1118807206.db2.gz OCHDAKLUSZLKDA-SQNIBIBYSA-N 1 3 298.490 3.862 20 0 CHADHO CC(C)C[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCN(C(C)C)C2)C1 ZINC000300328641 1119273518 /nfs/dbraw/zinc/27/35/18/1119273518.db2.gz PDTVREQOONSWSO-KSZLIROESA-N 1 3 280.500 3.911 20 0 CHADHO CCc1ccc(CN[C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)s1 ZINC000261630301 1119347932 /nfs/dbraw/zinc/34/79/32/1119347932.db2.gz BHEXUCJLOHMOMP-GVDBMIGSSA-N 1 3 292.492 3.711 20 0 CHADHO CC[C@@H](NCc1ccc(C[NH3+])cc1F)c1ccccc1 ZINC000650752569 1119408858 /nfs/dbraw/zinc/40/88/58/1119408858.db2.gz UHQTYPWZHOQCGL-QGZVFWFLSA-N 1 3 272.367 3.525 20 0 CHADHO C[C@@H]1CC([N@@H+]2CCC[C@@H]2C2CCCCC2)C[C@@H](C)N1 ZINC000708386411 1119423905 /nfs/dbraw/zinc/42/39/05/1119423905.db2.gz MIINRQHBYMWJFW-CKEIUWERSA-N 1 3 264.457 3.560 20 0 CHADHO C[C@@H]1CC([N@H+]2CCC[C@@H]2C2CCCCC2)C[C@@H](C)N1 ZINC000708386411 1119423906 /nfs/dbraw/zinc/42/39/06/1119423906.db2.gz MIINRQHBYMWJFW-CKEIUWERSA-N 1 3 264.457 3.560 20 0 CHADHO C[C@@H](CN[C@H](CC1CC1)c1ccccc1)C[NH+]1CCCC1 ZINC000566772588 1119433291 /nfs/dbraw/zinc/43/32/91/1119433291.db2.gz OQOSQFKUPZQLNB-QFBILLFUSA-N 1 3 286.463 3.849 20 0 CHADHO C[C@H]([NH2+]C1CCN(C2CCCCC2)CC1)C1CCCC1 ZINC000168456692 1119446154 /nfs/dbraw/zinc/44/61/54/1119446154.db2.gz AJFOATSDLAVINZ-HNNXBMFYSA-N 1 3 278.484 3.952 20 0 CHADHO c1cc(CNCc2ccc(C[NH+]3CCCCCC3)cc2)c[nH]1 ZINC000086252238 1119533888 /nfs/dbraw/zinc/53/38/88/1119533888.db2.gz QOWIZLPKRGBMCI-UHFFFAOYSA-N 1 3 297.446 3.681 20 0 CHADHO CC(C)[C@@H](NCc1ccc(C[NH+](C)C)cc1)c1cccnc1 ZINC000091266010 1119554934 /nfs/dbraw/zinc/55/49/34/1119554934.db2.gz SMFGPZFACRGGME-LJQANCHMSA-N 1 3 297.446 3.630 20 0 CHADHO CC(C)CCC[C@@H](C)[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000685455215 1119610582 /nfs/dbraw/zinc/61/05/82/1119610582.db2.gz KXMFLCVIAMZXSL-CVEARBPZSA-N 1 3 254.462 3.521 20 0 CHADHO CC(C)C[C@H](C)C[C@@H](C)[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000685455659 1119610864 /nfs/dbraw/zinc/61/08/64/1119610864.db2.gz DYEPLTZXKGRUAL-GVDBMIGSSA-N 1 3 268.489 3.767 20 0 CHADHO CCCCN1CCC([NH2+][C@@H](C)c2csc(C)c2)CC1 ZINC000394481436 1119758627 /nfs/dbraw/zinc/75/86/27/1119758627.db2.gz LMADASBNOCXCCD-AWEZNQCLSA-N 1 3 280.481 3.972 20 0 CHADHO C[C@H]1C[C@H]([NH2+]C[C@@H]2CCCCN(C)C2)CC(C)(C)C1 ZINC000708787060 1119845023 /nfs/dbraw/zinc/84/50/23/1119845023.db2.gz FMYWRDVMSYNCKW-JYJNAYRXSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@@H](CN1CC[C@H](C[NH+]2CCCCC2)C1)c1ccccc1 ZINC000173867860 1119917206 /nfs/dbraw/zinc/91/72/06/1119917206.db2.gz DVKPGHKEZDFGLP-ZWKOTPCHSA-N 1 3 286.463 3.598 20 0 CHADHO C[C@@H](C[N@@H+]1CC[C@H](CN2CCCCC2)C1)c1ccccc1 ZINC000173867860 1119917207 /nfs/dbraw/zinc/91/72/07/1119917207.db2.gz DVKPGHKEZDFGLP-ZWKOTPCHSA-N 1 3 286.463 3.598 20 0 CHADHO C[C@@H](C[N@H+]1CC[C@H](CN2CCCCC2)C1)c1ccccc1 ZINC000173867860 1119917210 /nfs/dbraw/zinc/91/72/10/1119917210.db2.gz DVKPGHKEZDFGLP-ZWKOTPCHSA-N 1 3 286.463 3.598 20 0 CHADHO C[C@H](NCc1ccc(C[NH+](C)C)cc1)c1cccc(F)c1 ZINC000171126284 1119930500 /nfs/dbraw/zinc/93/05/00/1119930500.db2.gz DEVLLNVNJPPJRA-AWEZNQCLSA-N 1 3 286.394 3.738 20 0 CHADHO C[C@@H]1C[N@H+](CC[C@@H]2CCCCN2C)[C@H]1c1ccccc1 ZINC000472590612 1119989474 /nfs/dbraw/zinc/98/94/74/1119989474.db2.gz GTRYHWVICPDSGD-BPQIPLTHSA-N 1 3 272.436 3.554 20 0 CHADHO C[C@@H]1C[N@@H+](CC[C@@H]2CCCCN2C)[C@H]1c1ccccc1 ZINC000472590612 1119989477 /nfs/dbraw/zinc/98/94/77/1119989477.db2.gz GTRYHWVICPDSGD-BPQIPLTHSA-N 1 3 272.436 3.554 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccc(Cl)cc1 ZINC000623657061 1120065617 /nfs/dbraw/zinc/06/56/17/1120065617.db2.gz IZWVFUJEYCZIKE-UONOGXRCSA-N 1 3 280.843 3.723 20 0 CHADHO CC(C)CCC[C@H](C)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000624120782 1120066502 /nfs/dbraw/zinc/06/65/02/1120066502.db2.gz GWJCFKLOZJORDE-JKSUJKDBSA-N 1 3 254.462 3.523 20 0 CHADHO CC(C)CC(CC(C)C)[NH2+][C@H]1CCC[C@@H](N(C)C)C1 ZINC000715543403 1120109782 /nfs/dbraw/zinc/10/97/82/1120109782.db2.gz NEQLVWYUUWIMBT-DOTOQJQBSA-N 1 3 268.489 3.910 20 0 CHADHO CC(C)CC(CC(C)C)[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000715543404 1120109787 /nfs/dbraw/zinc/10/97/87/1120109787.db2.gz NEQLVWYUUWIMBT-NVXWUHKLSA-N 1 3 268.489 3.910 20 0 CHADHO C[NH+](C)CCC1CCN(Cc2cccc(Cl)c2)CC1 ZINC000056524102 1120128519 /nfs/dbraw/zinc/12/85/19/1120128519.db2.gz ZGRAGGBBPJCDIK-UHFFFAOYSA-N 1 3 280.843 3.504 20 0 CHADHO CC[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000181745908 1120143370 /nfs/dbraw/zinc/14/33/70/1120143370.db2.gz UVGBAIVMBMYQEI-GVDBMIGSSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@@H]([NH3+])[C@H]1CCCN(Cc2ccc(C(C)(C)C)cc2)C1 ZINC000111695826 1120155150 /nfs/dbraw/zinc/15/51/50/1120155150.db2.gz NSHSDCRZGYIKTE-ZBFHGGJFSA-N 1 3 274.452 3.543 20 0 CHADHO C[C@@H](c1ccc(F)cc1)[N@H+](C)CC[C@H]1CCCCN1C ZINC000472763747 1120164661 /nfs/dbraw/zinc/16/46/61/1120164661.db2.gz NIBZMXJGWWIEQP-WMLDXEAASA-N 1 3 278.415 3.693 20 0 CHADHO C[C@@H](c1ccc(F)cc1)[N@@H+](C)CC[C@H]1CCCCN1C ZINC000472763747 1120164663 /nfs/dbraw/zinc/16/46/63/1120164663.db2.gz NIBZMXJGWWIEQP-WMLDXEAASA-N 1 3 278.415 3.693 20 0 CHADHO C[N@@H+]1CCCC[C@H]1CCN1CCC(c2ccccc2)CC1 ZINC000472773650 1120170840 /nfs/dbraw/zinc/17/08/40/1120170840.db2.gz OOQABIVGOGKFLY-IBGZPJMESA-N 1 3 286.463 3.740 20 0 CHADHO C[N@H+]1CCCC[C@H]1CCN1CCC(c2ccccc2)CC1 ZINC000472773650 1120170842 /nfs/dbraw/zinc/17/08/42/1120170842.db2.gz OOQABIVGOGKFLY-IBGZPJMESA-N 1 3 286.463 3.740 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H](C)[C@H]2CC3CCC2CC3)C1 ZINC000394428744 1120219076 /nfs/dbraw/zinc/21/90/76/1120219076.db2.gz AUOIFVURPWVKFV-MEEPFQLTSA-N 1 3 278.484 3.521 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](N[C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000629550435 1128914974 /nfs/dbraw/zinc/91/49/74/1128914974.db2.gz YKNNWWRISCUIDQ-FMKPAKJESA-N 1 3 278.827 3.577 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](N[C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000629550437 1128915038 /nfs/dbraw/zinc/91/50/38/1128915038.db2.gz YKNNWWRISCUIDQ-YCPHGPKFSA-N 1 3 278.827 3.577 20 0 CHADHO [NH3+][C@H]1CCC[C@@H](N[C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC000629556770 1128915515 /nfs/dbraw/zinc/91/55/15/1128915515.db2.gz YKNNWWRISCUIDQ-SQWLQELKSA-N 1 3 278.827 3.577 20 0 CHADHO C[C@@H]([NH2+]CCCC1CCC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000660255337 1120467836 /nfs/dbraw/zinc/46/78/36/1120467836.db2.gz BIKHNUHUVDQPIM-NVXWUHKLSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1)[C@@H]1CCCN(C2CCC2)C1 ZINC000660256034 1120468830 /nfs/dbraw/zinc/46/88/30/1120468830.db2.gz IDOMVLYDEVXEOO-TZNCUMHOSA-N 1 3 290.495 3.665 20 0 CHADHO Cc1occc1C[NH2+]C[C@]1(C)CCN(Cc2ccccc2)C1 ZINC000320917885 1120519156 /nfs/dbraw/zinc/51/91/56/1120519156.db2.gz JXNYQLHDZKECMT-IBGZPJMESA-N 1 3 298.430 3.590 20 0 CHADHO CC(C)N(C)CCC[NH2+]C1CC(C)(C)CC(C)(C)C1 ZINC000226333577 1120578523 /nfs/dbraw/zinc/57/85/23/1120578523.db2.gz CIKUQFYMGUTUBD-UHFFFAOYSA-N 1 3 268.489 3.911 20 0 CHADHO CN(C)[C@@H]1CCC[N@H+](CC[C@H]2CCc3ccccc32)CC1 ZINC000660416643 1120590013 /nfs/dbraw/zinc/59/00/13/1120590013.db2.gz VEYCAQBLNUBJAH-QZTJIDSGSA-N 1 3 286.463 3.523 20 0 CHADHO CN(C)[C@@H]1CCC[N@@H+](CC[C@H]2CCc3ccccc32)CC1 ZINC000660416643 1120590016 /nfs/dbraw/zinc/59/00/16/1120590016.db2.gz VEYCAQBLNUBJAH-QZTJIDSGSA-N 1 3 286.463 3.523 20 0 CHADHO CC1=CC[C@H](CC[N@@H+]2CC[C@@]3(C2)CCCCN3)C1(C)C ZINC001222421118 1120595255 /nfs/dbraw/zinc/59/52/55/1120595255.db2.gz IOLSTFLSWHAFFY-SJLPKXTDSA-N 1 3 276.468 3.587 20 0 CHADHO CC1=CC[C@H](CC[N@H+]2CC[C@@]3(C2)CCCCN3)C1(C)C ZINC001222421118 1120595258 /nfs/dbraw/zinc/59/52/58/1120595258.db2.gz IOLSTFLSWHAFFY-SJLPKXTDSA-N 1 3 276.468 3.587 20 0 CHADHO CC(C)c1ccc([C@@H](C)N2CC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC000257709775 1120742691 /nfs/dbraw/zinc/74/26/91/1120742691.db2.gz NMFDGRWHHCXPOB-CRAIPNDOSA-N 1 3 272.436 3.556 20 0 CHADHO CC[C@H](C)[NH2+][C@@H](C)c1ccc(OC)c(CN(CC)CC)c1 ZINC000182193432 1128940635 /nfs/dbraw/zinc/94/06/35/1128940635.db2.gz GWMVFHLMYYBKJG-GJZGRUSLSA-N 1 3 292.467 3.986 20 0 CHADHO C[C@@H]1CCCC[C@H]1N1CCC([NH2+]C2(C3CCC3)CC2)CC1 ZINC000652272284 1120806245 /nfs/dbraw/zinc/80/62/45/1120806245.db2.gz GYYCOBDSHNCUJW-CRAIPNDOSA-N 1 3 290.495 3.952 20 0 CHADHO C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663344067 1120940777 /nfs/dbraw/zinc/94/07/77/1120940777.db2.gz NIYAYHBXDBUDFM-OIISXLGYSA-N 1 3 278.484 3.523 20 0 CHADHO C([NH2+][C@@H](C1CC1)C1CCCC1)[C@@H]1CCCN(CC2CC2)C1 ZINC000663464998 1120979559 /nfs/dbraw/zinc/97/95/59/1120979559.db2.gz HWILUSWABPLYKU-QFBILLFUSA-N 1 3 290.495 3.667 20 0 CHADHO C([NH2+]C(C1CCC1)C1CCC1)[C@H]1CCCN(CC2CC2)C1 ZINC000663466237 1120980951 /nfs/dbraw/zinc/98/09/51/1120980951.db2.gz PVPLIUZADSFQNB-MRXNPFEDSA-N 1 3 290.495 3.667 20 0 CHADHO CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663464145 1120981049 /nfs/dbraw/zinc/98/10/49/1120981049.db2.gz COWVDGNIRSDRPD-GVDBMIGSSA-N 1 3 278.484 3.523 20 0 CHADHO C([NH2+][C@H]1CCCC12CCCC2)[C@H]1CCCN(CC2CC2)C1 ZINC000663465863 1120981063 /nfs/dbraw/zinc/98/10/63/1120981063.db2.gz LZOXZLRPPWCMRC-MSOLQXFVSA-N 1 3 290.495 3.811 20 0 CHADHO C[C@H](CC1CCCC1)[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663470221 1120984988 /nfs/dbraw/zinc/98/49/88/1120984988.db2.gz TTXJHVYICVPVLQ-CRAIPNDOSA-N 1 3 278.484 3.667 20 0 CHADHO CC(C)[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663469594 1120985076 /nfs/dbraw/zinc/98/50/76/1120985076.db2.gz QWWQMVKWKKGAAA-BZSNNMDCSA-N 1 3 278.484 3.523 20 0 CHADHO CCC[C@H](N[C@H]1CCC[NH2+]CC1)c1ccc(Cl)cc1 ZINC000643467038 1120996639 /nfs/dbraw/zinc/99/66/39/1120996639.db2.gz QCUWROCOGDXYPY-HOTGVXAUSA-N 1 3 280.843 3.913 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]C[C@H]1CCCCN1 ZINC000643502893 1121002120 /nfs/dbraw/zinc/00/21/20/1121002120.db2.gz UPUUHESNMOZFKX-RDTXWAMCSA-N 1 3 297.446 3.585 20 0 CHADHO C[C@@H](N[C@H]1CC12CC[NH2+]CC2)c1ccc(Cl)cc1Cl ZINC000643533897 1121009884 /nfs/dbraw/zinc/00/98/84/1121009884.db2.gz HOYFMNWFNFGSSJ-YGRLFVJLSA-N 1 3 299.245 3.786 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]CCCN2CCC(C)CC2)cc1 ZINC000021009086 1121141911 /nfs/dbraw/zinc/14/19/11/1121141911.db2.gz MQUAOLBTPGCENN-QGZVFWFLSA-N 1 3 274.452 3.768 20 0 CHADHO c1ccc(C[N@@H+]2CC[C@]3(CCN([C@H]4C=CCCC4)C3)C2)cc1 ZINC000512245950 1121224413 /nfs/dbraw/zinc/22/44/13/1121224413.db2.gz UDSZPGWSHSKQRB-PMACEKPBSA-N 1 3 296.458 3.693 20 0 CHADHO c1ccc(C[N@H+]2CC[C@]3(CCN([C@H]4C=CCCC4)C3)C2)cc1 ZINC000512245950 1121224416 /nfs/dbraw/zinc/22/44/16/1121224416.db2.gz UDSZPGWSHSKQRB-PMACEKPBSA-N 1 3 296.458 3.693 20 0 CHADHO CC(C)CCN1CCC([NH2+]CC2CCC=CCC2)CC1 ZINC001207639482 1121228488 /nfs/dbraw/zinc/22/84/88/1121228488.db2.gz QVSSUODIRPQUKM-UHFFFAOYSA-N 1 3 278.484 3.833 20 0 CHADHO CCN(CC)CCC[NH2+][C@H](C)[C@H](C)c1ccccc1 ZINC000675724896 1121347542 /nfs/dbraw/zinc/34/75/42/1121347542.db2.gz PDPABNOMOQPHOV-JKSUJKDBSA-N 1 3 262.441 3.500 20 0 CHADHO CCC[NH+]1CCC(CN[C@H](C)c2nc(C)sc2C)CC1 ZINC000676489833 1121439369 /nfs/dbraw/zinc/43/93/69/1121439369.db2.gz LPDSXBSFVHAPOF-GFCCVEGCSA-N 1 3 295.496 3.533 20 0 CHADHO C[C@@H]1CCC[C@@H]([NH+]2CCC(N[C@H]3CC34CCCC4)CC2)C1 ZINC000429425728 1121576487 /nfs/dbraw/zinc/57/64/87/1121576487.db2.gz LRRIZCCKVPJBNZ-NXHRZFHOSA-N 1 3 290.495 3.952 20 0 CHADHO C[C@@H]1CCC[C@H]([NH+]2CCC(N[C@H]3CC34CCCC4)CC2)C1 ZINC000429425726 1121576782 /nfs/dbraw/zinc/57/67/82/1121576782.db2.gz LRRIZCCKVPJBNZ-NJAFHUGGSA-N 1 3 290.495 3.952 20 0 CHADHO CCN(Cc1ccc(C[NH+](C)C)cc1)[C@H](C)c1ccncc1 ZINC000626062173 1121593392 /nfs/dbraw/zinc/59/33/92/1121593392.db2.gz KDRPGZKJJURMRQ-MRXNPFEDSA-N 1 3 297.446 3.726 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@@H]2[N@H+](C)C[C@H]2CCCNC2)cc1 ZINC000261747655 1121690899 /nfs/dbraw/zinc/69/08/99/1121690899.db2.gz BZWODTKXUVYZDN-WDSOQIARSA-N 1 3 286.463 3.563 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@@H]2[N@@H+](C)C[C@H]2CCCNC2)cc1 ZINC000261747655 1121690901 /nfs/dbraw/zinc/69/09/01/1121690901.db2.gz BZWODTKXUVYZDN-WDSOQIARSA-N 1 3 286.463 3.563 20 0 CHADHO CCSCC[C@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000152788094 1129003184 /nfs/dbraw/zinc/00/31/84/1129003184.db2.gz LARFWDNCXOPIFZ-HNNXBMFYSA-N 1 3 298.540 3.905 20 0 CHADHO Cc1cc(C)c(/C=C/CNC2CC[NH+](C3CC3)CC2)cc1C ZINC001177161909 1121716103 /nfs/dbraw/zinc/71/61/03/1121716103.db2.gz GWMDLCYCEJODLB-SNAWJCMRSA-N 1 3 298.474 3.841 20 0 CHADHO Cc1cc(CN2CCC[C@](C)(C[NH3+])CC2)c(F)cc1Cl ZINC001206326948 1121782159 /nfs/dbraw/zinc/78/21/59/1121782159.db2.gz RAUUDRMDYJGPNR-INIZCTEOSA-N 1 3 298.833 3.738 20 0 CHADHO C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC001179592846 1121892164 /nfs/dbraw/zinc/89/21/64/1121892164.db2.gz IXEVKNMEGPYSTJ-LTDCPUDJSA-N 1 3 290.495 3.665 20 0 CHADHO C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC001179592847 1121893088 /nfs/dbraw/zinc/89/30/88/1121893088.db2.gz IXEVKNMEGPYSTJ-LVFSCSRESA-N 1 3 290.495 3.665 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2ccc(C3CC3)cc2)[C@@H](C)C1 ZINC001179906658 1121929095 /nfs/dbraw/zinc/92/90/95/1121929095.db2.gz ZLGOKHIDONMNLM-KXBFYZLASA-N 1 3 286.463 3.726 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2ccc(C3CC3)cc2)[C@@H](C)C1 ZINC001179906658 1121929098 /nfs/dbraw/zinc/92/90/98/1121929098.db2.gz ZLGOKHIDONMNLM-KXBFYZLASA-N 1 3 286.463 3.726 20 0 CHADHO CN1CCCC[C@@H]1CC[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420946058 1122048455 /nfs/dbraw/zinc/04/84/55/1122048455.db2.gz LMQIXPMOMHTETJ-ZIAGYGMSSA-N 1 3 292.389 3.525 20 0 CHADHO CN1CCCC[C@@H]1CC[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420946058 1122048462 /nfs/dbraw/zinc/04/84/62/1122048462.db2.gz LMQIXPMOMHTETJ-ZIAGYGMSSA-N 1 3 292.389 3.525 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]C2CC3(C2)CCCCC3)C1 ZINC000421322067 1122092775 /nfs/dbraw/zinc/09/27/75/1122092775.db2.gz FODICIGADVRNFH-INIZCTEOSA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)[C@@H](NCC[C@@H]1CCC[N@@H+]1C)c1ccc(F)cc1 ZINC000502536436 1122101332 /nfs/dbraw/zinc/10/13/32/1122101332.db2.gz WPGNRACAIXHVBO-DLBZAZTESA-N 1 3 278.415 3.597 20 0 CHADHO CC(C)[C@@H](NCC[C@@H]1CCC[N@H+]1C)c1ccc(F)cc1 ZINC000502536436 1122101335 /nfs/dbraw/zinc/10/13/35/1122101335.db2.gz WPGNRACAIXHVBO-DLBZAZTESA-N 1 3 278.415 3.597 20 0 CHADHO CC(C)[C@@H]([NH2+]CC[C@@H]1CCCN1C)c1ccc(F)cc1 ZINC000502536436 1122101338 /nfs/dbraw/zinc/10/13/38/1122101338.db2.gz WPGNRACAIXHVBO-DLBZAZTESA-N 1 3 278.415 3.597 20 0 CHADHO CC[NH+]1CCC(N[C@H](c2ccc(F)c(C)c2)C2CC2)CC1 ZINC000271908418 1122182782 /nfs/dbraw/zinc/18/27/82/1122182782.db2.gz ZROYOZONGMYJFH-SFHVURJKSA-N 1 3 290.426 3.659 20 0 CHADHO CC[NH+]1CCC(N[C@@H](c2ccc(F)c(C)c2)C2CC2)CC1 ZINC000271908416 1122182956 /nfs/dbraw/zinc/18/29/56/1122182956.db2.gz ZROYOZONGMYJFH-GOSISDBHSA-N 1 3 290.426 3.659 20 0 CHADHO CCC[C@@H](Cc1ccccc1)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC001182903019 1122194882 /nfs/dbraw/zinc/19/48/82/1122194882.db2.gz VRFKTEINQBLWCH-OALUTQOASA-N 1 3 288.479 3.719 20 0 CHADHO CCCCc1ccc(CN2CCC[C@@](C)([NH3+])CC2)s1 ZINC001205264280 1122215888 /nfs/dbraw/zinc/21/58/88/1122215888.db2.gz IUPSKWNORXIVIK-MRXNPFEDSA-N 1 3 280.481 3.794 20 0 CHADHO CC(C)(C)Oc1ccc(CN2CCC[C@@](C)([NH3+])CC2)cc1 ZINC001205281295 1122239334 /nfs/dbraw/zinc/23/93/34/1122239334.db2.gz RUXXUYWJFJGHLC-GOSISDBHSA-N 1 3 290.451 3.567 20 0 CHADHO CCN(CC)Cc1cc([C@H](C)[NH2+]CCCF)ccc1OC ZINC000183350132 1129047187 /nfs/dbraw/zinc/04/71/87/1129047187.db2.gz MOFVXKXBXHCGGC-AWEZNQCLSA-N 1 3 296.430 3.547 20 0 CHADHO FC1(F)CCC([NH2+]C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001167958969 1122464402 /nfs/dbraw/zinc/46/44/02/1122464402.db2.gz LIHWWGUYMMLNEK-MQVJKMGUSA-N 1 3 298.421 3.559 20 0 CHADHO CSc1ccc(C[NH2+]CC2(CN(C)C)CCCC2)s1 ZINC000515479581 1122501984 /nfs/dbraw/zinc/50/19/84/1122501984.db2.gz WYHLFTQPJHHLHU-UHFFFAOYSA-N 1 3 298.521 3.682 20 0 CHADHO CC[C@H](C)[C@@H](C)[N@@H+]1CCC[C@H](CN2CCC(C)CC2)C1 ZINC001190652317 1122549949 /nfs/dbraw/zinc/54/99/49/1122549949.db2.gz ZOHACQNJSADUPV-RCCFBDPRSA-N 1 3 280.500 3.865 20 0 CHADHO CC[C@H](C)[C@@H](C)[N@H+]1CCC[C@H](CN2CCC(C)CC2)C1 ZINC001190652317 1122549951 /nfs/dbraw/zinc/54/99/51/1122549951.db2.gz ZOHACQNJSADUPV-RCCFBDPRSA-N 1 3 280.500 3.865 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](CCC(C)C)C2CC2)C1 ZINC000517042773 1122643236 /nfs/dbraw/zinc/64/32/36/1122643236.db2.gz ADVJPZKPNVNIMB-NVXWUHKLSA-N 1 3 266.473 3.523 20 0 CHADHO Cc1cc2c(cc1C)[C@H]([NH2+]C[C@H](C)CN(C)C)CCS2 ZINC000425913627 1122658511 /nfs/dbraw/zinc/65/85/11/1122658511.db2.gz AGVXCDXHUWZQNI-BLLLJJGKSA-N 1 3 292.492 3.628 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCC[C@H]1c1ccccc1Cl)CN(C)C ZINC000425939317 1122670440 /nfs/dbraw/zinc/67/04/40/1122670440.db2.gz ZRNMTEMMPBUUHL-KMFMINBZSA-N 1 3 294.870 3.763 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H]1CCC[C@H]1CCC(C)C ZINC001193495401 1122693389 /nfs/dbraw/zinc/69/33/89/1122693389.db2.gz AZPLDLXUPVQERE-DLBZAZTESA-N 1 3 268.489 3.913 20 0 CHADHO Cc1cc(C)c(CN(C)C2CC[NH+](C(C)C)CC2)cc1C ZINC000506370750 1122725191 /nfs/dbraw/zinc/72/51/91/1122725191.db2.gz SGZSRUWIYCQNBA-UHFFFAOYSA-N 1 3 288.479 3.916 20 0 CHADHO CC[C@H](C)[C@@H](C)N1CCC(CC)([NH+]2CCCC2)CC1 ZINC001196728076 1122930716 /nfs/dbraw/zinc/93/07/16/1122930716.db2.gz UBUGRNAUCASTQS-JKSUJKDBSA-N 1 3 266.473 3.761 20 0 CHADHO C[C@H](C[NH2+]C[C@H](C)CN1CCCC1)CC1CCCCC1 ZINC001199403580 1123029676 /nfs/dbraw/zinc/02/96/76/1123029676.db2.gz VYWVHKRHBGWJHG-IRXDYDNUSA-N 1 3 280.500 3.914 20 0 CHADHO C(C1CCCCC1)N1CCC([NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000839190502 1123044750 /nfs/dbraw/zinc/04/47/50/1123044750.db2.gz GWWLDQLYRYCSLK-NZSAHSFTSA-N 1 3 290.495 3.809 20 0 CHADHO CC/C=C\CCCCC[N@@H+]1CCC[C@@H](CN)[C@H]1C ZINC001205901692 1123060487 /nfs/dbraw/zinc/06/04/87/1123060487.db2.gz FDVBPJFTJWYEEN-MSNYOWOLSA-N 1 3 252.446 3.572 20 0 CHADHO CC/C=C\CCCCC[N@H+]1CCC[C@@H](CN)[C@H]1C ZINC001205901692 1123060493 /nfs/dbraw/zinc/06/04/93/1123060493.db2.gz FDVBPJFTJWYEEN-MSNYOWOLSA-N 1 3 252.446 3.572 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CCC[C@H](CN)[C@H]1C ZINC001205902002 1123060557 /nfs/dbraw/zinc/06/05/57/1123060557.db2.gz GUTUPTJRPZWDIZ-GVDBMIGSSA-N 1 3 266.473 3.818 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CCC[C@H](CN)[C@H]1C ZINC001205902002 1123060562 /nfs/dbraw/zinc/06/05/62/1123060562.db2.gz GUTUPTJRPZWDIZ-GVDBMIGSSA-N 1 3 266.473 3.818 20 0 CHADHO C[NH+](C)Cc1cccc(Nc2ccnc(C3CC3)c2)c1 ZINC001201396752 1123091471 /nfs/dbraw/zinc/09/14/71/1123091471.db2.gz XEBDMMSUDXAQPY-UHFFFAOYSA-N 1 3 267.376 3.764 20 0 CHADHO C1=CC[C@H](C[N@H+]2CCCC[C@H]2CCN2CCCC2)CC1 ZINC001201418797 1123098074 /nfs/dbraw/zinc/09/80/74/1123098074.db2.gz SERFPZQKIGPJJT-ROUUACIJSA-N 1 3 276.468 3.683 20 0 CHADHO C1=CC[C@H](C[N@@H+]2CCCC[C@H]2CCN2CCCC2)CC1 ZINC001201418797 1123098079 /nfs/dbraw/zinc/09/80/79/1123098079.db2.gz SERFPZQKIGPJJT-ROUUACIJSA-N 1 3 276.468 3.683 20 0 CHADHO CCC[C@@H](C)C[N@@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001201550296 1123117892 /nfs/dbraw/zinc/11/78/92/1123117892.db2.gz IEXKBTYYXHEHEA-SJORKVTESA-N 1 3 266.473 3.763 20 0 CHADHO CCC[C@@H](C)C[N@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001201550296 1123117895 /nfs/dbraw/zinc/11/78/95/1123117895.db2.gz IEXKBTYYXHEHEA-SJORKVTESA-N 1 3 266.473 3.763 20 0 CHADHO CC(C)C[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC001201616967 1123131495 /nfs/dbraw/zinc/13/14/95/1123131495.db2.gz DOUVRKORLQYXQN-CEXWTWQISA-N 1 3 286.463 3.533 20 0 CHADHO C[N@H+](CC1CCCC1)C1CCN(C2CCCCC2)CC1 ZINC001202189673 1123184452 /nfs/dbraw/zinc/18/44/52/1123184452.db2.gz GKDNJBNCLVBMLZ-UHFFFAOYSA-N 1 3 278.484 3.906 20 0 CHADHO C[N@@H+](CC1CCCC1)C1CCN(C2CCCCC2)CC1 ZINC001202189673 1123184453 /nfs/dbraw/zinc/18/44/53/1123184453.db2.gz GKDNJBNCLVBMLZ-UHFFFAOYSA-N 1 3 278.484 3.906 20 0 CHADHO CC(C)[C@H](CSc1ccccc1)[NH2+]CC1(N)CCCC1 ZINC000665247730 1123258408 /nfs/dbraw/zinc/25/84/08/1123258408.db2.gz IVJHYGQPGUUZTJ-INIZCTEOSA-N 1 3 292.492 3.664 20 0 CHADHO CC(C)[C@H](CSc1ccccc1)NCC1([NH3+])CCCC1 ZINC000665247730 1123258410 /nfs/dbraw/zinc/25/84/10/1123258410.db2.gz IVJHYGQPGUUZTJ-INIZCTEOSA-N 1 3 292.492 3.664 20 0 CHADHO C[C@@H]([NH2+]CC1(N)CCCC1)c1ccc2ccccc2c1 ZINC000665249912 1123262804 /nfs/dbraw/zinc/26/28/04/1123262804.db2.gz AYLUQGUAWZSQHG-CQSZACIVSA-N 1 3 268.404 3.762 20 0 CHADHO C[C@H](CC[NH2+][C@H]1CCC12CCCC2)N1CCCCC1 ZINC000474046012 1123400163 /nfs/dbraw/zinc/40/01/63/1123400163.db2.gz RMIJSDTXJYZDSD-CVEARBPZSA-N 1 3 264.457 3.563 20 0 CHADHO C[C@H]1C[C@H]([NH2+]CCCN2CCCC[C@@H]2C)C[C@@H](C)C1 ZINC000252114855 1123412654 /nfs/dbraw/zinc/41/26/54/1123412654.db2.gz IISPYOIGOZHJRR-VVLHAWIVSA-N 1 3 266.473 3.665 20 0 CHADHO CCC1(N2CCC2)CC[NH+]([C@H](C)Cc2ccsc2)CC1 ZINC000895827519 1123517038 /nfs/dbraw/zinc/51/70/38/1123517038.db2.gz LYUGLHOPIFPVJV-OAHLLOKOSA-N 1 3 292.492 3.629 20 0 CHADHO C[C@@H]([NH2+]C1CCN([C@H]2CCC[C@@H](C)C2)CC1)C1(C)CC1 ZINC000776883507 1123556924 /nfs/dbraw/zinc/55/69/24/1123556924.db2.gz ZLOMCXVEISFVEH-INMHGKMJSA-N 1 3 278.484 3.808 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2CCC[C@@H](C(C)C)C2)C1 ZINC000474628594 1123561742 /nfs/dbraw/zinc/56/17/42/1123561742.db2.gz LNTTWJVJZXVJFU-BRWVUGGUSA-N 1 3 266.473 3.523 20 0 CHADHO C([NH2+]C1CCN(C2CCCCC2)CC1)[C@@H]1CCCCS1 ZINC000544371079 1123622465 /nfs/dbraw/zinc/62/24/65/1123622465.db2.gz LPYLNECPLHZSPA-KRWDZBQOSA-N 1 3 296.524 3.659 20 0 CHADHO Cc1oc2ccccc2c1[C@H](C)N[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000925140169 1123823237 /nfs/dbraw/zinc/82/32/37/1123823237.db2.gz JAUWQMHBHVIGCI-KCQAQPDRSA-N 1 3 286.419 3.875 20 0 CHADHO Cc1oc2ccccc2c1[C@H](C)N[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000925140169 1123823242 /nfs/dbraw/zinc/82/32/42/1123823242.db2.gz JAUWQMHBHVIGCI-KCQAQPDRSA-N 1 3 286.419 3.875 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@@H]2CCCc3ccc(C)cc32)C1 ZINC000339072797 1123971800 /nfs/dbraw/zinc/97/18/00/1123971800.db2.gz XTYRZKRWRULIIP-QFBILLFUSA-N 1 3 286.463 3.694 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@@H]2CCCc3ccc(C)cc32)C1 ZINC000339072797 1123971802 /nfs/dbraw/zinc/97/18/02/1123971802.db2.gz XTYRZKRWRULIIP-QFBILLFUSA-N 1 3 286.463 3.694 20 0 CHADHO CCCc1ccc(C[NH2+]C2CCN(CC3CC3)CC2)s1 ZINC000621329974 1129163511 /nfs/dbraw/zinc/16/35/11/1129163511.db2.gz VDFYDDDSRLQCCP-UHFFFAOYSA-N 1 3 292.492 3.665 20 0 CHADHO Cc1ccccc1[C@H]1CCN(CCC[NH+]2CCCCC2)C1 ZINC000444574321 1124043010 /nfs/dbraw/zinc/04/30/10/1124043010.db2.gz PLOGFZOGJVJQHZ-SFHVURJKSA-N 1 3 286.463 3.660 20 0 CHADHO CS[C@H]1C[C@H](NC2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)C1 ZINC000866486438 1124071925 /nfs/dbraw/zinc/07/19/25/1124071925.db2.gz HMWSULICPMXXES-QSPRXWTASA-N 1 3 296.524 3.513 20 0 CHADHO Cc1cc([C@H](C)NCc2cccc3c2CC[NH2+]C3)cs1 ZINC000635009663 1129170026 /nfs/dbraw/zinc/17/00/26/1129170026.db2.gz JXZBWPMTUWEMDY-ZDUSSCGKSA-N 1 3 286.444 3.553 20 0 CHADHO C[C@@H]([NH2+]CCCC(F)(F)F)[C@H]1CCCN(C2CCC2)C1 ZINC001119931338 1131267315 /nfs/dbraw/zinc/26/73/15/1131267315.db2.gz KXBHLRKSTPMPIX-OLZOCXBDSA-N 1 3 292.389 3.572 20 0 CHADHO CC(C)[NH+]1CCC(N(C)Cc2cccc3ccoc32)CC1 ZINC000449010889 1124633463 /nfs/dbraw/zinc/63/34/63/1124633463.db2.gz WGPWUIOGQIYVNG-UHFFFAOYSA-N 1 3 286.419 3.737 20 0 CHADHO CC(C)N(C)CCC[NH2+]C1CCC(OC2CCCC2)CC1 ZINC000449079068 1124646672 /nfs/dbraw/zinc/64/66/72/1124646672.db2.gz ZIELOTDQTVQOJZ-UHFFFAOYSA-N 1 3 296.499 3.577 20 0 CHADHO C[C@H](Cc1coc2ccccc12)N[C@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000449083016 1124646968 /nfs/dbraw/zinc/64/69/68/1124646968.db2.gz RREOHVGDDBOFFD-JLSDUUJJSA-N 1 3 298.430 3.580 20 0 CHADHO C[C@H](Cc1coc2ccccc12)N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000449083016 1124646970 /nfs/dbraw/zinc/64/69/70/1124646970.db2.gz RREOHVGDDBOFFD-JLSDUUJJSA-N 1 3 298.430 3.580 20 0 CHADHO CCC[C@H]([NH2+]C[C@H]1CCN(CCC)C1)C1CCCC1 ZINC000449095471 1124649989 /nfs/dbraw/zinc/64/99/89/1124649989.db2.gz YQICEXRMRKSOFY-WBVHZDCISA-N 1 3 266.473 3.667 20 0 CHADHO CC(C)[NH+](CCCN[C@@H]1CCO[C@@H](C(C)(C)C)C1)C(C)C ZINC000872039468 1124663470 /nfs/dbraw/zinc/66/34/70/1124663470.db2.gz FQQPPWIXZLGXGP-IAGOWNOFSA-N 1 3 298.515 3.679 20 0 CHADHO CC(C)CN1CCC[C@@H](C[NH2+][C@@H]2CCCC23CCC3)C1 ZINC000449211245 1124669465 /nfs/dbraw/zinc/66/94/65/1124669465.db2.gz RTIJFWKPDXYYEK-DLBZAZTESA-N 1 3 278.484 3.667 20 0 CHADHO CC(C)(C)N1CCC([NH2+]C[C@@H]2CCCCC2(F)F)CC1 ZINC000449372951 1124704868 /nfs/dbraw/zinc/70/48/68/1124704868.db2.gz AVAKASQPRUVWKJ-ZDUSSCGKSA-N 1 3 288.426 3.664 20 0 CHADHO C[C@@H](NCc1ccsc1)c1cccc(C[NH+](C)C)c1 ZINC000820807625 1131302262 /nfs/dbraw/zinc/30/22/62/1131302262.db2.gz MUFZTMFNWNHKSP-CYBMUJFWSA-N 1 3 274.433 3.661 20 0 CHADHO C(=C\c1ccccc1)\CCN1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000450437943 1125027050 /nfs/dbraw/zinc/02/70/50/1125027050.db2.gz LQNHEUVIEPBHOJ-OZVOWOKYSA-N 1 3 298.474 3.898 20 0 CHADHO CCC[C@H](C)CC[C@H](C)NC[C@@]1(C(F)(F)F)CC[NH2+]C1 ZINC001246111185 1131329737 /nfs/dbraw/zinc/32/97/37/1131329737.db2.gz KQZCKGNZIAUBPO-MELADBBJSA-N 1 3 294.405 3.723 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2c(C)cccc2C)C[C@H]1C ZINC000530663050 1125170186 /nfs/dbraw/zinc/17/01/86/1125170186.db2.gz CLUQXIPNNIGNLN-SJORKVTESA-N 1 3 274.452 3.608 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2c(C)cccc2C)C[C@H]1C ZINC000530663050 1125170191 /nfs/dbraw/zinc/17/01/91/1125170191.db2.gz CLUQXIPNNIGNLN-SJORKVTESA-N 1 3 274.452 3.608 20 0 CHADHO CCCCCC[C@@H](CC)NC[C@]1(C(F)(F)F)CC[NH2+]C1 ZINC001246115953 1131340135 /nfs/dbraw/zinc/34/01/35/1131340135.db2.gz UCDCFHARFLVPNW-KGLIPLIRSA-N 1 3 294.405 3.867 20 0 CHADHO CS[C@H]1CC[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000128319030 1125260726 /nfs/dbraw/zinc/26/07/26/1125260726.db2.gz DCOOWLLGANNVFI-WBVHZDCISA-N 1 3 296.524 3.657 20 0 CHADHO Cc1csc(CN2CCCC[C@@H]2C[C@@H]2CCC[N@H+]2C)c1 ZINC001137158419 1125285630 /nfs/dbraw/zinc/28/56/30/1125285630.db2.gz ROALBQAJUCVCKD-JKSUJKDBSA-N 1 3 292.492 3.895 20 0 CHADHO Cc1csc(CN2CCCC[C@@H]2C[C@@H]2CCC[N@@H+]2C)c1 ZINC001137158419 1125285633 /nfs/dbraw/zinc/28/56/33/1125285633.db2.gz ROALBQAJUCVCKD-JKSUJKDBSA-N 1 3 292.492 3.895 20 0 CHADHO Cc1csc(C[N@H+]2CCCC[C@@H]2C[C@@H]2CCCN2C)c1 ZINC001137158419 1125285638 /nfs/dbraw/zinc/28/56/38/1125285638.db2.gz ROALBQAJUCVCKD-JKSUJKDBSA-N 1 3 292.492 3.895 20 0 CHADHO Cc1csc(C[N@@H+]2CCCC[C@@H]2C[C@@H]2CCCN2C)c1 ZINC001137158419 1125285641 /nfs/dbraw/zinc/28/56/41/1125285641.db2.gz ROALBQAJUCVCKD-JKSUJKDBSA-N 1 3 292.492 3.895 20 0 CHADHO CC(C)Cc1ccccc1CN(C)[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC001307517314 1125370267 /nfs/dbraw/zinc/37/02/67/1125370267.db2.gz XOKUIIYMQKVLMZ-VQIMIIECSA-N 1 3 288.479 3.800 20 0 CHADHO CC(C)Cc1ccccc1CN(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC001307517314 1125370268 /nfs/dbraw/zinc/37/02/68/1125370268.db2.gz XOKUIIYMQKVLMZ-VQIMIIECSA-N 1 3 288.479 3.800 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCCC2(CC2)C1)[C@H]1CCCN(C2CCC2)C1 ZINC000883216728 1125378930 /nfs/dbraw/zinc/37/89/30/1125378930.db2.gz VNYFDJXGAMBIHW-YESZJQIVSA-N 1 3 290.495 3.952 20 0 CHADHO CC1CCC([NH2+]C2CCN(C[C@H]3CC=CCC3)CC2)CC1 ZINC001168209636 1125412753 /nfs/dbraw/zinc/41/27/53/1125412753.db2.gz ZQJQSLRRBRYTRV-ADKAHSJRSA-N 1 3 290.495 3.975 20 0 CHADHO CN1CCC[C@@H]1CC[N@H+](Cc1ccco1)C1CCCC1 ZINC000124960629 1125444084 /nfs/dbraw/zinc/44/40/84/1125444084.db2.gz CDURGFBFIPBPSN-OAHLLOKOSA-N 1 3 276.424 3.509 20 0 CHADHO CN1CCC[C@@H]1CC[N@@H+](Cc1ccco1)C1CCCC1 ZINC000124960629 1125444085 /nfs/dbraw/zinc/44/40/85/1125444085.db2.gz CDURGFBFIPBPSN-OAHLLOKOSA-N 1 3 276.424 3.509 20 0 CHADHO CC(C)[N@@H+]1CCC[C@H](CN[C@@H]2CCCc3ccccc32)C1 ZINC000125946747 1125452597 /nfs/dbraw/zinc/45/25/97/1125452597.db2.gz HDFZYCQBUDNCSC-VQIMIIECSA-N 1 3 286.463 3.774 20 0 CHADHO CC(C)[N@H+]1CCC[C@H](CN[C@@H]2CCCc3ccccc32)C1 ZINC000125946747 1125452602 /nfs/dbraw/zinc/45/26/02/1125452602.db2.gz HDFZYCQBUDNCSC-VQIMIIECSA-N 1 3 286.463 3.774 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H]2CCCc3ccccc32)C1 ZINC000125946747 1125452608 /nfs/dbraw/zinc/45/26/08/1125452608.db2.gz HDFZYCQBUDNCSC-VQIMIIECSA-N 1 3 286.463 3.774 20 0 CHADHO C[C@@H](NCc1cccc(-c2ccccc2)c1)[C@H]1CCC[NH2+]C1 ZINC000414855691 1129196314 /nfs/dbraw/zinc/19/63/14/1129196314.db2.gz NGVIPEZCUNMNCO-UZLBHIALSA-N 1 3 294.442 3.831 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3N[C@H]1CCC[NH2+]CC1 ZINC000643522911 1129443732 /nfs/dbraw/zinc/44/37/32/1129443732.db2.gz URIJDFXOEPYHTI-KSSFIOAISA-N 1 3 297.446 3.585 20 0 CHADHO Cc1ncc([C@@H](C)N[C@H](CCC[NH3+])c2ccccc2)s1 ZINC000643543761 1129445170 /nfs/dbraw/zinc/44/51/70/1129445170.db2.gz OHIZYYBMYCOOSH-IUODEOHRSA-N 1 3 289.448 3.582 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@H]2N[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643547952 1129445373 /nfs/dbraw/zinc/44/53/73/1129445373.db2.gz LDGPQVAVFLKKDH-SJLPKXTDSA-N 1 3 298.474 3.945 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)N(C[C@@H]1CC[NH2+]C1)C1CC1 ZINC000647882037 1129587229 /nfs/dbraw/zinc/58/72/29/1129587229.db2.gz DIKQETHSEWEPJB-HZPDHXFCSA-N 1 3 294.442 3.975 20 0 CHADHO CN(C)CC(C)(C)C[NH2+][C@@H]1CCSc2c(F)cccc21 ZINC000037197190 1129596863 /nfs/dbraw/zinc/59/68/63/1129596863.db2.gz QTDZVXARTDGJLP-CQSZACIVSA-N 1 3 296.455 3.540 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]CC[C@@H](C)c2ccccc2)C1 ZINC000194422984 1129647145 /nfs/dbraw/zinc/64/71/45/1129647145.db2.gz VJBXALKRSQCTAC-MSOLQXFVSA-N 1 3 288.479 3.890 20 0 CHADHO CC(C)C[C@@H](Cc1ccccc1)[N@H+](CCCN)C(C)C ZINC001169049951 1129691800 /nfs/dbraw/zinc/69/18/00/1129691800.db2.gz MFGIHVGOBWEVHK-SFHVURJKSA-N 1 3 276.468 3.703 20 0 CHADHO CC(C)C[C@@H](Cc1ccccc1)[N@@H+](CCCN)C(C)C ZINC001169049951 1129691801 /nfs/dbraw/zinc/69/18/01/1129691801.db2.gz MFGIHVGOBWEVHK-SFHVURJKSA-N 1 3 276.468 3.703 20 0 CHADHO CC(C)[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)N2C)c1ccccc1F ZINC001169101121 1129697362 /nfs/dbraw/zinc/69/73/62/1129697362.db2.gz OQWYQXVDAAGYQS-AFIMGQEJSA-N 1 3 290.426 3.738 20 0 CHADHO CC[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc(C)c1C ZINC001169119810 1129700197 /nfs/dbraw/zinc/70/01/97/1129700197.db2.gz WMBNYAGDNSPMBU-VXIBKDFQSA-N 1 3 286.463 3.969 20 0 CHADHO CC[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(C)c1C ZINC001169119810 1129700199 /nfs/dbraw/zinc/70/01/99/1129700199.db2.gz WMBNYAGDNSPMBU-VXIBKDFQSA-N 1 3 286.463 3.969 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@H](N1CCC[C@@H]1c1ccc(F)cc1)C2 ZINC001169127004 1129701993 /nfs/dbraw/zinc/70/19/93/1129701993.db2.gz ZHSIOQAQXRBFQM-XMTFNYHQSA-N 1 3 288.410 3.588 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](N1CCC[C@@H]1c1ccc(F)cc1)C2 ZINC001169127004 1129701997 /nfs/dbraw/zinc/70/19/97/1129701997.db2.gz ZHSIOQAQXRBFQM-XMTFNYHQSA-N 1 3 288.410 3.588 20 0 CHADHO Cc1ccc([C@H](C)N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)c(C)c1 ZINC001169108605 1129703522 /nfs/dbraw/zinc/70/35/22/1129703522.db2.gz TUZDKYQBBYEBKW-LUKYLMHMSA-N 1 3 272.436 3.579 20 0 CHADHO Cc1ccc([C@H](C)N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(C)c1 ZINC001169108605 1129703524 /nfs/dbraw/zinc/70/35/24/1129703524.db2.gz TUZDKYQBBYEBKW-LUKYLMHMSA-N 1 3 272.436 3.579 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](N1CCC[C@H]1c1cccc(F)c1)C2 ZINC001169142441 1129704149 /nfs/dbraw/zinc/70/41/49/1129704149.db2.gz USYUIFQTQFKZET-MLHJIOFPSA-N 1 3 288.410 3.588 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](N1CCC[C@H]1c1cccc(F)c1)C2 ZINC001169142441 1129704151 /nfs/dbraw/zinc/70/41/51/1129704151.db2.gz USYUIFQTQFKZET-MLHJIOFPSA-N 1 3 288.410 3.588 20 0 CHADHO Cc1cc2cc(NC(C)(C)CC[NH+](C)C)ccc2cn1 ZINC001169717367 1129750647 /nfs/dbraw/zinc/75/06/47/1129750647.db2.gz CNJVYFBDZKFNIJ-UHFFFAOYSA-N 1 3 271.408 3.685 20 0 CHADHO C[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000381983703 1129853859 /nfs/dbraw/zinc/85/38/59/1129853859.db2.gz NNJBOAXRXVCXEJ-NEWSRXKRSA-N 1 3 286.463 3.677 20 0 CHADHO CN(C)C1CC[NH+](Cc2ccccc2-c2ccccc2)CC1 ZINC000768530869 1129859951 /nfs/dbraw/zinc/85/99/51/1129859951.db2.gz XQHDOGHGHXGNPK-UHFFFAOYSA-N 1 3 294.442 3.880 20 0 CHADHO CCCC[C@H](CC)COCCC[NH2+][C@H]1CCN[C@H](CC)C1 ZINC001246215024 1131404226 /nfs/dbraw/zinc/40/42/26/1131404226.db2.gz HUVYOVDOWGTARX-KSZLIROESA-N 1 3 298.515 3.730 20 0 CHADHO CC[C@@H](C)C[NH2+]C1CCN(CC2CCCCC2)CC1 ZINC000771818770 1129990999 /nfs/dbraw/zinc/99/09/99/1129990999.db2.gz LLBVUTCBJYXZPW-OAHLLOKOSA-N 1 3 266.473 3.667 20 0 CHADHO [NH3+][C@@H]1C[C@H](NCCC2CCC(F)(F)CC2)c2ccccc21 ZINC000902456690 1130012167 /nfs/dbraw/zinc/01/21/67/1130012167.db2.gz QPFOOQFAWTWDHT-CVEARBPZSA-N 1 3 294.389 3.936 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C1(C2CCCCC2)CC1 ZINC000902516044 1130018929 /nfs/dbraw/zinc/01/89/29/1130018929.db2.gz ABIFNVYXNVBFMF-CQSZACIVSA-N 1 3 287.451 3.612 20 0 CHADHO Cc1cccc(-c2ccccc2CN2CCC([NH3+])CC2)c1C ZINC001239716766 1130069903 /nfs/dbraw/zinc/06/99/03/1130069903.db2.gz UNKCFUGAOXNHBJ-UHFFFAOYSA-N 1 3 294.442 3.894 20 0 CHADHO Cl/C=C\C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000903443172 1130177742 /nfs/dbraw/zinc/17/77/42/1130177742.db2.gz CNUNAFUJOJYTGA-DEJVHIGNSA-N 1 3 290.838 3.524 20 0 CHADHO Cc1ccccc1[C@H](N[C@H]1CC[N@@H+]2CCC[C@@H]2C1)C1CC1 ZINC000677240278 1130298351 /nfs/dbraw/zinc/29/83/51/1130298351.db2.gz FCTATHUQNBONSY-YQVWRLOYSA-N 1 3 284.447 3.663 20 0 CHADHO Cc1ccccc1[C@H](N[C@H]1CC[N@H+]2CCC[C@@H]2C1)C1CC1 ZINC000677240278 1130298357 /nfs/dbraw/zinc/29/83/57/1130298357.db2.gz FCTATHUQNBONSY-YQVWRLOYSA-N 1 3 284.447 3.663 20 0 CHADHO CCC[NH+]1CCC(N[C@H]2c3ccccc3CC[C@@H]2C)CC1 ZINC000678774009 1130453623 /nfs/dbraw/zinc/45/36/23/1130453623.db2.gz DBNUTUCQIWFISD-HNAYVOBHSA-N 1 3 286.463 3.774 20 0 CHADHO C[C@@H](CN1CC[C@]2(CC[NH2+]C2)C1)c1cccc2ccccc21 ZINC001235033270 1130702792 /nfs/dbraw/zinc/70/27/92/1130702792.db2.gz XBJLMLOFNMRNFW-JXFKEZNVSA-N 1 3 294.442 3.629 20 0 CHADHO C[C@H](CN1CCC2(CC[NH2+]2)CC1)c1cccc2ccccc21 ZINC001235105972 1130711772 /nfs/dbraw/zinc/71/17/72/1130711772.db2.gz JALFDSZPEYZXBM-MRXNPFEDSA-N 1 3 294.442 3.771 20 0 CHADHO CC(C)c1ccc(CC[N@@H+]2CCCC23CCNCC3)cc1 ZINC001235141217 1130714713 /nfs/dbraw/zinc/71/47/13/1130714713.db2.gz PKOJZWYWLNSCLH-UHFFFAOYSA-N 1 3 286.463 3.571 20 0 CHADHO CC(C)c1ccc(CC[N@H+]2CCCC23CCNCC3)cc1 ZINC001235141217 1130714716 /nfs/dbraw/zinc/71/47/16/1130714716.db2.gz PKOJZWYWLNSCLH-UHFFFAOYSA-N 1 3 286.463 3.571 20 0 CHADHO c1ccc(CCCCC[N@@H+]2CCCC23CCNCC3)cc1 ZINC001235141249 1130714731 /nfs/dbraw/zinc/71/47/31/1130714731.db2.gz QBYVNQHNMRDECQ-UHFFFAOYSA-N 1 3 286.463 3.617 20 0 CHADHO c1ccc(CCCCC[N@H+]2CCCC23CCNCC3)cc1 ZINC001235141249 1130714734 /nfs/dbraw/zinc/71/47/34/1130714734.db2.gz QBYVNQHNMRDECQ-UHFFFAOYSA-N 1 3 286.463 3.617 20 0 CHADHO Cc1cc(C)c(C[N@@H+]2CCCCC23CCNCC3)cc1C ZINC001235189260 1130721488 /nfs/dbraw/zinc/72/14/88/1130721488.db2.gz FSLNRDVNEHSAID-UHFFFAOYSA-N 1 3 286.463 3.720 20 0 CHADHO Cc1cc(C)c(C[N@H+]2CCCCC23CCNCC3)cc1C ZINC001235189260 1130721492 /nfs/dbraw/zinc/72/14/92/1130721492.db2.gz FSLNRDVNEHSAID-UHFFFAOYSA-N 1 3 286.463 3.720 20 0 CHADHO C1=CC2(CCN(CC[C@H]3CCCC[NH2+]3)CC2)c2ccccc21 ZINC001235187429 1130721590 /nfs/dbraw/zinc/72/15/90/1130721590.db2.gz YVQOENIZHARHNJ-GOSISDBHSA-N 1 3 296.458 3.579 20 0 CHADHO Cc1ccc(-c2ccc(CN3C[C@@H]4C[C@H]3C[C@@H]4[NH3+])cc2)cc1 ZINC001235252953 1130727807 /nfs/dbraw/zinc/72/78/07/1130727807.db2.gz ARAYZZJDTWAXAS-UFYCRDLUSA-N 1 3 292.426 3.584 20 0 CHADHO [NH3+]C[C@@H]1CCCN(Cc2cccc(-c3ccsc3)c2)C1 ZINC001235672296 1130764233 /nfs/dbraw/zinc/76/42/33/1130764233.db2.gz AEQCMLQUJXMRGN-HNNXBMFYSA-N 1 3 286.444 3.586 20 0 CHADHO Clc1cccc(CN2CCC(C3CC[NH2+]CC3)CC2)c1 ZINC001235702944 1130772145 /nfs/dbraw/zinc/77/21/45/1130772145.db2.gz YBWHKPKNGWSOMW-UHFFFAOYSA-N 1 3 292.854 3.552 20 0 CHADHO CC1([NH3+])CCN(CC(c2ccccc2)c2ccccc2)CC1 ZINC001235748281 1130776394 /nfs/dbraw/zinc/77/63/94/1130776394.db2.gz KBIMSZQHHXPGCP-UHFFFAOYSA-N 1 3 294.442 3.632 20 0 CHADHO Cc1c(CN2CCC(C)([NH3+])CC2)cccc1-c1ccccc1 ZINC001235752880 1130776766 /nfs/dbraw/zinc/77/67/66/1130776766.db2.gz TZIWASTULKPGLI-UHFFFAOYSA-N 1 3 294.442 3.975 20 0 CHADHO CN(Cc1ccccc1-c1ccc(F)cc1)C[C@@H]1CC[NH2+]C1 ZINC001235843631 1130787404 /nfs/dbraw/zinc/78/74/04/1130787404.db2.gz ZYRYYAYTCVUJOR-OAHLLOKOSA-N 1 3 298.405 3.534 20 0 CHADHO Cc1c(C)c(C)c(C[N@H+]2C[C@H](N)CC[C@H]2C)c(C)c1C ZINC001235905059 1130801819 /nfs/dbraw/zinc/80/18/19/1130801819.db2.gz KPAJBFSCOJQOMK-PIGZYNQJSA-N 1 3 274.452 3.540 20 0 CHADHO Cc1c(C)c(C)c(C[N@@H+]2C[C@H](N)CC[C@H]2C)c(C)c1C ZINC001235905059 1130801827 /nfs/dbraw/zinc/80/18/27/1130801827.db2.gz KPAJBFSCOJQOMK-PIGZYNQJSA-N 1 3 274.452 3.540 20 0 CHADHO C[C@H]1CC[C@H](N)C[N@@H+]1Cc1cccc2c3ccccc3oc21 ZINC001235906831 1130803966 /nfs/dbraw/zinc/80/39/66/1130803966.db2.gz OVTLRNBVSYZYEZ-ZFWWWQNUSA-N 1 3 294.398 3.898 20 0 CHADHO C[C@H]1CC[C@H](N)C[N@H+]1Cc1cccc2c3ccccc3oc21 ZINC001235906831 1130803973 /nfs/dbraw/zinc/80/39/73/1130803973.db2.gz OVTLRNBVSYZYEZ-ZFWWWQNUSA-N 1 3 294.398 3.898 20 0 CHADHO C[C@@H](C[N@@H+]1CCC[C@H]1CCN)c1cccc2ccccc21 ZINC001235925555 1130805861 /nfs/dbraw/zinc/80/58/61/1130805861.db2.gz UYWKIEFCJASQNQ-RDJZCZTQSA-N 1 3 282.431 3.757 20 0 CHADHO C[C@@H](C[N@H+]1CCC[C@H]1CCN)c1cccc2ccccc21 ZINC001235925555 1130805864 /nfs/dbraw/zinc/80/58/64/1130805864.db2.gz UYWKIEFCJASQNQ-RDJZCZTQSA-N 1 3 282.431 3.757 20 0 CHADHO c1cc(C2CCCCC2)ccc1CN1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC001235934784 1130810989 /nfs/dbraw/zinc/81/09/89/1130810989.db2.gz ALEYGGSCMXRREM-VQTJNVASSA-N 1 3 298.474 3.776 20 0 CHADHO [NH3+]CCCCCCN1CCC[C@H]1c1ccc(F)cc1F ZINC001236130003 1130871460 /nfs/dbraw/zinc/87/14/60/1130871460.db2.gz QGBDGEMHKOFWOO-INIZCTEOSA-N 1 3 282.378 3.621 20 0 CHADHO CCC[N@H+](Cc1ccc2ccsc2c1)C1CCNCC1 ZINC001236185139 1130882204 /nfs/dbraw/zinc/88/22/04/1130882204.db2.gz XMEOGKVQGYAGTJ-UHFFFAOYSA-N 1 3 288.460 3.865 20 0 CHADHO CCC[N@@H+](Cc1ccc2ccsc2c1)C1CCNCC1 ZINC001236185139 1130882212 /nfs/dbraw/zinc/88/22/12/1130882212.db2.gz XMEOGKVQGYAGTJ-UHFFFAOYSA-N 1 3 288.460 3.865 20 0 CHADHO CCCN(Cc1ccc2ccsc2c1)C1CC[NH2+]CC1 ZINC001236185139 1130882219 /nfs/dbraw/zinc/88/22/19/1130882219.db2.gz XMEOGKVQGYAGTJ-UHFFFAOYSA-N 1 3 288.460 3.865 20 0 CHADHO C[N@H+](Cc1c[nH]c2ccc(Cl)cc12)[C@@H]1CCCC[C@@H]1N ZINC001236212952 1130889804 /nfs/dbraw/zinc/88/98/04/1130889804.db2.gz MWCLREHYNDGFBT-GOEBONIOSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@@H+](Cc1c[nH]c2ccc(Cl)cc12)[C@@H]1CCCC[C@@H]1N ZINC001236212952 1130889808 /nfs/dbraw/zinc/88/98/08/1130889808.db2.gz MWCLREHYNDGFBT-GOEBONIOSA-N 1 3 291.826 3.523 20 0 CHADHO c1ccc(CN(CC[C@H]2CCCC[NH2+]2)C2CCC2)cc1 ZINC001236439939 1130942789 /nfs/dbraw/zinc/94/27/89/1130942789.db2.gz CHHGUQVEGDHYPF-QGZVFWFLSA-N 1 3 272.436 3.573 20 0 CHADHO Cc1ccc(F)cc1CN(CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236458536 1130946990 /nfs/dbraw/zinc/94/69/90/1130946990.db2.gz WGAZBNVXKLFGEY-UHFFFAOYSA-N 1 3 292.442 3.734 20 0 CHADHO Cc1ccc(F)cc1C[N@H+](CC(C)(C)C)C1CCNCC1 ZINC001236458536 1130946995 /nfs/dbraw/zinc/94/69/95/1130946995.db2.gz WGAZBNVXKLFGEY-UHFFFAOYSA-N 1 3 292.442 3.734 20 0 CHADHO Cc1ccc(F)cc1C[N@@H+](CC(C)(C)C)C1CCNCC1 ZINC001236458536 1130947001 /nfs/dbraw/zinc/94/70/01/1130947001.db2.gz WGAZBNVXKLFGEY-UHFFFAOYSA-N 1 3 292.442 3.734 20 0 CHADHO C[C@@]1(C[NH3+])CCN(Cc2ccc3oc4ccccc4c3c2)C1 ZINC001236605329 1130983222 /nfs/dbraw/zinc/98/32/22/1130983222.db2.gz QWWZSPNBRUWANY-IBGZPJMESA-N 1 3 294.398 3.757 20 0 CHADHO Cc1ccc(-c2ccc(CN3CC[C@](C)(C[NH3+])C3)cc2)cc1 ZINC001236605476 1130983634 /nfs/dbraw/zinc/98/36/34/1130983634.db2.gz VKNHCBFRJILIEA-HXUWFJFHSA-N 1 3 294.442 3.833 20 0 CHADHO CCCN(Cc1ccc(C(C)C)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236835609 1131018694 /nfs/dbraw/zinc/01/86/94/1131018694.db2.gz NWNPMDYPHMFSLK-QGZVFWFLSA-N 1 3 274.452 3.632 20 0 CHADHO Cc1c(C)c(C)c(CN2CCC[C@@](C)(C[NH3+])C2)c(C)c1C ZINC001237055231 1131042691 /nfs/dbraw/zinc/04/26/91/1131042691.db2.gz BPQBUKUBWLRTCQ-IBGZPJMESA-N 1 3 288.479 3.790 20 0 CHADHO Cc1sc2ccccc2c1CN1CCC[C@](C)(C[NH3+])C1 ZINC001237055105 1131044048 /nfs/dbraw/zinc/04/40/48/1131044048.db2.gz ADQCDIQNOXYJGV-QGZVFWFLSA-N 1 3 288.460 3.771 20 0 CHADHO CC(C)CCC[N@@H+]1Cc2ccccc2C12CCNCC2 ZINC001237306126 1131080786 /nfs/dbraw/zinc/08/07/86/1131080786.db2.gz ZUUPPKBQDUUNDJ-UHFFFAOYSA-N 1 3 272.436 3.517 20 0 CHADHO CC(C)CCC[N@H+]1Cc2ccccc2C12CCNCC2 ZINC001237306126 1131080792 /nfs/dbraw/zinc/08/07/92/1131080792.db2.gz ZUUPPKBQDUUNDJ-UHFFFAOYSA-N 1 3 272.436 3.517 20 0 CHADHO CCN1CCC[C@H](C[NH2+][C@H](C)c2ccc(Cl)s2)C1 ZINC001116293377 1131140210 /nfs/dbraw/zinc/14/02/10/1131140210.db2.gz PUJWOMUCFMILTC-VXGBXAGGSA-N 1 3 286.872 3.784 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+]3CCC[C@@H]3C)cc21 ZINC001237881021 1131146896 /nfs/dbraw/zinc/14/68/96/1131146896.db2.gz NFYZQQQHDIECKR-AWEZNQCLSA-N 1 3 270.420 3.672 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+]3CCC[C@@H]3C)cc21 ZINC001237881021 1131146900 /nfs/dbraw/zinc/14/69/00/1131146900.db2.gz NFYZQQQHDIECKR-AWEZNQCLSA-N 1 3 270.420 3.672 20 0 CHADHO CC[NH+](CC)C1CCN(c2c(C)cnc3ccccc32)CC1 ZINC001116466054 1131148873 /nfs/dbraw/zinc/14/88/73/1131148873.db2.gz UODJPUJPFTZJAJ-UHFFFAOYSA-N 1 3 297.446 3.854 20 0 CHADHO CCCC[C@H]1C[C@@H]([NH2+]C2CCC(C)(C)CC2)CCN1 ZINC001246308137 1131457768 /nfs/dbraw/zinc/45/77/68/1131457768.db2.gz JCBPLUBQTZWWTD-HOTGVXAUSA-N 1 3 266.473 3.856 20 0 CHADHO CC(C)(C)[C@@H]1C[C@@H]([NH2+]C2CCC(C)(C)CC2)CCN1 ZINC001246313362 1131461862 /nfs/dbraw/zinc/46/18/62/1131461862.db2.gz YSHRFFVBJXOZFU-GJZGRUSLSA-N 1 3 266.473 3.712 20 0 CHADHO CC[C@@]1(CN[C@@H](C)C[C@H](C)CC(C)C)CCC[NH2+]1 ZINC001246458549 1131507697 /nfs/dbraw/zinc/50/76/97/1131507697.db2.gz YYEICPCFZHGKSE-PMPSAXMXSA-N 1 3 254.462 3.569 20 0 CHADHO C[C@@H]1CC[N@@H+]([C@H]2CCCC3(CCCCC3)C2)C[C@@H]1CN ZINC001246553805 1131612411 /nfs/dbraw/zinc/61/24/11/1131612411.db2.gz UYYHFKDVZLCTJU-IKGGRYGDSA-N 1 3 278.484 3.796 20 0 CHADHO C[C@@H]1CC[N@H+]([C@H]2CCCC3(CCCCC3)C2)C[C@@H]1CN ZINC001246553805 1131612415 /nfs/dbraw/zinc/61/24/15/1131612415.db2.gz UYYHFKDVZLCTJU-IKGGRYGDSA-N 1 3 278.484 3.796 20 0 CHADHO CCC[C@H](C)CC[C@@H](C)[N@@H+]1CCCC[C@@H](CN)C1 ZINC001246595240 1131709633 /nfs/dbraw/zinc/70/96/33/1131709633.db2.gz SIAIJQKFKMWGIN-XHSDSOJGSA-N 1 3 254.462 3.652 20 0 CHADHO CCC[C@H](C)CC[C@@H](C)[N@H+]1CCCC[C@@H](CN)C1 ZINC001246595240 1131709635 /nfs/dbraw/zinc/70/96/35/1131709635.db2.gz SIAIJQKFKMWGIN-XHSDSOJGSA-N 1 3 254.462 3.652 20 0 CHADHO CC1(C)CCC[C@H]([N@@H+]2CCC[C@@]3(CCCCN3)C2)C1 ZINC001246616353 1131719686 /nfs/dbraw/zinc/71/96/86/1131719686.db2.gz WBGDYCUKESNISU-RDJZCZTQSA-N 1 3 264.457 3.563 20 0 CHADHO CC1(C)CCC[C@H]([N@H+]2CCC[C@@]3(CCCCN3)C2)C1 ZINC001246616353 1131719689 /nfs/dbraw/zinc/71/96/89/1131719689.db2.gz WBGDYCUKESNISU-RDJZCZTQSA-N 1 3 264.457 3.563 20 0 CHADHO CC1(C)CCC[C@H](N2CCC[C@@]3(CCCC[NH2+]3)C2)C1 ZINC001246616353 1131719694 /nfs/dbraw/zinc/71/96/94/1131719694.db2.gz WBGDYCUKESNISU-RDJZCZTQSA-N 1 3 264.457 3.563 20 0 CHADHO CCCCC(CCCC)[N@H+]1C[C@H](C2(N)CC2)[C@H](CF)C1 ZINC001246698432 1131781970 /nfs/dbraw/zinc/78/19/70/1131781970.db2.gz XWNICBXKUHTFET-ZBFHGGJFSA-N 1 3 284.463 3.744 20 0 CHADHO CCCCC(CCCC)[N@@H+]1C[C@H](C2(N)CC2)[C@H](CF)C1 ZINC001246698432 1131781976 /nfs/dbraw/zinc/78/19/76/1131781976.db2.gz XWNICBXKUHTFET-ZBFHGGJFSA-N 1 3 284.463 3.744 20 0 CHADHO Cc1ccc2ccccc2c1C[N@@H+]1CCCC[C@@H](CN)C1 ZINC001206624661 1132021632 /nfs/dbraw/zinc/02/16/32/1132021632.db2.gz YMQWSFOTYASJFJ-INIZCTEOSA-N 1 3 282.431 3.709 20 0 CHADHO Cc1ccc2ccccc2c1C[N@H+]1CCCC[C@@H](CN)C1 ZINC001206624661 1132021640 /nfs/dbraw/zinc/02/16/40/1132021640.db2.gz YMQWSFOTYASJFJ-INIZCTEOSA-N 1 3 282.431 3.709 20 0 CHADHO CC/C=C/CN[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716693639 1132027873 /nfs/dbraw/zinc/02/78/73/1132027873.db2.gz PKCXEMACMXKXRN-UHJLCXOYSA-N 1 3 284.447 3.595 20 0 CHADHO CC/C=C/CN[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716693639 1132027878 /nfs/dbraw/zinc/02/78/78/1132027878.db2.gz PKCXEMACMXKXRN-UHJLCXOYSA-N 1 3 284.447 3.595 20 0 CHADHO CC/C=C/C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000716693639 1132027888 /nfs/dbraw/zinc/02/78/88/1132027888.db2.gz PKCXEMACMXKXRN-UHJLCXOYSA-N 1 3 284.447 3.595 20 0 CHADHO CN1C(C)(C)CC([N@@H+]2CCC[C@](C)(F)CC2)CC1(C)C ZINC001171630768 1132060642 /nfs/dbraw/zinc/06/06/42/1132060642.db2.gz BCMPLPOKDPWXBS-KRWDZBQOSA-N 1 3 284.463 3.852 20 0 CHADHO CN1C(C)(C)CC([N@H+]2CCC[C@](C)(F)CC2)CC1(C)C ZINC001171630768 1132060649 /nfs/dbraw/zinc/06/06/49/1132060649.db2.gz BCMPLPOKDPWXBS-KRWDZBQOSA-N 1 3 284.463 3.852 20 0 CHADHO CN1C(C)(C)CC([NH2+]C[C@H]2CCC(F)(F)C2)CC1(C)C ZINC001171613724 1132065503 /nfs/dbraw/zinc/06/55/03/1132065503.db2.gz OCVNAADZNCKPES-LBPRGKRZSA-N 1 3 288.426 3.663 20 0 CHADHO CCC1([NH2+]C2CC(C)(C)N(C)C(C)(C)C2)CCC1 ZINC001171627585 1132066489 /nfs/dbraw/zinc/06/64/89/1132066489.db2.gz XUNKGQROHGHFKE-UHFFFAOYSA-N 1 3 252.446 3.560 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@H]2CC23CCCC3)CC1(C)C ZINC001171625274 1132066581 /nfs/dbraw/zinc/06/65/81/1132066581.db2.gz FICWMOBVJMGIHM-AWEZNQCLSA-N 1 3 264.457 3.560 20 0 CHADHO CN1C(C)(C)CC([NH2+]CCCC(F)(F)F)CC1(C)C ZINC001171623553 1132066784 /nfs/dbraw/zinc/06/67/84/1132066784.db2.gz BUJJLYUVKTUHKT-UHFFFAOYSA-N 1 3 280.378 3.570 20 0 CHADHO C[C@H]([NH2+]C1CC(C)(C)N(C)C(C)(C)C1)c1ccc(N)cc1 ZINC001171623640 1132067668 /nfs/dbraw/zinc/06/76/68/1132067668.db2.gz FEVNQAHSIVROGZ-ZDUSSCGKSA-N 1 3 289.467 3.571 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@@H]2CC23CCCCC3)CC1(C)C ZINC001171626299 1132067685 /nfs/dbraw/zinc/06/76/85/1132067685.db2.gz XBDGUVVKCQWBLV-OAHLLOKOSA-N 1 3 278.484 3.950 20 0 CHADHO CCN(C)C1CC[NH+]([C@H](C)CCc2ccc(C)cc2)CC1 ZINC001171682822 1132077631 /nfs/dbraw/zinc/07/76/31/1132077631.db2.gz XDXMMCMZGLRYKO-QGZVFWFLSA-N 1 3 288.479 3.732 20 0 CHADHO C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H](NCc1cccc3ccccc31)C2 ZINC001172100097 1132126198 /nfs/dbraw/zinc/12/61/98/1132126198.db2.gz MUZCWVNFTOBDCM-REPLKXPHSA-N 1 3 294.442 3.945 20 0 CHADHO C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H](NCc1cccc3ccccc31)C2 ZINC001172100097 1132126200 /nfs/dbraw/zinc/12/62/00/1132126200.db2.gz MUZCWVNFTOBDCM-REPLKXPHSA-N 1 3 294.442 3.945 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC3(CC[C@H](F)C3)CC1)C2 ZINC001172129045 1132127194 /nfs/dbraw/zinc/12/71/94/1132127194.db2.gz VUTYLZNIYAFSHU-MWDXBVQZSA-N 1 3 294.458 3.606 20 0 CHADHO C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](NCc1cccc(C3CC3)c1)C2 ZINC001172107787 1132128960 /nfs/dbraw/zinc/12/89/60/1132128960.db2.gz CGPJBUIZAJUDRR-LDLYASANSA-N 1 3 284.447 3.669 20 0 CHADHO C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H](NCc1cccc(C3CC3)c1)C2 ZINC001172107787 1132128963 /nfs/dbraw/zinc/12/89/63/1132128963.db2.gz CGPJBUIZAJUDRR-LDLYASANSA-N 1 3 284.447 3.669 20 0 CHADHO CC[N@H+](Cc1ccccc1F)[C@H]1C[C@H]2CCC[C@@H](C1)N2C ZINC001172120236 1132134348 /nfs/dbraw/zinc/13/43/48/1132134348.db2.gz BERKIGIGUZQOSK-FVQHAEBGSA-N 1 3 290.426 3.663 20 0 CHADHO CC[N@@H+](Cc1ccccc1F)[C@H]1C[C@H]2CCC[C@@H](C1)N2C ZINC001172120236 1132134353 /nfs/dbraw/zinc/13/43/53/1132134353.db2.gz BERKIGIGUZQOSK-FVQHAEBGSA-N 1 3 290.426 3.663 20 0 CHADHO CC[C@@H](C)OCC[C@@H](C)[N@H+](CCCN)C1CCCCC1 ZINC001172315213 1132155902 /nfs/dbraw/zinc/15/59/02/1132155902.db2.gz GFSZWDPFJGCECY-HZPDHXFCSA-N 1 3 284.488 3.564 20 0 CHADHO CC[C@@H](C)OCC[C@@H](C)[N@@H+](CCCN)C1CCCCC1 ZINC001172315213 1132155906 /nfs/dbraw/zinc/15/59/06/1132155906.db2.gz GFSZWDPFJGCECY-HZPDHXFCSA-N 1 3 284.488 3.564 20 0 CHADHO CCCCN(C)CCC[NH2+][C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC001172358140 1132187032 /nfs/dbraw/zinc/18/70/32/1132187032.db2.gz DONTXSRYFVDXGB-OWCLPIDISA-N 1 3 254.462 3.523 20 0 CHADHO C[C@@H]1CC[C@H]([NH+]2C(C)(C)CC(N)CC2(C)C)C[C@@H]1C ZINC001172360305 1132188608 /nfs/dbraw/zinc/18/86/08/1132188608.db2.gz RQGSVOXVRRRRMM-IPYPFGDCSA-N 1 3 266.473 3.791 20 0 CHADHO C[C@@H]1CC[C@H]([NH+]2CCC(N3CCCCC3)CC2)C[C@H]1C ZINC001172366703 1132191841 /nfs/dbraw/zinc/19/18/41/1132191841.db2.gz OWUBRQQCYGHMGT-NUJGCVRESA-N 1 3 278.484 3.761 20 0 CHADHO CCCCCC[C@@H](CCC)[NH+]1CCC(C)(N)CC1 ZINC001172391721 1132216363 /nfs/dbraw/zinc/21/63/63/1132216363.db2.gz SWUWDTDRDHQPHA-OAHLLOKOSA-N 1 3 254.462 3.939 20 0 CHADHO CC(C)OCC[C@@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC001172439471 1132233780 /nfs/dbraw/zinc/23/37/80/1132233780.db2.gz DYBWMLOJMPOBMP-MRXNPFEDSA-N 1 3 296.499 3.577 20 0 CHADHO CCCC[NH+](CCCC)Cc1cc2cnccc2[nH]1 ZINC001232013491 1132410188 /nfs/dbraw/zinc/41/01/88/1132410188.db2.gz AHCAJCNAZUGXHX-UHFFFAOYSA-N 1 3 259.397 3.965 20 0 CHADHO CC[C@@H]1CC[C@@H](N2CCC([NH3+])(c3ccc(F)cc3)CC2)C1 ZINC001173270598 1132435454 /nfs/dbraw/zinc/43/54/54/1132435454.db2.gz NWOYBUFDCUSRDD-RHSMWYFYSA-N 1 3 290.426 3.654 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCc1ccc(SC(F)(F)F)cc1 ZINC000843127101 1132495866 /nfs/dbraw/zinc/49/58/66/1132495866.db2.gz CGLIKZSMJMDMLN-VHSXEESVSA-N 1 3 292.370 3.514 20 0 CHADHO CCCN(CCC[NH+](C)C)Cc1ccc(C2CC2)cc1 ZINC001232987374 1132557924 /nfs/dbraw/zinc/55/79/24/1132557924.db2.gz UWUWAZNHEQFELT-UHFFFAOYSA-N 1 3 274.452 3.728 20 0 CHADHO Cc1cc2cc(NC[C@@H]3CCC[NH2+]C[C@@H]3C)ccc2cn1 ZINC001162472913 1133081315 /nfs/dbraw/zinc/08/13/15/1133081315.db2.gz ZQCBDYCTAAMBEL-ZFWWWQNUSA-N 1 3 283.419 3.591 20 0 CHADHO c1ccc(C[N@H+]2CCCC[C@H]2CCN2CCCC2)cc1 ZINC001203309078 1133314069 /nfs/dbraw/zinc/31/40/69/1133314069.db2.gz KPCILIYQZOKKBE-SFHVURJKSA-N 1 3 272.436 3.527 20 0 CHADHO c1ccc(C[N@@H+]2CCCC[C@H]2CCN2CCCC2)cc1 ZINC001203309078 1133314075 /nfs/dbraw/zinc/31/40/75/1133314075.db2.gz KPCILIYQZOKKBE-SFHVURJKSA-N 1 3 272.436 3.527 20 0 CHADHO c1ccc(C[N@H+]2CCCC[C@@H]2CCN2CCCC2)cc1 ZINC001203309077 1133314207 /nfs/dbraw/zinc/31/42/07/1133314207.db2.gz KPCILIYQZOKKBE-GOSISDBHSA-N 1 3 272.436 3.527 20 0 CHADHO c1ccc(C[N@@H+]2CCCC[C@@H]2CCN2CCCC2)cc1 ZINC001203309077 1133314213 /nfs/dbraw/zinc/31/42/13/1133314213.db2.gz KPCILIYQZOKKBE-GOSISDBHSA-N 1 3 272.436 3.527 20 0 CHADHO CN(C)CCC[N@H+](C)Cc1ccc(-c2ccccc2)cc1 ZINC001204133947 1133408965 /nfs/dbraw/zinc/40/89/65/1133408965.db2.gz KKJYNKNCDFCXOP-UHFFFAOYSA-N 1 3 282.431 3.737 20 0 CHADHO CN(C)CCC[N@@H+](C)Cc1ccc(-c2ccccc2)cc1 ZINC001204133947 1133408966 /nfs/dbraw/zinc/40/89/66/1133408966.db2.gz KKJYNKNCDFCXOP-UHFFFAOYSA-N 1 3 282.431 3.737 20 0 CHADHO CC[C@@H]1CCCC[C@@H]1C[N@@H+]1CC[C@H](CN(CC)CC)C1 ZINC001204549960 1133461684 /nfs/dbraw/zinc/46/16/84/1133461684.db2.gz DHVHGCWIWLGDPA-KZNAEPCWSA-N 1 3 280.500 3.867 20 0 CHADHO CC[C@@H]1CCCC[C@@H]1C[N@H+]1CC[C@H](CN(CC)CC)C1 ZINC001204549960 1133461687 /nfs/dbraw/zinc/46/16/87/1133461687.db2.gz DHVHGCWIWLGDPA-KZNAEPCWSA-N 1 3 280.500 3.867 20 0 CHADHO C[NH2+]C[C@@H]1CCCN(C[C@@H](C)c2cccc3ccccc32)C1 ZINC001205002081 1133516651 /nfs/dbraw/zinc/51/66/51/1133516651.db2.gz YXFPUYVITYWACA-SJORKVTESA-N 1 3 296.458 3.875 20 0 CHADHO CC(C)c1cc(CN2CCC(C[NH3+])CC2)ccc1Cl ZINC001205058663 1133521412 /nfs/dbraw/zinc/52/14/12/1133521412.db2.gz QOFONWONZSTROX-UHFFFAOYSA-N 1 3 280.843 3.634 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CCC[C@@H](N)CC1 ZINC001205087765 1133526726 /nfs/dbraw/zinc/52/67/26/1133526726.db2.gz IVOPILJQTAAZFD-JKSUJKDBSA-N 1 3 252.446 3.572 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CCC[C@@H](N)CC1 ZINC001205087765 1133526730 /nfs/dbraw/zinc/52/67/30/1133526730.db2.gz IVOPILJQTAAZFD-JKSUJKDBSA-N 1 3 252.446 3.572 20 0 CHADHO [NH3+][C@@H]1CCCN(Cc2cccc(-c3ccccc3)c2)CC1 ZINC001205110609 1133531324 /nfs/dbraw/zinc/53/13/24/1133531324.db2.gz XATGPCURTJWTDY-LJQANCHMSA-N 1 3 280.415 3.667 20 0 CHADHO CC(C)c1ccc(CN2CCC[C@](C)([NH3+])CC2)cc1 ZINC001205265335 1133551805 /nfs/dbraw/zinc/55/18/05/1133551805.db2.gz PYKXZKMPEKUDSU-KRWDZBQOSA-N 1 3 260.425 3.513 20 0 CHADHO C[C@H]1CCNCC[N@@H+]1Cc1cccc(-c2ccc(F)cc2)c1 ZINC001205326291 1133561621 /nfs/dbraw/zinc/56/16/21/1133561621.db2.gz XXPYSNUYAGSUQQ-HNNXBMFYSA-N 1 3 298.405 3.677 20 0 CHADHO C[C@H]1CCNCC[N@H+]1Cc1cccc(-c2ccc(F)cc2)c1 ZINC001205326291 1133561625 /nfs/dbraw/zinc/56/16/25/1133561625.db2.gz XXPYSNUYAGSUQQ-HNNXBMFYSA-N 1 3 298.405 3.677 20 0 CHADHO C[NH+]1CCC2(CCN(Cc3sccc3Cl)CC2)CC1 ZINC001205353957 1133567297 /nfs/dbraw/zinc/56/72/97/1133567297.db2.gz OLPAZCPDHKKLKN-UHFFFAOYSA-N 1 3 298.883 3.709 20 0 CHADHO Cc1c(Cl)ccc(CN2CC[C@H](C)[C@@H](C[NH3+])CC2)c1F ZINC001205651731 1133599776 /nfs/dbraw/zinc/59/97/76/1133599776.db2.gz IREUYLWGJYZCIL-WCQYABFASA-N 1 3 298.833 3.594 20 0 CHADHO Cc1c(Cl)ccc(CN2CC[C@@H](C)[C@@H](C[NH3+])CC2)c1F ZINC001205651730 1133600427 /nfs/dbraw/zinc/60/04/27/1133600427.db2.gz IREUYLWGJYZCIL-DGCLKSJQSA-N 1 3 298.833 3.594 20 0 CHADHO C[C@@H]1CNCC[N@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001206277593 1133681211 /nfs/dbraw/zinc/68/12/11/1133681211.db2.gz VASLSXAKSCEHBI-CQSZACIVSA-N 1 3 294.398 3.627 20 0 CHADHO C[C@@H]1CNCC[N@@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001206277593 1133681214 /nfs/dbraw/zinc/68/12/14/1133681214.db2.gz VASLSXAKSCEHBI-CQSZACIVSA-N 1 3 294.398 3.627 20 0 CHADHO CC(C)=CCC[C@@H](C)CCN1CCCC[C@@](F)(C[NH3+])C1 ZINC001206337002 1133691332 /nfs/dbraw/zinc/69/13/32/1133691332.db2.gz QBOQRGRWGRLPAW-IAGOWNOFSA-N 1 3 284.463 3.912 20 0 CHADHO Cc1ccc2[nH]c(CN(C(C)C)[C@@H]3CCC[NH2+]CC3)cc2c1 ZINC001206591289 1133722990 /nfs/dbraw/zinc/72/29/90/1133722990.db2.gz QOGXXSYTFXNIBV-GOSISDBHSA-N 1 3 299.462 3.829 20 0 CHADHO C[NH+](C)CC(C)(C)CN1CCC2(C=Cc3ccccc32)CC1 ZINC001207278860 1133786937 /nfs/dbraw/zinc/78/69/37/1133786937.db2.gz FAGKWAQEDRLRHB-UHFFFAOYSA-N 1 3 298.474 3.635 20 0 CHADHO CCCCN1CCC([N@H+](C)CCc2ccccc2F)CC1 ZINC001207502881 1133809782 /nfs/dbraw/zinc/80/97/82/1133809782.db2.gz LXGUCBZOPBVLNU-UHFFFAOYSA-N 1 3 292.442 3.565 20 0 CHADHO CCCCN1CCC([N@@H+](C)CCc2ccccc2F)CC1 ZINC001207502881 1133809787 /nfs/dbraw/zinc/80/97/87/1133809787.db2.gz LXGUCBZOPBVLNU-UHFFFAOYSA-N 1 3 292.442 3.565 20 0 CHADHO CC(C)CCN1CCC([NH2+][C@H](C)c2ccc(F)cc2)CC1 ZINC001207724454 1133842591 /nfs/dbraw/zinc/84/25/91/1133842591.db2.gz YHRFEEZALHDJHX-OAHLLOKOSA-N 1 3 292.442 3.987 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1CN1CCC([NH2+]C2CCC2)CC1 ZINC001207741754 1133843749 /nfs/dbraw/zinc/84/37/49/1133843749.db2.gz KIAXDVGNRSLJPQ-YJBOKZPZSA-N 1 3 276.468 3.585 20 0 CHADHO CC1=C[C@@H](C)[C@H](C[NH+]2CCC(N3CCCCC3)CC2)CC1 ZINC001208160157 1133889909 /nfs/dbraw/zinc/88/99/09/1133889909.db2.gz GBFJEJZIEXSJSU-MSOLQXFVSA-N 1 3 290.495 3.929 20 0 CHADHO CC1=C[C@@H](C)[C@H](CN2CCC([NH+]3CCCCC3)CC2)CC1 ZINC001208160157 1133889914 /nfs/dbraw/zinc/88/99/14/1133889914.db2.gz GBFJEJZIEXSJSU-MSOLQXFVSA-N 1 3 290.495 3.929 20 0 CHADHO C[C@H](CCN1CCC([NH+]2CCC2)CC1)CC(C)(C)C ZINC001208663400 1133924942 /nfs/dbraw/zinc/92/49/42/1133924942.db2.gz JXGNDLQQSVGAEJ-OAHLLOKOSA-N 1 3 266.473 3.619 20 0 CHADHO c1csc(C2CC[NH+](CCCN3CCCCC3)CC2)c1 ZINC001209449118 1134024726 /nfs/dbraw/zinc/02/47/26/1134024726.db2.gz SFBQZLDTSWGZTJ-UHFFFAOYSA-N 1 3 292.492 3.804 20 0 CHADHO CC(C)=CCC[C@@H](C)CN1CCC[C@]12CCC[NH2+]C2 ZINC001222231642 1135210929 /nfs/dbraw/zinc/21/09/29/1135210929.db2.gz OSWAKPFLMQYDIP-SJORKVTESA-N 1 3 264.457 3.587 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@@H+]1CCC[C@]12CCCNC2 ZINC001222231642 1135210921 /nfs/dbraw/zinc/21/09/21/1135210921.db2.gz OSWAKPFLMQYDIP-SJORKVTESA-N 1 3 264.457 3.587 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@H+]1CCC[C@]12CCCNC2 ZINC001222231642 1135210926 /nfs/dbraw/zinc/21/09/26/1135210926.db2.gz OSWAKPFLMQYDIP-SJORKVTESA-N 1 3 264.457 3.587 20 0 CHADHO CN1CC=C(C[NH2+][C@H](CC2CCC2)c2ccccc2)CC1 ZINC000344313629 530047519 /nfs/dbraw/zinc/04/75/19/530047519.db2.gz ZAWJNJUPKRHLNV-LJQANCHMSA-N 1 3 284.447 3.769 20 0 CHADHO CCCCN1CCCC2(CCC[N@H+](CCCC)C2)C1 ZINC000574322118 335010249 /nfs/dbraw/zinc/01/02/49/335010249.db2.gz KCBYJWWNBHGJDT-UHFFFAOYSA-N 1 3 266.473 3.765 20 0 CHADHO CCCCN1CCCC2(CCC[N@@H+](CCCC)C2)C1 ZINC000574322118 335010251 /nfs/dbraw/zinc/01/02/51/335010251.db2.gz KCBYJWWNBHGJDT-UHFFFAOYSA-N 1 3 266.473 3.765 20 0 CHADHO CC(C)CC1(C)CC[NH+](CCCN2CCCC2)CC1 ZINC000574363365 335013661 /nfs/dbraw/zinc/01/36/61/335013661.db2.gz YPEJYXQDCOARRZ-UHFFFAOYSA-N 1 3 266.473 3.621 20 0 CHADHO CC(C)CC1(C)CCN(CCC[NH+]2CCCC2)CC1 ZINC000574363365 335013662 /nfs/dbraw/zinc/01/36/62/335013662.db2.gz YPEJYXQDCOARRZ-UHFFFAOYSA-N 1 3 266.473 3.621 20 0 CHADHO CC1=C[C@H](C)C[C@@H](C[NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000575097990 335064844 /nfs/dbraw/zinc/06/48/44/335064844.db2.gz XKQZKZHWWZDCCM-DOTOQJQBSA-N 1 3 290.495 3.975 20 0 CHADHO CCC[NH+]1CCC(N[C@@H](CC)c2cccs2)CC1 ZINC000020190123 171057072 /nfs/dbraw/zinc/05/70/72/171057072.db2.gz VBPYCKAVQQWLQT-AWEZNQCLSA-N 1 3 266.454 3.663 20 0 CHADHO c1ccc2c(c1)CCCC[C@@H]2NCCC[NH+]1CCCC1 ZINC000020553037 171248044 /nfs/dbraw/zinc/24/80/44/171248044.db2.gz APIBGELLTQLWIX-SFHVURJKSA-N 1 3 272.436 3.530 20 0 CHADHO c1ccc2c(c1)CCCC[C@@H]2[NH2+]CCCN1CCCC1 ZINC000020553037 171248046 /nfs/dbraw/zinc/24/80/46/171248046.db2.gz APIBGELLTQLWIX-SFHVURJKSA-N 1 3 272.436 3.530 20 0 CHADHO CC1CCN(CCC[NH2+][C@H]2C[C@H](C)CC(C)(C)C2)CC1 ZINC000021047908 171294324 /nfs/dbraw/zinc/29/43/24/171294324.db2.gz XFGJVNOJFUFHTE-IRXDYDNUSA-N 1 3 280.500 3.913 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)c1cccs1)CN1CCCCC1 ZINC000038041733 174043083 /nfs/dbraw/zinc/04/30/83/174043083.db2.gz FCYDXHWALHDBEZ-KGLIPLIRSA-N 1 3 266.454 3.521 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccccc1 ZINC000575198364 335079901 /nfs/dbraw/zinc/07/99/01/335079901.db2.gz GMVWEXQZDJYYHX-SZMVWBNQSA-N 1 3 274.452 3.500 20 0 CHADHO C[C@H](c1ccc(F)c(Cl)c1)N1CCC[C@H](CC[NH3+])C1 ZINC000070169796 260152619 /nfs/dbraw/zinc/15/26/19/260152619.db2.gz JKLOVEUAEPAVKZ-VXGBXAGGSA-N 1 3 284.806 3.601 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1ccc(C(F)(F)F)cc1 ZINC000093213237 260272951 /nfs/dbraw/zinc/27/29/51/260272951.db2.gz RJEYASWRWPXBPC-LEWSCRJBSA-N 1 3 286.341 3.626 20 0 CHADHO Cc1ccc([C@@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1C ZINC000088163885 260280023 /nfs/dbraw/zinc/28/00/23/260280023.db2.gz SDEMAWLJCUNUSZ-BPIHKTFHSA-N 1 3 286.463 3.969 20 0 CHADHO Cc1ccc([C@@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1C ZINC000088163885 260280024 /nfs/dbraw/zinc/28/00/24/260280024.db2.gz SDEMAWLJCUNUSZ-BPIHKTFHSA-N 1 3 286.463 3.969 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2N[C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000093451297 260284248 /nfs/dbraw/zinc/28/42/48/260284248.db2.gz IXJZNJGXVSVDHH-YDZRNGNQSA-N 1 3 284.447 3.574 20 0 CHADHO CC(C)(CN[C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1)c1cccs1 ZINC000127589769 260369155 /nfs/dbraw/zinc/36/91/55/260369155.db2.gz NQJGNELQOXSAPI-QLFBSQMISA-N 1 3 292.492 3.536 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCN2CCC[C@@H]2C1)C1CCCCC1 ZINC000130248025 260394403 /nfs/dbraw/zinc/39/44/03/260394403.db2.gz AQMYUEGIVPUNSN-BBWFWOEESA-N 1 3 264.457 3.562 20 0 CHADHO Cc1cccc(CC[C@H](C)N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000130187656 260394712 /nfs/dbraw/zinc/39/47/12/260394712.db2.gz WGPFRQYEUVPRHV-QXAKKESOSA-N 1 3 286.463 3.533 20 0 CHADHO Cc1cccc(CC[C@H](C)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000130187656 260394713 /nfs/dbraw/zinc/39/47/13/260394713.db2.gz WGPFRQYEUVPRHV-QXAKKESOSA-N 1 3 286.463 3.533 20 0 CHADHO Cc1cccc(CC[C@H](C)[NH2+][C@@H]2CCN3CCC[C@@H]3C2)c1 ZINC000130187656 260394714 /nfs/dbraw/zinc/39/47/14/260394714.db2.gz WGPFRQYEUVPRHV-QXAKKESOSA-N 1 3 286.463 3.533 20 0 CHADHO CC(C)CC(CC(C)C)[NH2+][C@H]1CCN2CCC[C@@H]2C1 ZINC000130190129 260394887 /nfs/dbraw/zinc/39/48/87/260394887.db2.gz VIJHZOKCTOVOJG-DOTOQJQBSA-N 1 3 266.473 3.664 20 0 CHADHO CC(C)(C)C[C@H](NC[C@@H]1CCC[NH2+]C1)c1ccccc1 ZINC000130956393 260399593 /nfs/dbraw/zinc/39/95/93/260399593.db2.gz SDLQXNNVOHSQMG-WBVHZDCISA-N 1 3 274.452 3.753 20 0 CHADHO CC(C)(C)C[C@H]([NH2+]C[C@@H]1CCCNC1)c1ccccc1 ZINC000130956393 260399594 /nfs/dbraw/zinc/39/95/94/260399594.db2.gz SDLQXNNVOHSQMG-WBVHZDCISA-N 1 3 274.452 3.753 20 0 CHADHO CCC[C@@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1cccnc1 ZINC000185940832 262072742 /nfs/dbraw/zinc/07/27/42/262072742.db2.gz ZHWZZOGJRYDUFU-QGZVFWFLSA-N 1 3 289.467 3.775 20 0 CHADHO CC[NH+]1CCC(CCN[C@@H](C)c2sccc2OC)CC1 ZINC000186178216 262083312 /nfs/dbraw/zinc/08/33/12/262083312.db2.gz PNPONISZIPTLST-ZDUSSCGKSA-N 1 3 296.480 3.529 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCCC1)c1cccc2ccccc21 ZINC000021013046 262374045 /nfs/dbraw/zinc/37/40/45/262374045.db2.gz JOSIYBNCBJUMTC-MRXNPFEDSA-N 1 3 282.431 3.976 20 0 CHADHO C[C@@H](NCCC[NH+]1CCCC1)c1cccc2ccccc21 ZINC000021013046 262374047 /nfs/dbraw/zinc/37/40/47/262374047.db2.gz JOSIYBNCBJUMTC-MRXNPFEDSA-N 1 3 282.431 3.976 20 0 CHADHO c1cc2c(s1)CCC[C@@H]2[NH2+]CCCN1CCCCC1 ZINC000061325110 262394039 /nfs/dbraw/zinc/39/40/39/262394039.db2.gz RWDXAHGNASOAPE-HNNXBMFYSA-N 1 3 278.465 3.591 20 0 CHADHO CC[C@@H]([NH2+]C1CCN(C2CCCC2)CC1)[C@H]1CC1(C)C ZINC000414116365 262812085 /nfs/dbraw/zinc/81/20/85/262812085.db2.gz QRGCNSDKCMHIGR-IAGOWNOFSA-N 1 3 278.484 3.808 20 0 CHADHO CCN(Cc1ccc(Cl)c(C)c1)[C@@H]1CCC[NH2+]CC1 ZINC000414714719 263034111 /nfs/dbraw/zinc/03/41/11/263034111.db2.gz MGGULZYMDALRMN-OAHLLOKOSA-N 1 3 280.843 3.612 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H]([NH2+][C@@H]2CCCC[C@H]2CN)C1 ZINC000414803399 263051538 /nfs/dbraw/zinc/05/15/38/263051538.db2.gz NUSNOUACSVVXGH-KANFNMMFSA-N 1 3 286.463 3.604 20 0 CHADHO CCc1ccc(CNCc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000414809759 263052481 /nfs/dbraw/zinc/05/24/81/263052481.db2.gz NBAPSOGMCSRNJV-AWEZNQCLSA-N 1 3 268.404 3.559 20 0 CHADHO CCC([NH3+])(CC)CN[C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000414810412 263052919 /nfs/dbraw/zinc/05/29/19/263052919.db2.gz NVCRQLOFOBSCDS-IAGOWNOFSA-N 1 3 274.452 3.604 20 0 CHADHO C[C@H]([NH3+])c1ccc(CNCc2cc(F)cc(Cl)c2)cc1 ZINC000414816538 263054361 /nfs/dbraw/zinc/05/43/61/263054361.db2.gz PYULFXMIDJHINO-NSHDSACASA-N 1 3 292.785 3.789 20 0 CHADHO Clc1ccccc1[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCCNC1 ZINC000414829322 263056064 /nfs/dbraw/zinc/05/60/64/263056064.db2.gz NRBWMFXQTIEMDM-UKPHBRMFSA-N 1 3 292.854 3.565 20 0 CHADHO C[C@H]([NH2+]C1CCC(c2ccccc2)CC1)[C@@H]1CCCNC1 ZINC000414855002 263071657 /nfs/dbraw/zinc/07/16/57/263071657.db2.gz MOYKHYXMNYDPAX-WEOZKBJRSA-N 1 3 286.463 3.691 20 0 CHADHO C[C@H](CNCC1([NH3+])CCCCCC1)c1ccc(F)cc1 ZINC000414862001 263075493 /nfs/dbraw/zinc/07/54/93/263075493.db2.gz UHBJESYMBNQSPE-CQSZACIVSA-N 1 3 278.415 3.571 20 0 CHADHO N[C@H]1CCC[C@H]([NH2+]CC2CCC(c3ccccc3)CC2)C1 ZINC000414919388 263124044 /nfs/dbraw/zinc/12/40/44/263124044.db2.gz UROYYNVHCMRBAK-FYOYPEGLSA-N 1 3 286.463 3.820 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@@H]2c2ccc(Cl)cc2)C1 ZINC000414928133 263134506 /nfs/dbraw/zinc/13/45/06/263134506.db2.gz PWEMPLRMDAXYQO-TWMKSMIVSA-N 1 3 292.854 3.836 20 0 CHADHO C[C@H]1CNCC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2)s1 ZINC000414959639 263164866 /nfs/dbraw/zinc/16/48/66/263164866.db2.gz QALNFRAQGAQKHG-BBRMVZONSA-N 1 3 286.444 3.503 20 0 CHADHO Clc1oc2ccccc2c1CNCCC[C@@H]1CCC[NH2+]1 ZINC000414960046 263165438 /nfs/dbraw/zinc/16/54/38/263165438.db2.gz AADYDHUGZOZURR-GFCCVEGCSA-N 1 3 292.810 3.708 20 0 CHADHO [NH3+][C@H]1CCC[C@@H](CNCc2ccc(Cl)cc2Cl)C1 ZINC000414992510 263188936 /nfs/dbraw/zinc/18/89/36/263188936.db2.gz KORQASDGHBJVRG-MFKMUULPSA-N 1 3 287.234 3.601 20 0 CHADHO Cc1ccccc1C1(CN[C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)CC1 ZINC000415098974 263273492 /nfs/dbraw/zinc/27/34/92/263273492.db2.gz GHEUQXRWFDXJHW-BHIYHBOVSA-N 1 3 298.474 3.537 20 0 CHADHO Cc1ccccc1[C@@H](CC(C)C)N[C@@H]1CCC[NH2+]CC1 ZINC000415115606 263274100 /nfs/dbraw/zinc/27/41/00/263274100.db2.gz UGUITFRJCMFVOA-SJLPKXTDSA-N 1 3 274.452 3.814 20 0 CHADHO Cc1ccc([C@H](N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C2CC2)cc1 ZINC000157456331 264376103 /nfs/dbraw/zinc/37/61/03/264376103.db2.gz ZIGFLVWAWFEWRG-QRVBRYPASA-N 1 3 284.447 3.663 20 0 CHADHO Cc1ccc([C@H](N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)C2CC2)cc1 ZINC000157456331 264376105 /nfs/dbraw/zinc/37/61/05/264376105.db2.gz ZIGFLVWAWFEWRG-QRVBRYPASA-N 1 3 284.447 3.663 20 0 CHADHO CCCCN1CCC([NH2+][C@H](C)c2cc(F)cc(F)c2)CC1 ZINC000094826882 265259617 /nfs/dbraw/zinc/25/96/17/265259617.db2.gz CYWZOOHVZRCZER-CYBMUJFWSA-N 1 3 296.405 3.880 20 0 CHADHO CC[C@@H](NCC1(C)CC[NH+](C)CC1)c1ccc(F)cc1F ZINC000356832666 266183047 /nfs/dbraw/zinc/18/30/47/266183047.db2.gz FELLOAGMGHEHEH-MRXNPFEDSA-N 1 3 296.405 3.737 20 0 CHADHO CC[C@@H](NCC1(C)CC[NH+](C)CC1)c1cc(F)ccc1F ZINC000356836185 266184689 /nfs/dbraw/zinc/18/46/89/266184689.db2.gz HCOGFLYKYBLZKV-MRXNPFEDSA-N 1 3 296.405 3.737 20 0 CHADHO C1CC12CCC([NH2+]C1CCN(C3CCCC3)CC1)CC2 ZINC000362922775 267061560 /nfs/dbraw/zinc/06/15/60/267061560.db2.gz FUNDDIGOJVVXCL-UHFFFAOYSA-N 1 3 276.468 3.706 20 0 CHADHO CC(C)[NH2+]CCCN[C@@H]1C[C@H](c2ccccc2)C1(C)C ZINC000580062375 327687185 /nfs/dbraw/zinc/68/71/85/327687185.db2.gz QCDASIZLFUVKQI-IAGOWNOFSA-N 1 3 274.452 3.546 20 0 CHADHO CC(C)Cc1ccc([C@H](C)[NH2+][C@H]2CCNC[C@@H]2C)cc1 ZINC000261683796 328006119 /nfs/dbraw/zinc/00/61/19/328006119.db2.gz GZCPOIBJENGWCQ-MPGHIAIKSA-N 1 3 274.452 3.534 20 0 CHADHO CC(C)(C)N1CCC([NH2+][C@H](c2ccccc2)C2CC2)CC1 ZINC000041075745 328026574 /nfs/dbraw/zinc/02/65/74/328026574.db2.gz WOZLROFMDVCLHQ-GOSISDBHSA-N 1 3 286.463 3.990 20 0 CHADHO CC(C)(C)[NH+]1CCC(N[C@H](c2ccccc2)C2CC2)CC1 ZINC000041075745 328026576 /nfs/dbraw/zinc/02/65/76/328026576.db2.gz WOZLROFMDVCLHQ-GOSISDBHSA-N 1 3 286.463 3.990 20 0 CHADHO C[NH+](C)CC[C@@H](N[C@@H]1CCc2ccccc21)C(C)(C)C ZINC000531714904 328027999 /nfs/dbraw/zinc/02/79/99/328027999.db2.gz RLXUEMGNKJXHKX-IAGOWNOFSA-N 1 3 274.452 3.630 20 0 CHADHO C[C@H]1C[C@H]([NH3+])CCN1Cc1cccc(-c2ccccc2)c1 ZINC000571578190 328134728 /nfs/dbraw/zinc/13/47/28/328134728.db2.gz GKKVZHHZFNPFOA-HNAYVOBHSA-N 1 3 280.415 3.665 20 0 CHADHO C[C@@H]1C[C@@H]([NH3+])CCN1Cc1cccc(-c2ccccc2)c1 ZINC000571578184 328134762 /nfs/dbraw/zinc/13/47/62/328134762.db2.gz GKKVZHHZFNPFOA-BEFAXECRSA-N 1 3 280.415 3.665 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1NCc1cc2ccccc2s1 ZINC000268796421 328186179 /nfs/dbraw/zinc/18/61/79/328186179.db2.gz IKZLYWXIZNZKEZ-DVOMOZLQSA-N 1 3 288.460 3.720 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1NCc1cc2ccccc2s1 ZINC000268796421 328186181 /nfs/dbraw/zinc/18/61/81/328186181.db2.gz IKZLYWXIZNZKEZ-DVOMOZLQSA-N 1 3 288.460 3.720 20 0 CHADHO C[N@H+]([C@H]1CC[C@@](C)(c2ccccc2)C1)[C@@H]1CCCNCC1 ZINC000414754737 328220374 /nfs/dbraw/zinc/22/03/74/328220374.db2.gz SCZHGSWZSQHRDX-CEXWTWQISA-N 1 3 286.463 3.571 20 0 CHADHO C[N@@H+]([C@H]1CC[C@@](C)(c2ccccc2)C1)[C@@H]1CCCNCC1 ZINC000414754737 328220375 /nfs/dbraw/zinc/22/03/75/328220375.db2.gz SCZHGSWZSQHRDX-CEXWTWQISA-N 1 3 286.463 3.571 20 0 CHADHO CC(C)[C@H]([NH3+])CN[C@@H]1CCC[C@@H]1c1ccccc1Cl ZINC000414789135 328225760 /nfs/dbraw/zinc/22/57/60/328225760.db2.gz FBKWTFCMBGRBPM-FVQBIDKESA-N 1 3 280.843 3.549 20 0 CHADHO C[C@H]([NH3+])c1ccc(CNCc2ccc(Cl)c(F)c2)cc1 ZINC000414802531 328231197 /nfs/dbraw/zinc/23/11/97/328231197.db2.gz BVTJKXQNTCGLEY-NSHDSACASA-N 1 3 292.785 3.789 20 0 CHADHO C[C@@H](CC[NH+](C)C)N[C@@H](C)c1cccc(C2CC2)c1 ZINC000340208690 328247869 /nfs/dbraw/zinc/24/78/69/328247869.db2.gz FYQHBKVCUNDEMK-KBPBESRZSA-N 1 3 260.425 3.555 20 0 CHADHO [NH3+][C@H]1CCC[C@@H](CNCc2cc(Cl)ccc2Cl)C1 ZINC000414998966 328292412 /nfs/dbraw/zinc/29/24/12/328292412.db2.gz RFKYXFFTXJKCFR-MFKMUULPSA-N 1 3 287.234 3.601 20 0 CHADHO C[C@@H](NCc1ccc(C[NH3+])cc1)c1cc2c(s1)CCC2 ZINC000583565436 328616271 /nfs/dbraw/zinc/61/62/71/328616271.db2.gz QNTBONIKAATSEH-GFCCVEGCSA-N 1 3 286.444 3.546 20 0 CHADHO C[C@H](N)[C@H](C)[NH2+]Cc1ccc(Sc2ccccc2)cc1 ZINC000415011850 328298800 /nfs/dbraw/zinc/29/88/00/328298800.db2.gz IPBHRSGQBKFVJN-KBPBESRZSA-N 1 3 286.444 3.663 20 0 CHADHO C[C@@H]1Cc2ccccc2[C@@H]1NCc1ccc(C[NH+](C)C)cc1 ZINC000111410926 328354585 /nfs/dbraw/zinc/35/45/85/328354585.db2.gz CWRVUUXHIQGKMF-FOIQADDNSA-N 1 3 294.442 3.771 20 0 CHADHO C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]Cc1ccc(CN(C)C)cc1 ZINC000111410926 328354586 /nfs/dbraw/zinc/35/45/86/328354586.db2.gz CWRVUUXHIQGKMF-FOIQADDNSA-N 1 3 294.442 3.771 20 0 CHADHO Cc1cc(C)cc(C[NH2+]CCCN2CCC(C)CC2)c1 ZINC000049900850 328381316 /nfs/dbraw/zinc/38/13/16/328381316.db2.gz BRXWKCWSHIFMNF-UHFFFAOYSA-N 1 3 274.452 3.515 20 0 CHADHO C1CC1[C@@H]1CC[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000558241313 327080791 /nfs/dbraw/zinc/08/07/91/327080791.db2.gz NSKAELOJOURVIK-ZWKOTPCHSA-N 1 3 276.468 3.562 20 0 CHADHO CCCC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000558419117 327092610 /nfs/dbraw/zinc/09/26/10/327092610.db2.gz IAYGWNXIBULGGZ-BRWVUGGUSA-N 1 3 266.473 3.665 20 0 CHADHO CCCOc1ccc([C@@H](C)NCc2ccc(C[NH3+])cc2)cc1 ZINC000569847141 327551345 /nfs/dbraw/zinc/55/13/45/327551345.db2.gz CSDGMDUQLRCWEW-OAHLLOKOSA-N 1 3 298.430 3.785 20 0 CHADHO CC(C)C[C@@H](C)C[NH2+]C1CCN(CC2CCCC2)CC1 ZINC000570485305 327595392 /nfs/dbraw/zinc/59/53/92/327595392.db2.gz WFTPXHSPKOMZIU-MRXNPFEDSA-N 1 3 280.500 3.913 20 0 CHADHO CCCN1CC[C@H](C[NH2+]CC[C@@H](C)c2ccccc2)C1 ZINC000194261374 329080436 /nfs/dbraw/zinc/08/04/36/329080436.db2.gz UVQNXENBKAEVQT-IAGOWNOFSA-N 1 3 274.452 3.502 20 0 CHADHO CC[C@@H]1CCC[C@H](C[NH2+]C[C@H]2CCN(C(C)C)C2)C1 ZINC000394505775 329124389 /nfs/dbraw/zinc/12/43/89/329124389.db2.gz GIRWECUMJCKKRF-IXDOHACOSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@@H]1CCCC[C@@H]1C[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000394863726 329158449 /nfs/dbraw/zinc/15/84/49/329158449.db2.gz RVYWCVJNJDMTSM-ZIAGYGMSSA-N 1 3 266.473 3.712 20 0 CHADHO CC(C)CN1CCC([NH2+][C@@H](C)c2ccsc2)CC1 ZINC000177836929 329192831 /nfs/dbraw/zinc/19/28/31/329192831.db2.gz SOUVSRJLNXJQGZ-ZDUSSCGKSA-N 1 3 266.454 3.519 20 0 CHADHO c1ccc2c(c1)CN(CC1CC[NH2+]CC1)Cc1ccccc1-2 ZINC000178971647 329203462 /nfs/dbraw/zinc/20/34/62/329203462.db2.gz GZUHFEASVQYAIZ-UHFFFAOYSA-N 1 3 292.426 3.669 20 0 CHADHO Clc1ccc([C@H](NC[C@H]2CC[NH2+]C2)C2CCCC2)cc1 ZINC000420406854 329764171 /nfs/dbraw/zinc/76/41/71/329764171.db2.gz OCICXRYFYIDPQV-SUMWQHHRSA-N 1 3 292.854 3.770 20 0 CHADHO CCN(C)C[C@@H]1CC[N@@H+]([C@H](C)c2ccc3c(c2)CCC3)C1 ZINC000445403226 330110990 /nfs/dbraw/zinc/11/09/90/330110990.db2.gz MNPHHXDUKMVVEZ-CVEARBPZSA-N 1 3 286.463 3.510 20 0 CHADHO CCN(C)C[C@@H]1CC[N@H+]([C@H](C)c2ccc3c(c2)CCC3)C1 ZINC000445403226 330110992 /nfs/dbraw/zinc/11/09/92/330110992.db2.gz MNPHHXDUKMVVEZ-CVEARBPZSA-N 1 3 286.463 3.510 20 0 CHADHO CC(C)Sc1ccc([C@H](C)[NH2+]C2CCNCC2)cc1 ZINC000422711664 330151483 /nfs/dbraw/zinc/15/14/83/330151483.db2.gz HIAYPMYAXTWUNC-ZDUSSCGKSA-N 1 3 278.465 3.590 20 0 CHADHO Cc1ccc(CCN[C@@H]2C[C@@H]([NH3+])c3ccccc32)c(C)c1 ZINC000422707620 330151526 /nfs/dbraw/zinc/15/15/26/330151526.db2.gz WSNYVOYWKGJWRI-RTBURBONSA-N 1 3 280.415 3.580 20 0 CHADHO CC(C)Oc1ccc(CC[C@@H](C)[NH2+][C@H](C)C[C@H](C)N)cc1 ZINC000422717277 330151670 /nfs/dbraw/zinc/15/16/70/330151670.db2.gz KMHBIGMXIGVRST-ARFHVFGLSA-N 1 3 292.467 3.510 20 0 CHADHO CCc1ccc([C@H](NC2C[C@H]3CC[C@@H](C2)[NH2+]3)C(C)C)cc1 ZINC000422761148 330154046 /nfs/dbraw/zinc/15/40/46/330154046.db2.gz HFJQKHDVEURLNO-ZZJWQFMZSA-N 1 3 286.463 3.819 20 0 CHADHO c1ccc([C@H](N[C@H]2CCC[NH2+]CC2)C2CCCC2)cc1 ZINC000422782776 330154843 /nfs/dbraw/zinc/15/48/43/330154843.db2.gz MHBUOGXEZQYWAH-ROUUACIJSA-N 1 3 272.436 3.650 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC[C@@H]1CCC[C@H](C)C1 ZINC000422744494 330155238 /nfs/dbraw/zinc/15/52/38/330155238.db2.gz KCKOCKHLYNVJBM-DZKIICNBSA-N 1 3 289.467 3.716 20 0 CHADHO Cc1cc(C)cc(CCN[C@H]2C[C@H]([NH3+])c3ccccc32)c1 ZINC000422794267 330155703 /nfs/dbraw/zinc/15/57/03/330155703.db2.gz YYHIGYQZHSRSSD-OALUTQOASA-N 1 3 280.415 3.580 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NCC2(c3ccccc3)CCC2)c2ccccc21 ZINC000422803605 330155891 /nfs/dbraw/zinc/15/58/91/330155891.db2.gz CZHXWVCZLOVPCB-RTBURBONSA-N 1 3 292.426 3.843 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H]1CCC(C)(C)C[C@H]1C ZINC000422816455 330156145 /nfs/dbraw/zinc/15/61/45/330156145.db2.gz FGWXVQDHICBMEX-IFIJOSMWSA-N 1 3 289.467 3.714 20 0 CHADHO CCS[C@@H]1CCC[C@H](N[C@H]2C[C@H]([NH3+])c3ccccc32)C1 ZINC000422818402 330156213 /nfs/dbraw/zinc/15/62/13/330156213.db2.gz KHUMKGCWUFGTCM-RMHZUWNSSA-N 1 3 290.476 3.785 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H](C)[C@@H](C)c1ccccc1 ZINC000422817710 330156252 /nfs/dbraw/zinc/15/62/52/330156252.db2.gz DUTJQQCPEDKKSW-KFWWJZLASA-N 1 3 297.446 3.692 20 0 CHADHO C[C@H](N[C@@H]1C[C@@H]([NH3+])c2ccccc21)[C@@H](C)c1ccccc1 ZINC000422818284 330156320 /nfs/dbraw/zinc/15/63/20/330156320.db2.gz FZXLJOACPQRDIZ-GTYSZEQSSA-N 1 3 280.415 3.913 20 0 CHADHO C[C@H](CN[C@@H]1CCC[C@@H]1[NH3+])c1c(Cl)cccc1Cl ZINC000422879287 330158802 /nfs/dbraw/zinc/15/88/02/330158802.db2.gz MDMVRRXRKXYKPC-JIMOISOXSA-N 1 3 287.234 3.566 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C1CCC(C(C)C)CC1 ZINC000422890017 330159229 /nfs/dbraw/zinc/15/92/29/330159229.db2.gz HKBCZNLCTOMPDA-IUDNXUCKSA-N 1 3 289.467 3.714 20 0 CHADHO NC[C@@H]1CCC[C@H]1[NH2+]CCc1cccc(-c2ccccc2)c1 ZINC000422887941 330159248 /nfs/dbraw/zinc/15/92/48/330159248.db2.gz LSRAMLLUBDQCPU-VQTJNVASSA-N 1 3 294.442 3.613 20 0 CHADHO Cc1cccc(C2(C[NH2+][C@H](C)C[C@@H](C)N)CCCC2)c1 ZINC000422909421 330159830 /nfs/dbraw/zinc/15/98/30/330159830.db2.gz NZPBCNOQEDKEHO-HZPDHXFCSA-N 1 3 274.452 3.522 20 0 CHADHO Cc1cccc(C2(CN[C@H](C)C[C@@H](C)[NH3+])CCCC2)c1 ZINC000422909421 330159832 /nfs/dbraw/zinc/15/98/32/330159832.db2.gz NZPBCNOQEDKEHO-HZPDHXFCSA-N 1 3 274.452 3.522 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@@H]1C ZINC000422927645 330160753 /nfs/dbraw/zinc/16/07/53/330160753.db2.gz ZKRDKFFOYWLDBF-PVIIJVKYSA-N 1 3 280.843 3.753 20 0 CHADHO NC[C@H]1CCCC[C@H]1[NH2+]CC1(Cc2ccccc2)CCC1 ZINC000422927917 330160983 /nfs/dbraw/zinc/16/09/83/330160983.db2.gz HUOYCGNOWHAJRD-QZTJIDSGSA-N 1 3 286.463 3.507 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@@H]1NCCc1csc2ccccc12 ZINC000422931941 330161092 /nfs/dbraw/zinc/16/10/92/330161092.db2.gz DFEXPWTUFFBRGH-CVEARBPZSA-N 1 3 288.460 3.693 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+][C@@H](C)C(c1ccccc1)c1ccccc1 ZINC000422934095 330161219 /nfs/dbraw/zinc/16/12/19/330161219.db2.gz FHGUYWWUKMLJBN-BBWFWOEESA-N 1 3 296.458 3.922 20 0 CHADHO [NH3+][C@@H]1C[C@H](NC2(Cc3ccccc3)CCC2)c2ccccc21 ZINC000422956428 330163973 /nfs/dbraw/zinc/16/39/73/330163973.db2.gz LEPGZXWLVBGTLC-MOPGFXCFSA-N 1 3 292.426 3.886 20 0 CHADHO CC[C@H](CSc1ccc(C)c(C)c1)NC1CC[NH2+]CC1 ZINC000423004870 330164956 /nfs/dbraw/zinc/16/49/56/330164956.db2.gz QBKYOMSFPRIOTD-OAHLLOKOSA-N 1 3 292.492 3.516 20 0 CHADHO CC[C@H](CSc1ccc(C)c(C)c1)[NH2+]C1CCNCC1 ZINC000423004870 330164958 /nfs/dbraw/zinc/16/49/58/330164958.db2.gz QBKYOMSFPRIOTD-OAHLLOKOSA-N 1 3 292.492 3.516 20 0 CHADHO CC(C)CSCCC[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCCN1 ZINC000423016825 330165469 /nfs/dbraw/zinc/16/54/69/330165469.db2.gz UQYKOSDDXXQLFF-GVDBMIGSSA-N 1 3 298.540 3.666 20 0 CHADHO C[C@H]1CCCc2ccccc2[C@@H]1NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423048071 330167033 /nfs/dbraw/zinc/16/70/33/330167033.db2.gz IDLNKUPMRKNEQP-UUMNEFNHSA-N 1 3 284.447 3.573 20 0 CHADHO CC(C)c1ccc2c(c1)[C@H](N[C@@H](C)C[C@H](C)[NH3+])CC2 ZINC000423065860 330168178 /nfs/dbraw/zinc/16/81/78/330168178.db2.gz VJJBNOLNNDIVDF-GDZNZVCISA-N 1 3 260.425 3.513 20 0 CHADHO c1ccc([C@H]2CCC[C@H](NC3C[C@H]4CC[C@@H](C3)[NH2+]4)C2)cc1 ZINC000423078101 330168526 /nfs/dbraw/zinc/16/85/26/330168526.db2.gz NTRVGNUXINWLHM-ZWKKMZQASA-N 1 3 284.447 3.585 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000423084389 330168716 /nfs/dbraw/zinc/16/87/16/330168716.db2.gz HYGTVMLXMNQVQG-FZCLSBEQSA-N 1 3 290.426 3.569 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000423084393 330168719 /nfs/dbraw/zinc/16/87/19/330168719.db2.gz HYGTVMLXMNQVQG-ONIAQPFYSA-N 1 3 290.426 3.569 20 0 CHADHO N[C@@H]1C[C@@H]([NH2+][C@H]2C[C@H](c3ccccc3F)C2)c2ccccc21 ZINC000423093539 330169348 /nfs/dbraw/zinc/16/93/48/330169348.db2.gz HXLUBQNQBWOBBM-YTFOQLDISA-N 1 3 296.389 3.806 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000423092885 330169514 /nfs/dbraw/zinc/16/95/14/330169514.db2.gz DTQOHWNRDXBDIJ-ONIAQPFYSA-N 1 3 290.426 3.569 20 0 CHADHO CC(C)[C@@H](C[NH2+][C@@H](C)C[C@H](C)N)c1ccc(Cl)cc1 ZINC000423099073 330170209 /nfs/dbraw/zinc/17/02/09/330170209.db2.gz AGAJPGMJBCBPHB-HEHGZKQESA-N 1 3 282.859 3.795 20 0 CHADHO CC(F)(F)c1ccc(C[NH2+][C@H]2CCCCC[C@H]2N)cc1 ZINC000423127294 330171646 /nfs/dbraw/zinc/17/16/46/330171646.db2.gz BUGZWXFMFLAHQV-CABCVRRESA-N 1 3 282.378 3.548 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](C)c1ccc(F)c2ccccc21 ZINC000423132425 330171893 /nfs/dbraw/zinc/17/18/93/330171893.db2.gz UNZQJEGVSSQPTK-XQQFMLRXSA-N 1 3 274.383 3.755 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]C1(Cc2ccc(Cl)cc2)CCC1 ZINC000423136552 330172172 /nfs/dbraw/zinc/17/21/72/330172172.db2.gz VGUVFNIJINQWJL-STQMWFEESA-N 1 3 280.843 3.521 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NC1(Cc2ccc(Cl)cc2)CCC1 ZINC000423136552 330172173 /nfs/dbraw/zinc/17/21/73/330172173.db2.gz VGUVFNIJINQWJL-STQMWFEESA-N 1 3 280.843 3.521 20 0 CHADHO CC(C)=CCC[C@H](C)[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000423152171 330173040 /nfs/dbraw/zinc/17/30/40/330173040.db2.gz DSWVYVAQRWPAKQ-UONOGXRCSA-N 1 3 275.440 3.634 20 0 CHADHO C[C@H]([NH2+]C1CCNCC1)c1cccc(-c2ccccc2)c1 ZINC000423175695 330174709 /nfs/dbraw/zinc/17/47/09/330174709.db2.gz ATKNSZNGPRBLKB-HNNXBMFYSA-N 1 3 280.415 3.756 20 0 CHADHO Cc1ccccc1COc1ccc([C@@H](C)NCCC[NH3+])cc1 ZINC000423174534 330174785 /nfs/dbraw/zinc/17/47/85/330174785.db2.gz AWVCASKLQQVHCF-MRXNPFEDSA-N 1 3 298.430 3.573 20 0 CHADHO C[C@H](N[C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1)[C@@H]1CC[NH2+]C1 ZINC000423175852 330174816 /nfs/dbraw/zinc/17/48/16/330174816.db2.gz FKVHMTXMFYOIRR-DPAVQSFQSA-N 1 3 292.854 3.564 20 0 CHADHO Cc1cc([C@@H](C)[NH2+]CC2(N)CCCCC2)c(C)s1 ZINC000423174544 330174910 /nfs/dbraw/zinc/17/49/10/330174910.db2.gz AZEVNUXEXMKTRN-GFCCVEGCSA-N 1 3 266.454 3.677 20 0 CHADHO C[C@@H](NCC1([NH3+])CCCCC1)C(C)(C)c1ccccc1 ZINC000423177819 330175194 /nfs/dbraw/zinc/17/51/94/330175194.db2.gz JQAKSHUPSMRNRK-OAHLLOKOSA-N 1 3 274.452 3.604 20 0 CHADHO CC(C)[C@@H](NCCC[NH3+])c1ccc(Cl)c(Cl)c1 ZINC000423182762 330175509 /nfs/dbraw/zinc/17/55/09/330175509.db2.gz HDGBDWARRRMYFF-CYBMUJFWSA-N 1 3 275.223 3.629 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H]1CCC[C@H]1C(C)(C)C ZINC000423194622 330176325 /nfs/dbraw/zinc/17/63/25/330176325.db2.gz WYLYRVOYKCLFFM-XKQJLSEDSA-N 1 3 289.467 3.714 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2N[C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000423211849 330177952 /nfs/dbraw/zinc/17/79/52/330177952.db2.gz HLBFDCNLNUOJNU-ANQUJSFKSA-N 1 3 272.436 3.521 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+][C@H](C)[C@@H]1CCCNC1 ZINC000423211849 330177953 /nfs/dbraw/zinc/17/79/53/330177953.db2.gz HLBFDCNLNUOJNU-ANQUJSFKSA-N 1 3 272.436 3.521 20 0 CHADHO C[C@H](N)CC[NH2+][C@@H]1CCC[C@@H](c2ccc(Cl)cc2)C1 ZINC000423225571 330180082 /nfs/dbraw/zinc/18/00/82/330180082.db2.gz NGOUJUZLJLTDAA-JGGQBBKZSA-N 1 3 280.843 3.693 20 0 CHADHO C[C@H]([NH3+])CCN[C@@H](C)c1ccc(-c2ccc(F)cc2)s1 ZINC000423228791 330180346 /nfs/dbraw/zinc/18/03/46/330180346.db2.gz FEQVRVLGRSUXJH-RYUDHWBXSA-N 1 3 292.423 3.942 20 0 CHADHO CCCCCOc1ccc([C@H](C)NCC[C@H](C)[NH3+])cc1 ZINC000423232466 330180713 /nfs/dbraw/zinc/18/07/13/330180713.db2.gz MRTRUYLPNGAJMK-GJZGRUSLSA-N 1 3 278.440 3.644 20 0 CHADHO C[C@H]1C[C@H](N[C@H]2CCCC[C@H]2C[NH3+])c2ccsc2S1 ZINC000423277508 330185094 /nfs/dbraw/zinc/18/50/94/330185094.db2.gz OICFXBWNACDWCG-IMIFBBOLSA-N 1 3 296.505 3.781 20 0 CHADHO CCC[C@H](N[C@@H]1CCCC[C@@H]1C[NH3+])c1ccsc1 ZINC000423279921 330185321 /nfs/dbraw/zinc/18/53/21/330185321.db2.gz SBZOYXAIKAJQJF-VHDGCEQUSA-N 1 3 266.454 3.696 20 0 CHADHO CNC[C@H](C)C[NH2+][C@@H](C)C(c1ccccc1)c1ccccc1 ZINC000423284018 330185679 /nfs/dbraw/zinc/18/56/79/330185679.db2.gz XXWPQZAFUDZCGM-IRXDYDNUSA-N 1 3 296.458 3.652 20 0 CHADHO C[NH2+]C[C@H](C)CN[C@@H](C)C(c1ccccc1)c1ccccc1 ZINC000423284018 330185680 /nfs/dbraw/zinc/18/56/80/330185680.db2.gz XXWPQZAFUDZCGM-IRXDYDNUSA-N 1 3 296.458 3.652 20 0 CHADHO C[C@H](N[C@@H]1CCCC[C@H]1C[NH3+])c1ccc(F)c(Cl)c1 ZINC000423281983 330185700 /nfs/dbraw/zinc/18/57/00/330185700.db2.gz VQMQTKNROHZYPG-ITDIGPHOSA-N 1 3 284.806 3.647 20 0 CHADHO C[C@H]([NH2+]CC(C)(C)N)c1ccc(-c2cccs2)cc1 ZINC000423283872 330185717 /nfs/dbraw/zinc/18/57/17/330185717.db2.gz FSQMBEZTOYXPJM-LBPRGKRZSA-N 1 3 274.433 3.803 20 0 CHADHO CC(C)(N)C[NH2+][C@H](c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000423288155 330186224 /nfs/dbraw/zinc/18/62/24/330186224.db2.gz QTIPDXMVOYYIEW-ZDUSSCGKSA-N 1 3 287.234 3.771 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2c3ccccc3C[C@@H]2C)cc1 ZINC000423289887 330186401 /nfs/dbraw/zinc/18/64/01/330186401.db2.gz BWGSVFWXVDWCGK-NJSLBKSFSA-N 1 3 280.415 3.729 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2c3ccccc3C[C@H]2C)cc1 ZINC000423289888 330186627 /nfs/dbraw/zinc/18/66/27/330186627.db2.gz BWGSVFWXVDWCGK-TYILLQQXSA-N 1 3 280.415 3.729 20 0 CHADHO CCC[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1cccnc1 ZINC000423290868 330186754 /nfs/dbraw/zinc/18/67/54/330186754.db2.gz FTCNLZMILIOMLO-KBXCAEBGSA-N 1 3 283.419 3.732 20 0 CHADHO CCC([NH3+])(CC)CN[C@H]1C[C@H](c2ccccc2)C1(C)C ZINC000423290356 330186819 /nfs/dbraw/zinc/18/68/19/330186819.db2.gz ZTYMNNZRUHHIGI-CVEARBPZSA-N 1 3 274.452 3.676 20 0 CHADHO CCC(N)(CC)C[NH2+][C@@H]1CCCc2c3ccccc3[nH]c21 ZINC000423290531 330186935 /nfs/dbraw/zinc/18/69/35/330186935.db2.gz DJJXRHUSAFOTMD-MRXNPFEDSA-N 1 3 285.435 3.652 20 0 CHADHO CCCC[C@H](CN)[NH2+][C@H](C)c1cc2ccccc2o1 ZINC000423297983 330188563 /nfs/dbraw/zinc/18/85/63/330188563.db2.gz MQADDLXJPRUWDM-TZMCWYRMSA-N 1 3 260.381 3.601 20 0 CHADHO Cc1ccsc1[C@H](Cc1ccccc1)NC[C@@H](C)C[NH3+] ZINC000423303055 330188884 /nfs/dbraw/zinc/18/88/84/330188884.db2.gz WMFPCHHDOXFEQD-BBRMVZONSA-N 1 3 288.460 3.525 20 0 CHADHO Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]C[C@@H](C)CN ZINC000423303055 330188886 /nfs/dbraw/zinc/18/88/86/330188886.db2.gz WMFPCHHDOXFEQD-BBRMVZONSA-N 1 3 288.460 3.525 20 0 CHADHO C[C@H](C[NH3+])CN[C@H](C)c1cccc(OCc2ccccc2)c1 ZINC000423304625 330189311 /nfs/dbraw/zinc/18/93/11/330189311.db2.gz ZGSBGIQXMZWCFK-HZPDHXFCSA-N 1 3 298.430 3.511 20 0 CHADHO C[C@H]([NH2+]C[C@H](N)C1CC1)c1ccc(-c2ccccc2)s1 ZINC000423314446 330189756 /nfs/dbraw/zinc/18/97/56/330189756.db2.gz HGTWBMVXYHFZMS-WFASDCNBSA-N 1 3 286.444 3.803 20 0 CHADHO C[C@@H]([NH2+]C[C@@H](N)C1CC1)c1ccc(-c2ccccc2)cc1 ZINC000423320763 330190364 /nfs/dbraw/zinc/19/03/64/330190364.db2.gz MPTVAJWURFOCEH-AUUYWEPGSA-N 1 3 280.415 3.742 20 0 CHADHO CC(C)[C@@H](NCC1=CC[NH2+]CC1)c1ccc(Cl)cc1F ZINC000423334787 330191516 /nfs/dbraw/zinc/19/15/16/330191516.db2.gz FYOPXAHBPBHLMR-MRXNPFEDSA-N 1 3 296.817 3.686 20 0 CHADHO CC(C)[C@@H](CCc1ccccc1)[NH2+]C[C@]1(C)CCCNC1 ZINC000423338857 330191717 /nfs/dbraw/zinc/19/17/17/330191717.db2.gz UZSFKSFDVGBHHD-RTBURBONSA-N 1 3 288.479 3.623 20 0 CHADHO CCc1c2ccccc2oc1[C@H](C)NCC1=CC[NH2+]CC1 ZINC000423337868 330191871 /nfs/dbraw/zinc/19/18/71/330191871.db2.gz HSWFYTQUKBZDNY-ZDUSSCGKSA-N 1 3 284.403 3.566 20 0 CHADHO C[C@@H](NCC1=CC[NH2+]CC1)c1ccc(-c2cccs2)cc1 ZINC000423346787 330192583 /nfs/dbraw/zinc/19/25/83/330192583.db2.gz PPSOLNGUATUVDD-CQSZACIVSA-N 1 3 298.455 3.985 20 0 CHADHO c1cc2c(s1)CCC[C@H]2NCc1ccc2c(c1)C[NH2+]C2 ZINC000423357948 330193275 /nfs/dbraw/zinc/19/32/75/330193275.db2.gz MQKJWCGYZWACLT-MRXNPFEDSA-N 1 3 284.428 3.519 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@@H](Cc2ccccc2Cl)C2CC2)C1 ZINC000423360970 330193741 /nfs/dbraw/zinc/19/37/41/330193741.db2.gz GILUCECUHZKJHF-VYDXJSESSA-N 1 3 292.854 3.521 20 0 CHADHO CC(C)=CCC[C@H](C)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423360336 330193784 /nfs/dbraw/zinc/19/37/84/330193784.db2.gz QLMMTYTYXRNZAP-AWEZNQCLSA-N 1 3 258.409 3.514 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1cc2ccccc2s1 ZINC000423363443 330193954 /nfs/dbraw/zinc/19/39/54/330193954.db2.gz IYWMPFQPMKCWNH-FPMFFAJLSA-N 1 3 274.433 3.822 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H](CC2CCC2)c2ccccc2)CCN1 ZINC000423362906 330193972 /nfs/dbraw/zinc/19/39/72/330193972.db2.gz ABJFTNIAMMHJLE-OLMNPRSZSA-N 1 3 272.436 3.648 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CC2)CCN1 ZINC000423363056 330194103 /nfs/dbraw/zinc/19/41/03/330194103.db2.gz AHCGVYIYKWSBBS-RLCCDNCMSA-N 1 3 278.827 3.521 20 0 CHADHO CCC[C@H]([NH2+][C@@H]1CCNC[C@@H]1C)c1ccc(Cl)cc1 ZINC000423363922 330194206 /nfs/dbraw/zinc/19/42/06/330194206.db2.gz CDEDSFXDBGZPNU-MAZHCROVSA-N 1 3 280.843 3.769 20 0 CHADHO CCC[C@H]([NH2+][C@@H]1CCC[C@H](N)C1)C1CCCCC1 ZINC000423363725 330194248 /nfs/dbraw/zinc/19/42/48/330194248.db2.gz AGKKMXZKUSUKNC-XHSDSOJGSA-N 1 3 252.446 3.595 20 0 CHADHO CCOc1ccc([C@@H](C)NCc2ccc3c(c2)C[NH2+]C3)cc1 ZINC000423364348 330194404 /nfs/dbraw/zinc/19/44/04/330194404.db2.gz VPHGOMWDNBIPDH-CQSZACIVSA-N 1 3 296.414 3.539 20 0 CHADHO CC(C)[C@@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)CNC3)C1 ZINC000423364494 330194418 /nfs/dbraw/zinc/19/44/18/330194418.db2.gz AULXNIPPYBPDAF-CRAIPNDOSA-N 1 3 272.436 3.594 20 0 CHADHO C[C@@H](NCC[C@H]1CCC[NH2+]1)[C@@H](C)c1ccc(Cl)cc1 ZINC000423365921 330194602 /nfs/dbraw/zinc/19/46/02/330194602.db2.gz WXCJYTCXPLILFH-XJKCOSOUSA-N 1 3 280.843 3.564 20 0 CHADHO c1ccc([C@H]2CCC[C@@H]2[NH2+]Cc2ccc3c(c2)CNC3)cc1 ZINC000423366030 330194716 /nfs/dbraw/zinc/19/47/16/330194716.db2.gz BLORQOFQQRKUQP-UXHICEINSA-N 1 3 292.426 3.716 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@@H](CC2CC2)c2ccc(Cl)cc2)CCN1 ZINC000423367820 330194755 /nfs/dbraw/zinc/19/47/55/330194755.db2.gz AQPVXLBDOJAQDM-DQYPLSBCSA-N 1 3 292.854 3.911 20 0 CHADHO CCCC[C@H]([NH2+][C@H]1CCN[C@@H](C)C1)c1ccccc1 ZINC000423370143 330195100 /nfs/dbraw/zinc/19/51/00/330195100.db2.gz GTBHFQWLEOUPNT-XIRDDKMYSA-N 1 3 260.425 3.648 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@H]1N[C@H](Cc1ccccc1)c1ccccc1 ZINC000423400734 330195944 /nfs/dbraw/zinc/19/59/44/330195944.db2.gz QHGCSGQQVLNRHU-NSISKUIASA-N 1 3 294.442 3.558 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@H](Cc1ccccc1)c1ccccc1 ZINC000423400734 330195945 /nfs/dbraw/zinc/19/59/45/330195945.db2.gz QHGCSGQQVLNRHU-NSISKUIASA-N 1 3 294.442 3.558 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@H]1N[C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423399496 330195987 /nfs/dbraw/zinc/19/59/87/330195987.db2.gz POECMFKQHGWHTE-JLZZUVOBSA-N 1 3 292.854 3.769 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423399496 330195988 /nfs/dbraw/zinc/19/59/88/330195988.db2.gz POECMFKQHGWHTE-JLZZUVOBSA-N 1 3 292.854 3.769 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@H](N)C1)C1(c2ccccc2)CCCC1 ZINC000423400461 330196003 /nfs/dbraw/zinc/19/60/03/330196003.db2.gz VKUPJTBWTMQVSO-SZMVWBNQSA-N 1 3 286.463 3.746 20 0 CHADHO C[C@H](N[C@H]1CC[NH2+]C[C@@H]1C)c1cc2ccccc2s1 ZINC000423397756 330196080 /nfs/dbraw/zinc/19/60/80/330196080.db2.gz OLFSNWBZUFHJIR-OBJOEFQTSA-N 1 3 274.433 3.550 20 0 CHADHO C[C@H]([NH2+][C@H]1CCNC[C@@H]1C)c1cc2ccccc2s1 ZINC000423397756 330196082 /nfs/dbraw/zinc/19/60/82/330196082.db2.gz OLFSNWBZUFHJIR-OBJOEFQTSA-N 1 3 274.433 3.550 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423403893 330196246 /nfs/dbraw/zinc/19/62/46/330196246.db2.gz SHQLBOMZYTWZEO-OAUYIBNBSA-N 1 3 292.854 3.769 20 0 CHADHO Cc1cc2c(cc1C)[C@H](N[C@@H]1CCC[C@@H]([NH3+])C1)CCS2 ZINC000423406157 330196881 /nfs/dbraw/zinc/19/68/81/330196881.db2.gz YRFZSAPVRIZPLY-IIAWOOMASA-N 1 3 290.476 3.700 20 0 CHADHO Cc1cccc2c1[C@@H](C)C[C@H]2NCc1ccc2c(c1)C[NH2+]C2 ZINC000423382990 330199159 /nfs/dbraw/zinc/19/91/59/330199159.db2.gz KCVRQOJSWSVQAN-IFXJQAMLSA-N 1 3 292.426 3.936 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@@H]([NH3+])C1)c1ccccc1C(F)(F)F ZINC000423381932 330199240 /nfs/dbraw/zinc/19/92/40/330199240.db2.gz JQBTXGAULWWFKS-QJPTWQEYSA-N 1 3 286.341 3.626 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1ccccc1C(F)(F)F ZINC000423381940 330199330 /nfs/dbraw/zinc/19/93/30/330199330.db2.gz JQBTXGAULWWFKS-SDDRHHMPSA-N 1 3 286.341 3.626 20 0 CHADHO CCSc1ccc([C@H](C)N[C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000423390664 330200418 /nfs/dbraw/zinc/20/04/18/330200418.db2.gz PBTIARHAXSVSEG-QEJZJMRPSA-N 1 3 278.465 3.719 20 0 CHADHO Cc1ccc([C@@H](C)NCc2ccc3c(c2)C[NH2+]C3)s1 ZINC000423393624 330200698 /nfs/dbraw/zinc/20/06/98/330200698.db2.gz QSRMNGFCSBLADO-GFCCVEGCSA-N 1 3 272.417 3.511 20 0 CHADHO C[C@H](N)[C@H](C)[NH2+][C@@H](C)c1cccc(-c2ccccc2)c1 ZINC000423434575 330201168 /nfs/dbraw/zinc/20/11/68/330201168.db2.gz CZOMIAJSXBASKF-KKUMJFAQSA-N 1 3 268.404 3.740 20 0 CHADHO C[C@H](CCC[NH3+])N[C@H](C)c1ccc(Oc2ccccc2)cn1 ZINC000423445082 330202005 /nfs/dbraw/zinc/20/20/05/330202005.db2.gz BOYSUMRUDFPUET-HUUCEWRRSA-N 1 3 299.418 3.652 20 0 CHADHO C[C@@H](N[C@@H](C)[C@H](C)[NH3+])C(c1ccccc1)c1ccccc1 ZINC000423446103 330202271 /nfs/dbraw/zinc/20/22/71/330202271.db2.gz NUCLVLXZEUMQHG-HRCADAONSA-N 1 3 282.431 3.532 20 0 CHADHO CC[C@H](N)C[NH2+][C@@H](CC)c1ccc(Cl)c(Cl)c1 ZINC000423461099 330204004 /nfs/dbraw/zinc/20/40/04/330204004.db2.gz JJWKCKHIFZAWFE-GWCFXTLKSA-N 1 3 275.223 3.771 20 0 CHADHO CC[C@H](N)C[NH2+][C@@H](C)c1cccc(OCc2ccccc2)c1 ZINC000423464632 330204272 /nfs/dbraw/zinc/20/42/72/330204272.db2.gz MHXCPOFPSKHZST-YJBOKZPZSA-N 1 3 298.430 3.654 20 0 CHADHO CC[C@@H](N)C[NH2+][C@@H](c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000423471000 330205070 /nfs/dbraw/zinc/20/50/70/330205070.db2.gz PMULTLFKRHVVBG-BXUZGUMPSA-N 1 3 287.234 3.771 20 0 CHADHO COc1ccccc1[C@H](C)N[C@H](CCC[NH3+])c1ccccc1 ZINC000423498596 330208040 /nfs/dbraw/zinc/20/80/40/330208040.db2.gz IHBCLONVWKHWRT-MAUKXSAKSA-N 1 3 298.430 3.826 20 0 CHADHO CC(C)C[C@@H]([NH2+]CCCNC1CC1)c1ccccc1 ZINC000423526068 330209959 /nfs/dbraw/zinc/20/99/59/330209959.db2.gz KZTFZSUBRVWJLG-QGZVFWFLSA-N 1 3 260.425 3.506 20 0 CHADHO CN1CCC[C@H]1CC[N@@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000433302091 330217143 /nfs/dbraw/zinc/21/71/43/330217143.db2.gz XAFSQGKNGZHSNA-WBVHZDCISA-N 1 3 292.854 3.614 20 0 CHADHO CN1CCC[C@H]1CC[N@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000433302091 330217146 /nfs/dbraw/zinc/21/71/46/330217146.db2.gz XAFSQGKNGZHSNA-WBVHZDCISA-N 1 3 292.854 3.614 20 0 CHADHO CC(C)C[C@H](C)[NH2+][C@H](C)c1cccc(OCCN(C)C)c1 ZINC000536839120 330232324 /nfs/dbraw/zinc/23/23/24/330232324.db2.gz NGPISJWKRVFYHW-JKSUJKDBSA-N 1 3 292.467 3.712 20 0 CHADHO C[C@H]([NH2+]C1CCN(C2CCCCC2)CC1)[C@@H]1C[C@H]1C1CC1 ZINC000527669176 330269471 /nfs/dbraw/zinc/26/94/71/330269471.db2.gz GZUGLXJPECIZFE-JVPBZIDWSA-N 1 3 290.495 3.808 20 0 CHADHO CCC[C@@H](C[NH2+]C1CCN(C2CCCCC2)CC1)OCC ZINC000527744991 330280318 /nfs/dbraw/zinc/28/03/18/330280318.db2.gz MNIWNOHWYXKXEA-SFHVURJKSA-N 1 3 296.499 3.578 20 0 CHADHO CCCc1ccc([C@H](C)NC[C@H]2CCC[N@H+](C)C2)cc1 ZINC000044534929 330329937 /nfs/dbraw/zinc/32/99/37/330329937.db2.gz WJJLQZXHTXKZKN-DOTOQJQBSA-N 1 3 274.452 3.632 20 0 CHADHO CCCc1ccc([C@H](C)NC[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000044534929 330329938 /nfs/dbraw/zinc/32/99/38/330329938.db2.gz WJJLQZXHTXKZKN-DOTOQJQBSA-N 1 3 274.452 3.632 20 0 CHADHO C[C@H](NCCCC[NH+](C)C)c1ccc(Cl)cc1Cl ZINC000045663471 330347636 /nfs/dbraw/zinc/34/76/36/330347636.db2.gz IUUZYUONHVEODC-NSHDSACASA-N 1 3 289.250 3.986 20 0 CHADHO CCSc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2N)cc1 ZINC000424373942 330348261 /nfs/dbraw/zinc/34/82/61/330348261.db2.gz KJCCJIHGJCSBCW-APHBMKBZSA-N 1 3 278.465 3.719 20 0 CHADHO CC[C@@H]([NH2+][C@@H]1CCCC[C@H]1N)c1ccc(Cl)s1 ZINC000424370688 330348302 /nfs/dbraw/zinc/34/83/02/330348302.db2.gz DXTXVJVXGKYDGE-GMTAPVOTSA-N 1 3 272.845 3.712 20 0 CHADHO N[C@@H]1CCCC[C@H]1[NH2+]Cc1cc(-c2ccccc2)cs1 ZINC000424384291 330349538 /nfs/dbraw/zinc/34/95/38/330349538.db2.gz VHHBETSPSOSDMS-IAGOWNOFSA-N 1 3 286.444 3.775 20 0 CHADHO C[C@@]1(C[NH2+]C2CCN(C3CCCCC3)CC2)CCCS1 ZINC000120392473 330388470 /nfs/dbraw/zinc/38/84/70/330388470.db2.gz LCLHBJIHCCBFLC-KRWDZBQOSA-N 1 3 296.524 3.659 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1N[C@@H]1CCCc2cc(F)ccc21 ZINC000090964342 330397297 /nfs/dbraw/zinc/39/72/97/330397297.db2.gz NSNHKKMVHSZSBZ-XHSVMWQWSA-N 1 3 290.426 3.521 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1N[C@@H]1CCCc2cc(F)ccc21 ZINC000090964342 330397298 /nfs/dbraw/zinc/39/72/98/330397298.db2.gz NSNHKKMVHSZSBZ-XHSVMWQWSA-N 1 3 290.426 3.521 20 0 CHADHO CC[C@H](Cc1ccc(Cl)cc1)[NH2+][C@@H]1CCC[C@H](N)C1 ZINC000516492195 330493720 /nfs/dbraw/zinc/49/37/20/330493720.db2.gz UOUQWQIFMUCJSV-ARFHVFGLSA-N 1 3 280.843 3.521 20 0 CHADHO C[C@H]([NH2+]CC[C@@H]1CCCN1C)c1cccc(C2CC2)c1 ZINC000451108992 331015809 /nfs/dbraw/zinc/01/58/09/331015809.db2.gz AYXOLXYLGUJHFN-KSSFIOAISA-N 1 3 272.436 3.699 20 0 CHADHO Cc1[nH]c2ccc(CNC3CC[NH+](C4CC4)CC3)cc2c1C ZINC000459384901 331279479 /nfs/dbraw/zinc/27/94/79/331279479.db2.gz ISRRUMAIFIDUNO-UHFFFAOYSA-N 1 3 297.446 3.501 20 0 CHADHO CC1(C)[C@@H](CN[C@H]2CC[N@@H+]3CCC[C@H]3C2)[C@@H]1c1ccccc1 ZINC000459724441 331295859 /nfs/dbraw/zinc/29/58/59/331295859.db2.gz YSLFIJXYYHYBQG-VJANTYMQSA-N 1 3 298.474 3.643 20 0 CHADHO CC1(C)[C@@H](CN[C@H]2CC[N@H+]3CCC[C@H]3C2)[C@@H]1c1ccccc1 ZINC000459724441 331295860 /nfs/dbraw/zinc/29/58/60/331295860.db2.gz YSLFIJXYYHYBQG-VJANTYMQSA-N 1 3 298.474 3.643 20 0 CHADHO CC(C)[C@H](CN[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000166088619 331306765 /nfs/dbraw/zinc/30/67/65/331306765.db2.gz GYWXZQZCHBRBHL-OTWHNJEPSA-N 1 3 286.463 3.643 20 0 CHADHO CC(C)[C@H](CN[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000166088619 331306766 /nfs/dbraw/zinc/30/67/66/331306766.db2.gz GYWXZQZCHBRBHL-OTWHNJEPSA-N 1 3 286.463 3.643 20 0 CHADHO C[C@@H](CCc1ccsc1)[NH2+]CC(C)(C)CN1CCCC1 ZINC000477928816 331694527 /nfs/dbraw/zinc/69/45/27/331694527.db2.gz FJIONQXNQBLDNI-HNNXBMFYSA-N 1 3 294.508 3.781 20 0 CHADHO CC[NH+]1CCC(CCNCc2cc(F)cc(Cl)c2)CC1 ZINC000485698832 331920881 /nfs/dbraw/zinc/92/08/81/331920881.db2.gz YLUKGRRHCWRTGW-UHFFFAOYSA-N 1 3 298.833 3.691 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H]2CS[C@@H](C(C)(C)C)C2)C1 ZINC000488449047 332010225 /nfs/dbraw/zinc/01/02/25/332010225.db2.gz OMGVIBYKJAIXSW-BZUAXINKSA-N 1 3 298.540 3.617 20 0 CHADHO CC(C)[N@@H+]1CCC[C@H](CN[C@H]2CS[C@@H](C(C)(C)C)C2)C1 ZINC000488449047 332010226 /nfs/dbraw/zinc/01/02/26/332010226.db2.gz OMGVIBYKJAIXSW-BZUAXINKSA-N 1 3 298.540 3.617 20 0 CHADHO CC(C)[N@H+]1CCC[C@H](CN[C@H]2CS[C@@H](C(C)(C)C)C2)C1 ZINC000488449047 332010227 /nfs/dbraw/zinc/01/02/27/332010227.db2.gz OMGVIBYKJAIXSW-BZUAXINKSA-N 1 3 298.540 3.617 20 0 CHADHO CC(C)(C)[C@@H]1C[C@H](NC2CC[NH+](C(C)(C)C)CC2)CS1 ZINC000488456024 332010864 /nfs/dbraw/zinc/01/08/64/332010864.db2.gz FZXBJFTXASWXRX-GJZGRUSLSA-N 1 3 298.540 3.759 20 0 CHADHO CN(CCC[N@H+](C)C(C1CC1)C1CC1)C(C1CC1)C1CC1 ZINC000488671412 332021241 /nfs/dbraw/zinc/02/12/41/332021241.db2.gz SXTXTBOQOUXUMG-UHFFFAOYSA-N 1 3 290.495 3.617 20 0 CHADHO CN(CCC[N@@H+](C)C(C1CC1)C1CC1)C(C1CC1)C1CC1 ZINC000488671412 332021242 /nfs/dbraw/zinc/02/12/42/332021242.db2.gz SXTXTBOQOUXUMG-UHFFFAOYSA-N 1 3 290.495 3.617 20 0 CHADHO C(CN1C[C@@H]2CCCC[C@@H]2C1)C[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC000489356390 332048474 /nfs/dbraw/zinc/04/84/74/332048474.db2.gz DUUZPDVZKQEWHP-MKXGPGLRSA-N 1 3 290.495 3.621 20 0 CHADHO C(CN1C[C@H]2CCCC[C@@H]2C1)C[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000489356390 332048475 /nfs/dbraw/zinc/04/84/75/332048475.db2.gz DUUZPDVZKQEWHP-MKXGPGLRSA-N 1 3 290.495 3.621 20 0 CHADHO C(CN1C[C@H]2CCCC[C@@H]2C1)C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000489356390 332048477 /nfs/dbraw/zinc/04/84/77/332048477.db2.gz DUUZPDVZKQEWHP-MKXGPGLRSA-N 1 3 290.495 3.621 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H]2c3cc(C)ccc3C[C@H]2C)C1 ZINC000490172055 332083446 /nfs/dbraw/zinc/08/34/46/332083446.db2.gz JYJGEVBSOGESMN-GPMSIDNRSA-N 1 3 286.463 3.550 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H]2c3cc(C)ccc3C[C@H]2C)C1 ZINC000490172055 332083447 /nfs/dbraw/zinc/08/34/47/332083447.db2.gz JYJGEVBSOGESMN-GPMSIDNRSA-N 1 3 286.463 3.550 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H]2c3cc(C)ccc3C[C@H]2C)C1 ZINC000490172055 332083448 /nfs/dbraw/zinc/08/34/48/332083448.db2.gz JYJGEVBSOGESMN-GPMSIDNRSA-N 1 3 286.463 3.550 20 0 CHADHO Cc1ccc2c(c1)[C@@H](N[C@@H]1C[C@H](C)[N@@H+](C)C[C@H]1C)CCC2 ZINC000490228095 332085211 /nfs/dbraw/zinc/08/52/11/332085211.db2.gz YTXUAEIGBBBYMV-LVFSCSRESA-N 1 3 286.463 3.691 20 0 CHADHO Cc1ccc2c(c1)[C@@H](N[C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C)CCC2 ZINC000490228095 332085213 /nfs/dbraw/zinc/08/52/13/332085213.db2.gz YTXUAEIGBBBYMV-LVFSCSRESA-N 1 3 286.463 3.691 20 0 CHADHO CC1(C)CC[C@@H]([NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000575365379 335098047 /nfs/dbraw/zinc/09/80/47/335098047.db2.gz VCVYJRCYJFVWKZ-OAHLLOKOSA-N 1 3 264.457 3.562 20 0 CHADHO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1cccc(CN(C)C)c1 ZINC000502021054 332645535 /nfs/dbraw/zinc/64/55/35/332645535.db2.gz XUJZQFRLGPKWBA-QZTJIDSGSA-N 1 3 274.452 3.807 20 0 CHADHO C[C@@H]1CCC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000513074754 333002950 /nfs/dbraw/zinc/00/29/50/333002950.db2.gz JEZIIEMNWLYRLZ-WBVHZDCISA-N 1 3 278.484 3.952 20 0 CHADHO C/C(=C\c1ccc(Cl)cc1)CN[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000513525195 333024161 /nfs/dbraw/zinc/02/41/61/333024161.db2.gz JWUDVCSDMFTHDG-MKLFLIHKSA-N 1 3 292.854 3.816 20 0 CHADHO C/C(=C\c1ccc(Cl)cc1)CN[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000513525195 333024163 /nfs/dbraw/zinc/02/41/63/333024163.db2.gz JWUDVCSDMFTHDG-MKLFLIHKSA-N 1 3 292.854 3.816 20 0 CHADHO C/C(=C/c1ccc(Cl)cc1)CN[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000513525194 333024203 /nfs/dbraw/zinc/02/42/03/333024203.db2.gz JWUDVCSDMFTHDG-DYZPHHRXSA-N 1 3 292.854 3.816 20 0 CHADHO C/C(=C/c1ccc(Cl)cc1)CN[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000513525194 333024204 /nfs/dbraw/zinc/02/42/04/333024204.db2.gz JWUDVCSDMFTHDG-DYZPHHRXSA-N 1 3 292.854 3.816 20 0 CHADHO Cc1cc(C)c(CN[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@@H]32)c(C)c1 ZINC000513652794 333029431 /nfs/dbraw/zinc/02/94/31/333029431.db2.gz BWAYTYXBLXGLJF-BHIYHBOVSA-N 1 3 286.463 3.574 20 0 CHADHO Cc1cc(C)c(CN[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@@H]32)c(C)c1 ZINC000513652794 333029432 /nfs/dbraw/zinc/02/94/32/333029432.db2.gz BWAYTYXBLXGLJF-BHIYHBOVSA-N 1 3 286.463 3.574 20 0 CHADHO CC1(C)Cc2occc2[C@@H](NCc2ccc(C[NH3+])cc2)C1 ZINC000575803894 335116982 /nfs/dbraw/zinc/11/69/82/335116982.db2.gz SNLBEXLSRPMWPC-INIZCTEOSA-N 1 3 284.403 3.542 20 0 CHADHO CCN(CC)CCC[N@@H+]1CCC[C@H]1c1ccc(C)cc1 ZINC000513966171 333056158 /nfs/dbraw/zinc/05/61/58/333056158.db2.gz MMXCGULZWIUDGF-SFHVURJKSA-N 1 3 274.452 3.864 20 0 CHADHO CCN(CC)CCC[N@H+]1CCC[C@H]1c1ccc(C)cc1 ZINC000513966171 333056159 /nfs/dbraw/zinc/05/61/59/333056159.db2.gz MMXCGULZWIUDGF-SFHVURJKSA-N 1 3 274.452 3.864 20 0 CHADHO CC(C)CC[C@H]([NH2+]C[C@H](C)CN1CCCC1)C1CC1 ZINC000311551835 333069947 /nfs/dbraw/zinc/06/99/47/333069947.db2.gz LDFAEZFEHMVWDZ-RDJZCZTQSA-N 1 3 266.473 3.523 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@@H]2NC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000186104777 333155095 /nfs/dbraw/zinc/15/50/95/333155095.db2.gz XWMDNTQVDOHRPN-LPHOPBHVSA-N 1 3 298.474 3.755 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@@H]2NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000186104777 333155097 /nfs/dbraw/zinc/15/50/97/333155097.db2.gz XWMDNTQVDOHRPN-LPHOPBHVSA-N 1 3 298.474 3.755 20 0 CHADHO C[C@@H]([NH2+]CCCN(C)C1CCCCC1)C1CCSCC1 ZINC000186961163 333166756 /nfs/dbraw/zinc/16/67/56/333166756.db2.gz QRJROJLNIANKNL-OAHLLOKOSA-N 1 3 298.540 3.762 20 0 CHADHO c1ccc([C@@H]2CCCN2CCC[NH+]2CCCCC2)cc1 ZINC000193462147 333250730 /nfs/dbraw/zinc/25/07/30/333250730.db2.gz CBNXOWWBZVAVMZ-SFHVURJKSA-N 1 3 272.436 3.700 20 0 CHADHO C[C@H](CN[C@H]1C[C@@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000227535425 333285287 /nfs/dbraw/zinc/28/52/87/333285287.db2.gz QWNBHUWNJIZEIK-XWIAVFTESA-N 1 3 266.388 3.525 20 0 CHADHO Cc1ccc(CN[C@H](CC[NH+](C)C)C(C)(C)C)cc1C ZINC000522557789 333290223 /nfs/dbraw/zinc/29/02/23/333290223.db2.gz GRPGLUSOEYBLRT-QGZVFWFLSA-N 1 3 276.468 3.759 20 0 CHADHO CC(C)(C)C(C)(C)C[NH2+]C1CCN(c2ccncc2)CC1 ZINC000315644391 333382986 /nfs/dbraw/zinc/38/29/86/333382986.db2.gz XKFQGDKHTQYKAA-UHFFFAOYSA-N 1 3 289.467 3.712 20 0 CHADHO C[C@@H](C[NH2+]CC[C@H](C)c1ccccc1)CN1CCCC1 ZINC000062079384 333542160 /nfs/dbraw/zinc/54/21/60/333542160.db2.gz UMMZCBUBFKNZGG-IRXDYDNUSA-N 1 3 274.452 3.502 20 0 CHADHO CC1=CCC[C@@H](C)[C@@H]1C[NH2+]C1CCN(C2CCCC2)CC1 ZINC000152616078 333787539 /nfs/dbraw/zinc/78/75/39/333787539.db2.gz AHSYFXUSEXFXJU-VQIMIIECSA-N 1 3 290.495 3.975 20 0 CHADHO C[C@@]1(NC2CC[NH+](CC3CC3)CC2)CCCc2ccccc21 ZINC000546579191 334038620 /nfs/dbraw/zinc/03/86/20/334038620.db2.gz JVNRRSMWBJPSKM-HXUWFJFHSA-N 1 3 298.474 3.702 20 0 CHADHO C(C1CCCCC1)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000134862524 334105977 /nfs/dbraw/zinc/10/59/77/334105977.db2.gz DQADZARDUDACJO-SJLPKXTDSA-N 1 3 276.468 3.515 20 0 CHADHO C(C1CCCCC1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134862524 334105978 /nfs/dbraw/zinc/10/59/78/334105978.db2.gz DQADZARDUDACJO-SJLPKXTDSA-N 1 3 276.468 3.515 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2NC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000245508009 334198674 /nfs/dbraw/zinc/19/86/74/334198674.db2.gz QZTORFPEBDFYCF-RKVPGOIHSA-N 1 3 284.447 3.617 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000245508009 334198676 /nfs/dbraw/zinc/19/86/76/334198676.db2.gz QZTORFPEBDFYCF-RKVPGOIHSA-N 1 3 284.447 3.617 20 0 CHADHO C[C@H](NCCCCC[NH+]1CCCC1)c1ccccc1F ZINC000550267449 334218316 /nfs/dbraw/zinc/21/83/16/334218316.db2.gz ZLHQTKZULVYBNW-HNNXBMFYSA-N 1 3 278.415 3.742 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H](C)c2ccc(C)cc2C)C1 ZINC000247000378 334273752 /nfs/dbraw/zinc/27/37/52/334273752.db2.gz KRFGQEGXPQBAGA-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H](C)c2ccc(C)cc2C)C1 ZINC000247000378 334273753 /nfs/dbraw/zinc/27/37/53/334273753.db2.gz KRFGQEGXPQBAGA-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](C)c2ccc(C)cc2C)C1 ZINC000247000378 334273754 /nfs/dbraw/zinc/27/37/54/334273754.db2.gz KRFGQEGXPQBAGA-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN([C@H](C)CCc2ccccc2)C1 ZINC000246218372 334241821 /nfs/dbraw/zinc/24/18/21/334241821.db2.gz OREMQJXMFQRYOZ-IEBWSBKVSA-N 1 3 288.479 3.671 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN([C@H](C)CCc2ccccc2)C1 ZINC000246218372 334241822 /nfs/dbraw/zinc/24/18/22/334241822.db2.gz OREMQJXMFQRYOZ-IEBWSBKVSA-N 1 3 288.479 3.671 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+]([C@H](C)CCc2ccccc2)C1 ZINC000246218372 334241823 /nfs/dbraw/zinc/24/18/23/334241823.db2.gz OREMQJXMFQRYOZ-IEBWSBKVSA-N 1 3 288.479 3.671 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+]([C@H](C)CCc2ccccc2)C1 ZINC000246218372 334241824 /nfs/dbraw/zinc/24/18/24/334241824.db2.gz OREMQJXMFQRYOZ-IEBWSBKVSA-N 1 3 288.479 3.671 20 0 CHADHO CC(C)C1([NH2+]C2CCN([C@H]3CCC[C@H](C)C3)CC2)CC1 ZINC000551263338 334243281 /nfs/dbraw/zinc/24/32/81/334243281.db2.gz PWPVXRDJNVZETL-RDJZCZTQSA-N 1 3 278.484 3.808 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+](CC(C(C)C)C(C)C)C1 ZINC000551806888 334262613 /nfs/dbraw/zinc/26/26/13/334262613.db2.gz YUQSYAMOAKUGAX-INIZCTEOSA-N 1 3 268.489 3.578 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+](CC(C(C)C)C(C)C)C1 ZINC000551806888 334262614 /nfs/dbraw/zinc/26/26/14/334262614.db2.gz YUQSYAMOAKUGAX-INIZCTEOSA-N 1 3 268.489 3.578 20 0 CHADHO C[C@@H](c1cc2ccccc2o1)[N@H+](C)CC[C@H]1CCCN1C ZINC000247446552 334281600 /nfs/dbraw/zinc/28/16/00/334281600.db2.gz YFYOXQADFFOHCO-GOEBONIOSA-N 1 3 286.419 3.910 20 0 CHADHO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)CC[C@H]1CCCN1C ZINC000247446552 334281602 /nfs/dbraw/zinc/28/16/02/334281602.db2.gz YFYOXQADFFOHCO-GOEBONIOSA-N 1 3 286.419 3.910 20 0 CHADHO CC[C@H](C)[C@H](C)[NH2+][C@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000248406661 334300306 /nfs/dbraw/zinc/30/03/06/334300306.db2.gz SRSNCUSBUFXBTA-JONQDZQNSA-N 1 3 266.473 3.664 20 0 CHADHO CC(C)[C@H]1CC[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000552251191 334308664 /nfs/dbraw/zinc/30/86/64/334308664.db2.gz NBCKSAKZDAWMOX-MSOLQXFVSA-N 1 3 278.484 3.808 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H](c2ccc(F)cc2)C2CC2)C1 ZINC000552745273 334343848 /nfs/dbraw/zinc/34/38/48/334343848.db2.gz MNDBJGGHXWOSMR-KDOFPFPSSA-N 1 3 290.426 3.598 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H](c2ccc(F)cc2)C2CC2)C1 ZINC000552745273 334343849 /nfs/dbraw/zinc/34/38/49/334343849.db2.gz MNDBJGGHXWOSMR-KDOFPFPSSA-N 1 3 290.426 3.598 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](c2ccc(F)cc2)C2CC2)C1 ZINC000552745273 334343850 /nfs/dbraw/zinc/34/38/50/334343850.db2.gz MNDBJGGHXWOSMR-KDOFPFPSSA-N 1 3 290.426 3.598 20 0 CHADHO C[C@H](CCN[C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1)c1ccccc1 ZINC000251253813 334358925 /nfs/dbraw/zinc/35/89/25/334358925.db2.gz UXHZJVVKWSRGPE-NXWXRZEISA-N 1 3 286.463 3.691 20 0 CHADHO CC(C)CC(CC(C)C)[NH2+][C@@H]1CCN2CCC[C@H]2C1 ZINC000251441209 334361658 /nfs/dbraw/zinc/36/16/58/334361658.db2.gz VIJHZOKCTOVOJG-WBVHZDCISA-N 1 3 266.473 3.664 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]CCCN2CCCC[C@H]2C)cc1 ZINC000251467839 334361949 /nfs/dbraw/zinc/36/19/49/334361949.db2.gz JHXWZMUYSKAAJG-IAGOWNOFSA-N 1 3 274.452 3.910 20 0 CHADHO C[NH2+]C[C@@H]1CCCN([C@H](C)c2ccc3ccccc3c2)C1 ZINC000251509360 334362546 /nfs/dbraw/zinc/36/25/46/334362546.db2.gz HUMWSHVFQIWHNJ-CVEARBPZSA-N 1 3 282.431 3.832 20 0 CHADHO C[C@H]1C[C@H](N[C@H]2C[C@H]([NH3+])c3ccccc32)C[C@@H](C)C1 ZINC000252792040 334393413 /nfs/dbraw/zinc/39/34/13/334393413.db2.gz UXSFAGRFDOJJOF-YAKIMEMVSA-N 1 3 258.409 3.546 20 0 CHADHO CC(C)CC[C@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)C1CC1 ZINC000555226816 334471774 /nfs/dbraw/zinc/47/17/74/334471774.db2.gz NGAJPDOCRXFWIN-ULQDDVLXSA-N 1 3 266.473 3.664 20 0 CHADHO COc1ccccc1[C@H](CC(C)C)N[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000565843065 334602402 /nfs/dbraw/zinc/60/24/02/334602402.db2.gz LWSLUZGUCUWSEO-INMHGKMJSA-N 1 3 290.451 3.642 20 0 CHADHO CC[C@H]([NH2+]CC[C@H](C)N1CCCCC1)C(C)(C)C ZINC000565855594 334603490 /nfs/dbraw/zinc/60/34/90/334603490.db2.gz ILTCGCWRKAHGDO-GJZGRUSLSA-N 1 3 254.462 3.665 20 0 CHADHO CC(C)C[C@H]([NH2+]CC1=CCN(C)CC1)c1ccccc1 ZINC000344299163 335246376 /nfs/dbraw/zinc/24/63/76/335246376.db2.gz OQTQVPVPYFWWNX-SFHVURJKSA-N 1 3 272.436 3.625 20 0 CHADHO C[NH+]1CCC([C@@H]2CCN(Cc3ccc(Cl)cc3)C2)CC1 ZINC000577196780 335320678 /nfs/dbraw/zinc/32/06/78/335320678.db2.gz QAQLQLLJHRSDRV-MRXNPFEDSA-N 1 3 292.854 3.504 20 0 CHADHO CC(C)C[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000381931676 336078478 /nfs/dbraw/zinc/07/84/78/336078478.db2.gz RXKZUOLDPUHDCS-GOSISDBHSA-N 1 3 274.452 3.534 20 0 CHADHO CC(C)CC[C@@H]([NH2+]CC1=CCN(C)CC1)C(C)(C)C ZINC000581451986 336079667 /nfs/dbraw/zinc/07/96/67/336079667.db2.gz BORMPDUNHWPTPL-MRXNPFEDSA-N 1 3 266.473 3.689 20 0 CHADHO CC[NH+](CC)Cc1ccccc1CN[C@H](C)c1cccnc1 ZINC000120446371 520759471 /nfs/dbraw/zinc/75/94/71/520759471.db2.gz DOJJUHXMEUTVER-MRXNPFEDSA-N 1 3 297.446 3.774 20 0 CHADHO CC[NH+]1CCC(CCN[C@@H](C)c2ccc(Cl)cn2)CC1 ZINC000274970417 521550078 /nfs/dbraw/zinc/55/00/78/521550078.db2.gz YCVAOJBCMGRXSP-ZDUSSCGKSA-N 1 3 295.858 3.508 20 0 CHADHO CC[C@@H](N[C@H](C)CC[NH+](C)C)c1ccc(Cl)cc1 ZINC000049553198 522933002 /nfs/dbraw/zinc/93/30/02/522933002.db2.gz NPGCBGOBYVFACL-IUODEOHRSA-N 1 3 268.832 3.721 20 0 CHADHO C[C@H](CCN(C)C)[NH2+][C@H]1C[C@H](C)Sc2sccc21 ZINC000130478965 524169884 /nfs/dbraw/zinc/16/98/84/524169884.db2.gz YUKUVOMLLIZUBX-MDZLAQPJSA-N 1 3 284.494 3.603 20 0 CHADHO C[C@@H](C[NH2+]Cc1cccc(CN(C)C)c1)c1ccccc1 ZINC000237372800 524744184 /nfs/dbraw/zinc/74/41/84/524744184.db2.gz WUAGRBDNDOBMFN-INIZCTEOSA-N 1 3 282.431 3.642 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCCCC1)c1nccc2ccccc21 ZINC000289581632 525433916 /nfs/dbraw/zinc/43/39/16/525433916.db2.gz DVETYOJXNWBQOM-MRXNPFEDSA-N 1 3 297.446 3.761 20 0 CHADHO Cc1ccsc1[C@H](C)NC[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000125834164 525886508 /nfs/dbraw/zinc/88/65/08/525886508.db2.gz ROVLIPWLSNWMRH-LSDHHAIUSA-N 1 3 280.481 3.828 20 0 CHADHO Cc1ccsc1[C@H](C)NC[C@H]1CCC[N@H+](C(C)C)C1 ZINC000125834164 525886518 /nfs/dbraw/zinc/88/65/18/525886518.db2.gz ROVLIPWLSNWMRH-LSDHHAIUSA-N 1 3 280.481 3.828 20 0 CHADHO Cc1ccsc1[C@H](C)[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000125834164 525886527 /nfs/dbraw/zinc/88/65/27/525886527.db2.gz ROVLIPWLSNWMRH-LSDHHAIUSA-N 1 3 280.481 3.828 20 0 CHADHO Cc1nc(C)c([C@H](C)[NH2+]C[C@H](C)CN2CCCCC2)s1 ZINC000111361642 526753088 /nfs/dbraw/zinc/75/30/88/526753088.db2.gz AJPVFYHUDAIOTK-STQMWFEESA-N 1 3 295.496 3.533 20 0 CHADHO CCC[NH+]1CCC(N[C@@H]2CCCc3ccc(C)cc32)CC1 ZINC000352604980 528203284 /nfs/dbraw/zinc/20/32/84/528203284.db2.gz FKPMQODDZGWXHH-LJQANCHMSA-N 1 3 286.463 3.836 20 0 CHADHO C[C@@H](CC[NH2+][C@@H](C)c1cccs1)N1CCCCC1 ZINC000184501315 1118055022 /nfs/dbraw/zinc/05/50/22/1118055022.db2.gz GDCNQMSIZUSDBP-KBPBESRZSA-N 1 3 266.454 3.663 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1ccc(Cl)s1 ZINC000037649001 1118278589 /nfs/dbraw/zinc/27/85/89/1118278589.db2.gz QAWVEPSWFQTTAG-QWRGUYRKSA-N 1 3 284.856 3.536 20 0 CHADHO CC[NH+](CC)Cc1cccc(CN[C@@H](C)c2cccnc2)c1 ZINC000112531578 1125487734 /nfs/dbraw/zinc/48/77/34/1125487734.db2.gz KDXMSBTXMDXMJQ-INIZCTEOSA-N 1 3 297.446 3.774 20 0 CHADHO CN(C)[C@H]1CCC[N@H+](C[C@H]2CCCC(C)(C)C2)CC1 ZINC000562417904 1119473043 /nfs/dbraw/zinc/47/30/43/1119473043.db2.gz SXALCOLOPQEAPK-HOTGVXAUSA-N 1 3 266.473 3.619 20 0 CHADHO CN(C)[C@H]1CCC[N@@H+](C[C@H]2CCCC(C)(C)C2)CC1 ZINC000562417904 1119473044 /nfs/dbraw/zinc/47/30/44/1119473044.db2.gz SXALCOLOPQEAPK-HOTGVXAUSA-N 1 3 266.473 3.619 20 0 CHADHO C[C@H]1C[C@H](C)CN(CCC[NH2+]C2CCC(F)(F)CC2)C1 ZINC000647171139 1121435833 /nfs/dbraw/zinc/43/58/33/1121435833.db2.gz AWQCLWGMRGKHFS-KBPBESRZSA-N 1 3 288.426 3.522 20 0 CHADHO CN1CCCC[C@H]1CC[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420946050 1122049045 /nfs/dbraw/zinc/04/90/45/1122049045.db2.gz LMQIXPMOMHTETJ-KBPBESRZSA-N 1 3 292.389 3.525 20 0 CHADHO CN1CCCC[C@H]1CC[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420946050 1122049050 /nfs/dbraw/zinc/04/90/50/1122049050.db2.gz LMQIXPMOMHTETJ-KBPBESRZSA-N 1 3 292.389 3.525 20 0 CHADHO CC(C)C(CN1CCC[N@@H+](C2CCCC2)CC1)C(C)C ZINC000515440984 1122499351 /nfs/dbraw/zinc/49/93/51/1122499351.db2.gz KBDYKFNBUOYBJM-UHFFFAOYSA-N 1 3 280.500 3.865 20 0 CHADHO CC(C)C(CN1CCC[N@H+](C2CCCC2)CC1)C(C)C ZINC000515440984 1122499352 /nfs/dbraw/zinc/49/93/52/1122499352.db2.gz KBDYKFNBUOYBJM-UHFFFAOYSA-N 1 3 280.500 3.865 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+](C[C@@H](C)C2CCCCC2)C1 ZINC001191367586 1122596382 /nfs/dbraw/zinc/59/63/82/1122596382.db2.gz QHRMMJRKIVJTAW-SJORKVTESA-N 1 3 280.500 3.867 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+](C[C@@H](C)C2CCCCC2)C1 ZINC001191367586 1122596387 /nfs/dbraw/zinc/59/63/87/1122596387.db2.gz QHRMMJRKIVJTAW-SJORKVTESA-N 1 3 280.500 3.867 20 0 CHADHO C[C@H]1C[C@@H]([NH2+][C@@H]2CCCC3(CCCCC3)C2)CCN1 ZINC001246493094 1131525877 /nfs/dbraw/zinc/52/58/77/1131525877.db2.gz ADIQLTUOTPDGOG-HRCADAONSA-N 1 3 264.457 3.610 20 0 CHADHO CC(C)[PH+](CCNc1cc(CN(C)C)ccn1)C(C)C ZINC001162363452 1133072583 /nfs/dbraw/zinc/07/25/83/1133072583.db2.gz ODMQRRXRZVXCBH-UHFFFAOYSA-N 1 3 295.411 3.854 20 0 CHADHO CC[C@@H]1CCCC[C@H]1C[N@@H+]1CC[C@@H](CN(CC)CC)C1 ZINC001204549957 1133460935 /nfs/dbraw/zinc/46/09/35/1133460935.db2.gz DHVHGCWIWLGDPA-KSZLIROESA-N 1 3 280.500 3.867 20 0 CHADHO CC[C@@H]1CCCC[C@H]1C[N@H+]1CC[C@@H](CN(CC)CC)C1 ZINC001204549957 1133460939 /nfs/dbraw/zinc/46/09/39/1133460939.db2.gz DHVHGCWIWLGDPA-KSZLIROESA-N 1 3 280.500 3.867 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2coc3ccccc23)[C@@H](C)C1 ZINC000245708762 1125589967 /nfs/dbraw/zinc/58/99/67/1125589967.db2.gz FQBNGQNQYPKFTG-YOEHRIQHSA-N 1 3 286.419 3.595 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2coc3ccccc23)[C@@H](C)C1 ZINC000245708762 1125589971 /nfs/dbraw/zinc/58/99/71/1125589971.db2.gz FQBNGQNQYPKFTG-YOEHRIQHSA-N 1 3 286.419 3.595 20 0 CHADHO Cc1ccncc1[C@H](C)N[C@@H](C)c1cccc(C[NH+](C)C)c1 ZINC000925292099 1125614795 /nfs/dbraw/zinc/61/47/95/1125614795.db2.gz FBKMQIBLFAYVRA-HOTGVXAUSA-N 1 3 297.446 3.863 20 0 CHADHO Cc1coc(C[NH2+]C2CCN([C@@H](C)c3ccccc3)CC2)c1 ZINC000885990524 1125633206 /nfs/dbraw/zinc/63/32/06/1125633206.db2.gz JHVXSKXECWNUFS-INIZCTEOSA-N 1 3 298.430 3.903 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@H]2N(C)C[C@@]2(C)CC[NH2+]C2)cc1 ZINC000261703446 1125739328 /nfs/dbraw/zinc/73/93/28/1125739328.db2.gz CPYUYGOSZALLJI-OTWHNJEPSA-N 1 3 286.463 3.563 20 0 CHADHO C[C@H]([NH3+])[C@H]1CCCN(C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000262047621 1125750370 /nfs/dbraw/zinc/75/03/70/1125750370.db2.gz ZDMSFHSGDQSPDX-IPYPFGDCSA-N 1 3 280.843 3.503 20 0 CHADHO CCCc1cccc(CN(C)[C@H]2CC[N@H+](CC)C[C@@H]2C)c1 ZINC000481999834 1126738277 /nfs/dbraw/zinc/73/82/77/1126738277.db2.gz HVWKXTCYOTUHEK-LPHOPBHVSA-N 1 3 288.479 3.801 20 0 CHADHO CCCc1cccc(CN(C)[C@H]2CC[N@@H+](CC)C[C@@H]2C)c1 ZINC000481999834 1126738278 /nfs/dbraw/zinc/73/82/78/1126738278.db2.gz HVWKXTCYOTUHEK-LPHOPBHVSA-N 1 3 288.479 3.801 20 0 CHADHO CCCc1cccc(CN2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)c1 ZINC000482006576 1126739340 /nfs/dbraw/zinc/73/93/40/1126739340.db2.gz MFTLANPKNGFUEB-RBUKOAKNSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1cccc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c1 ZINC000482006576 1126739341 /nfs/dbraw/zinc/73/93/41/1126739341.db2.gz MFTLANPKNGFUEB-RBUKOAKNSA-N 1 3 286.463 3.555 20 0 CHADHO CN1CCCC[C@@H]1CC[N@H+](C)[C@@H]1CCc2ccc(F)cc21 ZINC000483062963 1126765863 /nfs/dbraw/zinc/76/58/63/1126765863.db2.gz LFMSEUISFLKLOZ-SJLPKXTDSA-N 1 3 290.426 3.619 20 0 CHADHO CN1CCCC[C@@H]1CC[N@@H+](C)[C@@H]1CCc2ccc(F)cc21 ZINC000483062963 1126765866 /nfs/dbraw/zinc/76/58/66/1126765866.db2.gz LFMSEUISFLKLOZ-SJLPKXTDSA-N 1 3 290.426 3.619 20 0 CHADHO COc1ccccc1[C@H](C)[NH2+][C@H](CCN(C)C)C(C)(C)C ZINC000483179186 1126771229 /nfs/dbraw/zinc/77/12/29/1126771229.db2.gz BOMODMIUIKXZLM-WMLDXEAASA-N 1 3 292.467 3.712 20 0 CHADHO C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNCc2cc[nH]c2)cc1 ZINC000175697841 1126785029 /nfs/dbraw/zinc/78/50/29/1126785029.db2.gz AZPNWTRZGNJYQP-MRXNPFEDSA-N 1 3 297.446 3.679 20 0 CHADHO C[C@@H]1CCCC[N@H+]1Cc1ccc(CNCc2cc[nH]c2)cc1 ZINC000175697841 1126785032 /nfs/dbraw/zinc/78/50/32/1126785032.db2.gz AZPNWTRZGNJYQP-MRXNPFEDSA-N 1 3 297.446 3.679 20 0 CHADHO CC[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCN(C(C)C)C2)CC1 ZINC000251698483 1126792947 /nfs/dbraw/zinc/79/29/47/1126792947.db2.gz IUKFUGFMWPVCHQ-ZACQAIPSSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@@H](CCCC(F)(F)F)[NH2+]CCCN1CCCC[C@H]1C ZINC000163194996 1126800339 /nfs/dbraw/zinc/80/03/39/1126800339.db2.gz RRTVLBURTXTRGY-UONOGXRCSA-N 1 3 294.405 3.962 20 0 CHADHO C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+][C@H]1CCC[C@H](N(C)C)C1 ZINC000484480417 1126821439 /nfs/dbraw/zinc/82/14/39/1126821439.db2.gz NPVIXUSVKAXUCB-BLBBIFAFSA-N 1 3 290.426 3.521 20 0 CHADHO CN1CCCC[C@@H]1CC[NH+]1CCC2(CCCC2)CC1 ZINC000351403199 1127189198 /nfs/dbraw/zinc/18/91/98/1127189198.db2.gz BVRRJKQPXJOEFM-MRXNPFEDSA-N 1 3 264.457 3.517 20 0 CHADHO CCN(CC)CCC[N@@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000351490637 1127190132 /nfs/dbraw/zinc/19/01/32/1127190132.db2.gz GLDHBZSUCAPTOX-QGZVFWFLSA-N 1 3 264.457 3.541 20 0 CHADHO CCN(CC)CCC[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000351490637 1127190136 /nfs/dbraw/zinc/19/01/36/1127190136.db2.gz GLDHBZSUCAPTOX-QGZVFWFLSA-N 1 3 264.457 3.541 20 0 CHADHO CC[NH+](CC)CCCN1CCC[C@]2(CC=CCC2)C1 ZINC000351490637 1127190138 /nfs/dbraw/zinc/19/01/38/1127190138.db2.gz GLDHBZSUCAPTOX-QGZVFWFLSA-N 1 3 264.457 3.541 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC2(C(F)(F)F)CCC2)CC1 ZINC000353949173 1127281962 /nfs/dbraw/zinc/28/19/62/1127281962.db2.gz ACHBXOGTNKKVFS-UHFFFAOYSA-N 1 3 292.389 3.572 20 0 CHADHO C[C@@H]1C[C@@H](NC2CC[NH+](C3CCC3)CC2)c2ccccc21 ZINC000289221461 1127377607 /nfs/dbraw/zinc/37/76/07/1127377607.db2.gz LHGKUXFFZPJLRO-AUUYWEPGSA-N 1 3 284.447 3.841 20 0 CHADHO CC[C@@H](NCC(C)(C)C[NH+]1CCCC1)c1ccccc1 ZINC000357853526 1127394728 /nfs/dbraw/zinc/39/47/28/1127394728.db2.gz PDZFAUNAAKXYRH-QGZVFWFLSA-N 1 3 274.452 3.849 20 0 CHADHO CC[C@@H]([NH2+]CC(C)(C)CN1CCCC1)c1ccccc1 ZINC000357853526 1127394730 /nfs/dbraw/zinc/39/47/30/1127394730.db2.gz PDZFAUNAAKXYRH-QGZVFWFLSA-N 1 3 274.452 3.849 20 0 CHADHO Cc1cc([C@H](C)NCc2cccc(C[NH+](C)C)c2)cs1 ZINC000296001806 1127659539 /nfs/dbraw/zinc/65/95/39/1127659539.db2.gz OKKSZGYRPHOJMK-AWEZNQCLSA-N 1 3 288.460 3.969 20 0 CHADHO C(CC1CCC1)CN1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000659944339 1127661630 /nfs/dbraw/zinc/66/16/30/1127661630.db2.gz JGIVIBGQDKLFEQ-QGZVFWFLSA-N 1 3 264.457 3.517 20 0 CHADHO CC(C)(C)N1CCC([NH2+]Cc2ccc3cc[nH]c3c2)CC1 ZINC000229638720 1127700894 /nfs/dbraw/zinc/70/08/94/1127700894.db2.gz IQACJWYZKWQIGG-UHFFFAOYSA-N 1 3 285.435 3.520 20 0 CHADHO C[C@@H](c1ccccc1Cl)N(C)CC[C@@H]1CCC[NH2+]C1 ZINC000062014443 1127730954 /nfs/dbraw/zinc/73/09/54/1127730954.db2.gz YSPNCVMOIQEYPU-KBPBESRZSA-N 1 3 280.843 3.723 20 0 CHADHO CCN(C)C[C@H]1CC[N@H+](C[C@H](C)CCc2ccccc2)C1 ZINC000539405105 1127922055 /nfs/dbraw/zinc/92/20/55/1127922055.db2.gz NAVCOJMDDVHJBN-IEBWSBKVSA-N 1 3 288.479 3.529 20 0 CHADHO CCN(C)C[C@H]1CC[N@@H+](C[C@H](C)CCc2ccccc2)C1 ZINC000539405105 1127922057 /nfs/dbraw/zinc/92/20/57/1127922057.db2.gz NAVCOJMDDVHJBN-IEBWSBKVSA-N 1 3 288.479 3.529 20 0 CHADHO CCC(C)(C)c1ccc(CN[C@@H]2CC[N@H+](C)C[C@H]2C)cc1 ZINC000540153085 1127964852 /nfs/dbraw/zinc/96/48/52/1127964852.db2.gz DTVBQEIJHIQFOQ-CRAIPNDOSA-N 1 3 288.479 3.804 20 0 CHADHO CCC(C)(C)c1ccc(CN[C@@H]2CC[N@@H+](C)C[C@H]2C)cc1 ZINC000540153085 1127964856 /nfs/dbraw/zinc/96/48/56/1127964856.db2.gz DTVBQEIJHIQFOQ-CRAIPNDOSA-N 1 3 288.479 3.804 20 0 CHADHO Cc1ccccc1[C@H](C)[NH2+]CC[C@@H](C)N1CCCCC1 ZINC000544374510 1127970595 /nfs/dbraw/zinc/97/05/95/1127970595.db2.gz RVEZLEBRXLLYEY-SJORKVTESA-N 1 3 274.452 3.910 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]CC[C@H](C)N2CCCCC2)s1 ZINC000544373898 1127970633 /nfs/dbraw/zinc/97/06/33/1127970633.db2.gz XIGVRJXOVPAHCV-ZFWWWQNUSA-N 1 3 280.481 3.972 20 0 CHADHO CC(C)[C@@H](NCCC[NH+](C)C)c1ccc(Cl)cc1 ZINC000540262235 1127971986 /nfs/dbraw/zinc/97/19/86/1127971986.db2.gz HTWPELYPVSEKJD-OAHLLOKOSA-N 1 3 268.832 3.578 20 0 CHADHO Cc1ccccc1[C@H]([NH2+]CC[C@@H]1CCCN1C)C(C)C ZINC000540360137 1127976783 /nfs/dbraw/zinc/97/67/83/1127976783.db2.gz PLTGFBXZLIFFGM-FUHWJXTLSA-N 1 3 274.452 3.766 20 0 CHADHO Cc1ccccc1[C@H](NCC[C@@H]1CCC[N@@H+]1C)C(C)C ZINC000540360137 1127976784 /nfs/dbraw/zinc/97/67/84/1127976784.db2.gz PLTGFBXZLIFFGM-FUHWJXTLSA-N 1 3 274.452 3.766 20 0 CHADHO Cc1ccccc1[C@H](NCC[C@@H]1CCC[N@H+]1C)C(C)C ZINC000540360137 1127976786 /nfs/dbraw/zinc/97/67/86/1127976786.db2.gz PLTGFBXZLIFFGM-FUHWJXTLSA-N 1 3 274.452 3.766 20 0 CHADHO C[C@H]1C[C@H](NCc2cccc(-c3ccccc3)c2)CC[N@@H+]1C ZINC000540606899 1127986295 /nfs/dbraw/zinc/98/62/95/1127986295.db2.gz INVUPOGQARTBOV-OXJNMPFZSA-N 1 3 294.442 3.926 20 0 CHADHO C[C@H]1C[C@H](NCc2cccc(-c3ccccc3)c2)CC[N@H+]1C ZINC000540606899 1127986297 /nfs/dbraw/zinc/98/62/97/1127986297.db2.gz INVUPOGQARTBOV-OXJNMPFZSA-N 1 3 294.442 3.926 20 0 CHADHO CCCN1CCC([N@H+](C)Cc2ccc(Cl)cc2C)CC1 ZINC000468394348 1128005031 /nfs/dbraw/zinc/00/50/31/1128005031.db2.gz TWGIJQKLDJKNFQ-UHFFFAOYSA-N 1 3 294.870 3.955 20 0 CHADHO CCCN1CCC([N@@H+](C)Cc2ccc(Cl)cc2C)CC1 ZINC000468394348 1128005034 /nfs/dbraw/zinc/00/50/34/1128005034.db2.gz TWGIJQKLDJKNFQ-UHFFFAOYSA-N 1 3 294.870 3.955 20 0 CHADHO Cc1cc(Cl)ccc1C[N@@H+](C)C1CCN(C(C)C)CC1 ZINC000468391830 1128005542 /nfs/dbraw/zinc/00/55/42/1128005542.db2.gz HMYCLZHSTGTBBD-UHFFFAOYSA-N 1 3 294.870 3.953 20 0 CHADHO Cc1cc(Cl)ccc1C[N@H+](C)C1CCN(C(C)C)CC1 ZINC000468391830 1128005545 /nfs/dbraw/zinc/00/55/45/1128005545.db2.gz HMYCLZHSTGTBBD-UHFFFAOYSA-N 1 3 294.870 3.953 20 0 CHADHO Cc1ccccc1-c1cccc(CN2CC[C@H]([NH3+])[C@@H](C)C2)c1 ZINC000469991650 1128060898 /nfs/dbraw/zinc/06/08/98/1128060898.db2.gz NCGPMTWWBNVFAO-JXFKEZNVSA-N 1 3 294.442 3.831 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1cccc(Cl)c1 ZINC000470363499 1128070466 /nfs/dbraw/zinc/07/04/66/1128070466.db2.gz RKRVTNOWHRKFKQ-KBRIMQKVSA-N 1 3 294.870 3.906 20 0 CHADHO CC(C)CN1CCC[C@@H](C[NH2+]C2CCCCCC2)C1 ZINC000557273964 1128097970 /nfs/dbraw/zinc/09/79/70/1128097970.db2.gz PPMWTHIWTMAFFD-INIZCTEOSA-N 1 3 266.473 3.667 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)c2c(C)oc3ccccc32)C1 ZINC000924707501 1128111049 /nfs/dbraw/zinc/11/10/49/1128111049.db2.gz USUMSLWDBPQVBH-DZGCQCFKSA-N 1 3 286.419 3.734 20 0 CHADHO CCC1([NH3+])CCN([C@H](C)c2cccc(C)c2C)CC1 ZINC000925755069 1128140340 /nfs/dbraw/zinc/14/03/40/1128140340.db2.gz BGFWSXLOSHUMBP-OAHLLOKOSA-N 1 3 260.425 3.568 20 0 CHADHO Cc1ccc2c(c1)[C@H](N[C@@H]1CCC[C@H]([NH+](C)C)C1)[C@H](C)C2 ZINC000493277689 1128137665 /nfs/dbraw/zinc/13/76/65/1128137665.db2.gz RGPXTPYPDFZADH-VYCZESIESA-N 1 3 286.463 3.691 20 0 CHADHO Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)[C@H](C)C2 ZINC000493277689 1128137668 /nfs/dbraw/zinc/13/76/68/1128137668.db2.gz RGPXTPYPDFZADH-VYCZESIESA-N 1 3 286.463 3.691 20 0 CHADHO CSc1ccc([C@@H](C)N[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000219233953 1128163438 /nfs/dbraw/zinc/16/34/38/1128163438.db2.gz LJMYAGNKCUUPPZ-GUTXKFCHSA-N 1 3 278.465 3.542 20 0 CHADHO CSc1ccc([C@@H](C)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000219233953 1128163441 /nfs/dbraw/zinc/16/34/41/1128163441.db2.gz LJMYAGNKCUUPPZ-GUTXKFCHSA-N 1 3 278.465 3.542 20 0 CHADHO Cc1cc(C)c(CN[C@@H](C)c2cccc(C[NH+](C)C)c2)cn1 ZINC000926552914 1128180103 /nfs/dbraw/zinc/18/01/03/1128180103.db2.gz ZSVSWXLKUWKJLV-INIZCTEOSA-N 1 3 297.446 3.611 20 0 CHADHO CCc1ccc(C[NH2+]C2CCN(CC(C)C)CC2)s1 ZINC000224738404 1128224561 /nfs/dbraw/zinc/22/45/61/1128224561.db2.gz RFFGWKQMGDMKGW-UHFFFAOYSA-N 1 3 280.481 3.521 20 0 CHADHO C[N@@H+]1CCC[C@@]2(CCN(Cc3ccc4ccccc4c3)C2)C1 ZINC000559310876 1128230711 /nfs/dbraw/zinc/23/07/11/1128230711.db2.gz GNPIVMICNLZURS-HXUWFJFHSA-N 1 3 294.442 3.758 20 0 CHADHO C[N@H+]1CCC[C@@]2(CCN(Cc3ccc4ccccc4c3)C2)C1 ZINC000559310876 1128230714 /nfs/dbraw/zinc/23/07/14/1128230714.db2.gz GNPIVMICNLZURS-HXUWFJFHSA-N 1 3 294.442 3.758 20 0 CHADHO C[C@H](Cc1ccccc1Cl)[NH2+][C@H]1CCC[C@@H](N(C)C)C1 ZINC000715278262 1128360050 /nfs/dbraw/zinc/36/00/50/1128360050.db2.gz PTBADRMSGITFFY-VNQPRFMTSA-N 1 3 294.870 3.733 20 0 CHADHO C[C@H](C[NH+]1CCC(N2CCCCC2)CC1)C(C)(C)C ZINC000670262157 1128373688 /nfs/dbraw/zinc/37/36/88/1128373688.db2.gz YTKHJOHKBUEISZ-OAHLLOKOSA-N 1 3 266.473 3.619 20 0 CHADHO C[C@@H](C[NH+]1CCC(N2CCCCC2)CC1)C(C)(C)C ZINC000670262156 1128373885 /nfs/dbraw/zinc/37/38/85/1128373885.db2.gz YTKHJOHKBUEISZ-HNNXBMFYSA-N 1 3 266.473 3.619 20 0 CHADHO C[C@H](CC[N@@H+]1CCC[C@@H](N(C)C)CC1)c1ccccc1 ZINC000562580090 1128411881 /nfs/dbraw/zinc/41/18/81/1128411881.db2.gz TWMMKOBAVNNLQG-SJLPKXTDSA-N 1 3 274.452 3.596 20 0 CHADHO C[C@H](CC[N@H+]1CCC[C@@H](N(C)C)CC1)c1ccccc1 ZINC000562580090 1128411882 /nfs/dbraw/zinc/41/18/82/1128411882.db2.gz TWMMKOBAVNNLQG-SJLPKXTDSA-N 1 3 274.452 3.596 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H](C)c2ccc(C(C)C)cc2)C1 ZINC000037643705 1128433757 /nfs/dbraw/zinc/43/37/57/1128433757.db2.gz VKYOMCKVEQZLCI-JKSUJKDBSA-N 1 3 274.452 3.802 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H](C)c2ccc(C(C)C)cc2)C1 ZINC000037643705 1128433760 /nfs/dbraw/zinc/43/37/60/1128433760.db2.gz VKYOMCKVEQZLCI-JKSUJKDBSA-N 1 3 274.452 3.802 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)c2ccc(C(C)C)cc2)C1 ZINC000037643705 1128433762 /nfs/dbraw/zinc/43/37/62/1128433762.db2.gz VKYOMCKVEQZLCI-JKSUJKDBSA-N 1 3 274.452 3.802 20 0 CHADHO CCN1CC[C@H](C[NH2+]C2CC(c3ccccc3Cl)C2)C1 ZINC000037644359 1128433820 /nfs/dbraw/zinc/43/38/20/1128433820.db2.gz ZLTGNCYMSDNESP-WLYUNCDWSA-N 1 3 292.854 3.517 20 0 CHADHO CCCc1ccc([C@@H](C)NC[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000037649255 1128435025 /nfs/dbraw/zinc/43/50/25/1128435025.db2.gz LTGCRVDHINGBPX-WBVHZDCISA-N 1 3 286.463 3.774 20 0 CHADHO CCCc1ccc([C@@H](C)NC[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000037649255 1128435027 /nfs/dbraw/zinc/43/50/27/1128435027.db2.gz LTGCRVDHINGBPX-WBVHZDCISA-N 1 3 286.463 3.774 20 0 CHADHO Cc1ccc([C@@H](C)NC[C@@H](C)C[NH+]2CCCC2)cc1C ZINC000062077617 1128436561 /nfs/dbraw/zinc/43/65/61/1128436561.db2.gz CEJNJRLZPKKRFX-RHSMWYFYSA-N 1 3 274.452 3.686 20 0 CHADHO CCc1ccc([C@@H](C)NC[C@@H](C)C[NH+]2CCCC2)cc1 ZINC000062078072 1128436569 /nfs/dbraw/zinc/43/65/69/1128436569.db2.gz SSWLAKJNUFMZHL-HZPDHXFCSA-N 1 3 274.452 3.632 20 0 CHADHO Cc1ccc(C2CC([NH2+]C[C@H](C)CN3CCCC3)C2)cc1 ZINC000062078459 1128437136 /nfs/dbraw/zinc/43/71/36/1128437136.db2.gz XJFFNHDMDDQBDF-IVMQYODDSA-N 1 3 286.463 3.563 20 0 CHADHO C[C@@H](CN[C@H](c1ccc(F)cc1)C1CC1)C[NH+]1CCCC1 ZINC000062078865 1128437404 /nfs/dbraw/zinc/43/74/04/1128437404.db2.gz SPELMIRFKKXAJV-KSSFIOAISA-N 1 3 290.426 3.598 20 0 CHADHO CC(C)=CCC[C@H](C)[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000125797231 1128454147 /nfs/dbraw/zinc/45/41/47/1128454147.db2.gz LYGMBDLOXJPNDT-DLBZAZTESA-N 1 3 266.473 3.831 20 0 CHADHO CSC(C)(C)C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000154211705 1128459430 /nfs/dbraw/zinc/45/94/30/1128459430.db2.gz RPRZUYXEYXJEMU-UHFFFAOYSA-N 1 3 284.513 3.515 20 0 CHADHO CCCCC[C@H](C)[N@H+](CCCN)C1CCCCC1 ZINC001257500382 1128509593 /nfs/dbraw/zinc/50/95/93/1128509593.db2.gz PNNACQKETWCBJM-HNNXBMFYSA-N 1 3 254.462 3.939 20 0 CHADHO CCCCC[C@H](C)[N@@H+](CCCN)C1CCCCC1 ZINC001257500382 1128509595 /nfs/dbraw/zinc/50/95/95/1128509595.db2.gz PNNACQKETWCBJM-HNNXBMFYSA-N 1 3 254.462 3.939 20 0 CHADHO Cc1cc([C@@H](C)NCc2ccc(C[NH3+])cc2)cc(C)c1F ZINC000565363395 1128524843 /nfs/dbraw/zinc/52/48/43/1128524843.db2.gz VWIQTQRCWYTYIK-CQSZACIVSA-N 1 3 286.394 3.752 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@@H]([N@@H+]2CC[C@]3(C2)CCCNC3)C1 ZINC000566230376 1128540634 /nfs/dbraw/zinc/54/06/34/1128540634.db2.gz KMJCHXRFFNPZHQ-HSALFYBXSA-N 1 3 298.474 3.572 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@@H]([N@H+]2CC[C@]3(C2)CCCNC3)C1 ZINC000566230376 1128540637 /nfs/dbraw/zinc/54/06/37/1128540637.db2.gz KMJCHXRFFNPZHQ-HSALFYBXSA-N 1 3 298.474 3.572 20 0 CHADHO C[C@H](N[C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000129775171 1128556039 /nfs/dbraw/zinc/55/60/39/1128556039.db2.gz HMAVMKMHARSIKG-ZRGWGRIASA-N 1 3 286.463 3.699 20 0 CHADHO C[C@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000129775171 1128556043 /nfs/dbraw/zinc/55/60/43/1128556043.db2.gz HMAVMKMHARSIKG-ZRGWGRIASA-N 1 3 286.463 3.699 20 0 CHADHO CCc1ccc(CNCCCC[N@@H+]2CCCC[C@@H]2C)o1 ZINC000130648390 1128590605 /nfs/dbraw/zinc/59/06/05/1128590605.db2.gz URABBVWHAPIMJF-HNNXBMFYSA-N 1 3 278.440 3.586 20 0 CHADHO CCc1ccc(CNCCCC[N@H+]2CCCC[C@@H]2C)o1 ZINC000130648390 1128590608 /nfs/dbraw/zinc/59/06/08/1128590608.db2.gz URABBVWHAPIMJF-HNNXBMFYSA-N 1 3 278.440 3.586 20 0 CHADHO C[C@H]1C[C@H](NCc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000073656712 1128646623 /nfs/dbraw/zinc/64/66/23/1128646623.db2.gz IXDNIBGGPCJLNV-FXAWDEMLSA-N 1 3 294.442 3.829 20 0 CHADHO C[C@H]1C[C@H](NCc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000073656712 1128646624 /nfs/dbraw/zinc/64/66/24/1128646624.db2.gz IXDNIBGGPCJLNV-FXAWDEMLSA-N 1 3 294.442 3.829 20 0 CHADHO Cc1cc(NCC[N@H+]2CCC[C@H](C)C2)c2ccccc2n1 ZINC000195667324 1128734987 /nfs/dbraw/zinc/73/49/87/1128734987.db2.gz NHBODNUGPUTQRC-AWEZNQCLSA-N 1 3 283.419 3.687 20 0 CHADHO Cc1cc(NCC[N@@H+]2CCC[C@H](C)C2)c2ccccc2n1 ZINC000195667324 1128734990 /nfs/dbraw/zinc/73/49/90/1128734990.db2.gz NHBODNUGPUTQRC-AWEZNQCLSA-N 1 3 283.419 3.687 20 0 CHADHO CC(C)CC(CC(C)C)[NH2+][C@@H]1CCNC2(CCC2)C1 ZINC000643546065 1117792353 /nfs/dbraw/zinc/79/23/53/1117792353.db2.gz HQBVVWXHFAZRIC-OAHLLOKOSA-N 1 3 266.473 3.712 20 0 CHADHO CCC[C@@H]([NH2+][C@H]1CCNC2(CCC2)C1)C1CCCC1 ZINC000643547245 1117797572 /nfs/dbraw/zinc/79/75/72/1117797572.db2.gz BVJZOTOAJZBYES-JKSUJKDBSA-N 1 3 264.457 3.610 20 0 CHADHO C[N@@H+]1CC[C@H](N[C@@H](CC2CC2)c2ccccc2)CC1(C)C ZINC000623431733 1117855641 /nfs/dbraw/zinc/85/56/41/1117855641.db2.gz OJMAKBIYVSJLLZ-ROUUACIJSA-N 1 3 286.463 3.990 20 0 CHADHO C[N@H+]1CC[C@H](N[C@@H](CC2CC2)c2ccccc2)CC1(C)C ZINC000623431733 1117855646 /nfs/dbraw/zinc/85/56/46/1117855646.db2.gz OJMAKBIYVSJLLZ-ROUUACIJSA-N 1 3 286.463 3.990 20 0 CHADHO CC[NH+](CC)C1CCN(C[C@@H]2CCC(C)=C[C@@H]2C)CC1 ZINC001208179448 1117857312 /nfs/dbraw/zinc/85/73/12/1117857312.db2.gz YHYSMMTUJWSMLF-IRXDYDNUSA-N 1 3 278.484 3.785 20 0 CHADHO CCCCCC[NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000185725251 1117879026 /nfs/dbraw/zinc/87/90/26/1117879026.db2.gz UOFUTKNBNHUFID-HZPDHXFCSA-N 1 3 266.473 3.809 20 0 CHADHO CC(C)[C@@H](C[NH2+]C[C@H]1CCCCN(C)C1)c1ccccc1 ZINC000623656802 1117884787 /nfs/dbraw/zinc/88/47/87/1117884787.db2.gz CELMSXRUZBHTOX-IEBWSBKVSA-N 1 3 288.479 3.748 20 0 CHADHO CC(C)Oc1ccc([C@@H](C)[NH2+]CC[C@H]2CCCN2C)cc1 ZINC000179535554 1117907598 /nfs/dbraw/zinc/90/75/98/1117907598.db2.gz YINPIIHMLYDOKZ-NVXWUHKLSA-N 1 3 290.451 3.609 20 0 CHADHO CC[C@H](C)[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000579288063 1128743088 /nfs/dbraw/zinc/74/30/88/1128743088.db2.gz IDMDKTJQHXIGKQ-DSLXNQLJSA-N 1 3 286.463 3.675 20 0 CHADHO CC(C)(C)[C@H]1CC[C@@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000579872167 1117966867 /nfs/dbraw/zinc/96/68/67/1117966867.db2.gz OHTRXIAVRYTYTG-IRXDYDNUSA-N 1 3 278.484 3.808 20 0 CHADHO CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000579872168 1117966925 /nfs/dbraw/zinc/96/69/25/1117966925.db2.gz OHTRXIAVRYTYTG-SJORKVTESA-N 1 3 278.484 3.808 20 0 CHADHO c1ccc([C@H]([NH2+]CCCN2CCCC2)C2CCC2)cc1 ZINC000119930494 1117968653 /nfs/dbraw/zinc/96/86/53/1117968653.db2.gz CGEFPUYTGGHDKA-SFHVURJKSA-N 1 3 272.436 3.603 20 0 CHADHO c1ccc([C@H](NCCC[NH+]2CCCC2)C2CCC2)cc1 ZINC000119930494 1117968657 /nfs/dbraw/zinc/96/86/57/1117968657.db2.gz CGEFPUYTGGHDKA-SFHVURJKSA-N 1 3 272.436 3.603 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccc(Cl)c(F)c1 ZINC000624122461 1117984809 /nfs/dbraw/zinc/98/48/09/1117984809.db2.gz RTCBCGDBDHGUEE-CHWSQXEVSA-N 1 3 298.833 3.862 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCCCN(C)C2)cc1C ZINC000624120429 1117985448 /nfs/dbraw/zinc/98/54/48/1117985448.db2.gz YWRSRYUBFZLOQS-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@H]2CCc3ccc(Cl)cc32)C1 ZINC000624121801 1117985633 /nfs/dbraw/zinc/98/56/33/1117985633.db2.gz DFAXQORYFKILPH-DYVFJYSZSA-N 1 3 292.854 3.649 20 0 CHADHO Cc1cccc(CC[C@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)c1 ZINC000624120665 1117986068 /nfs/dbraw/zinc/98/60/68/1117986068.db2.gz DPHCEYKUJMPWOZ-HKUYNNGSSA-N 1 3 288.479 3.638 20 0 CHADHO CC(C)[C@H](C[NH2+]C[C@@H]1CCN(C(C)C)C1)c1ccccc1 ZINC000232752745 1117988460 /nfs/dbraw/zinc/98/84/60/1117988460.db2.gz ULQLUEHZVOXXFG-HKUYNNGSSA-N 1 3 288.479 3.746 20 0 CHADHO CCC[C@@H](NCC[C@@H]1CCC[N@@H+]1C)c1ccccc1 ZINC000181788200 1118007534 /nfs/dbraw/zinc/00/75/34/1118007534.db2.gz FJUFIMFUAAPLOV-DLBZAZTESA-N 1 3 260.425 3.602 20 0 CHADHO CCC[C@@H](NCC[C@@H]1CCC[N@H+]1C)c1ccccc1 ZINC000181788200 1118007539 /nfs/dbraw/zinc/00/75/39/1118007539.db2.gz FJUFIMFUAAPLOV-DLBZAZTESA-N 1 3 260.425 3.602 20 0 CHADHO CCC[C@@H]([NH2+]CC[C@@H]1CCCN1C)c1ccccc1 ZINC000181788200 1118007544 /nfs/dbraw/zinc/00/75/44/1118007544.db2.gz FJUFIMFUAAPLOV-DLBZAZTESA-N 1 3 260.425 3.602 20 0 CHADHO CCc1ccc([C@@H](CC)[NH2+]C[C@@H]2CCN(CC)C2)cc1 ZINC000037644301 1118033697 /nfs/dbraw/zinc/03/36/97/1118033697.db2.gz OPCSDHWVIFNUBL-FUHWJXTLSA-N 1 3 274.452 3.632 20 0 CHADHO CCc1ccc([C@@H](CC)NC[C@@H]2CC[N@H+](CC)C2)cc1 ZINC000037644301 1118033701 /nfs/dbraw/zinc/03/37/01/1118033701.db2.gz OPCSDHWVIFNUBL-FUHWJXTLSA-N 1 3 274.452 3.632 20 0 CHADHO CCc1ccc([C@@H](CC)NC[C@@H]2CC[N@@H+](CC)C2)cc1 ZINC000037644301 1118033708 /nfs/dbraw/zinc/03/37/08/1118033708.db2.gz OPCSDHWVIFNUBL-FUHWJXTLSA-N 1 3 274.452 3.632 20 0 CHADHO Cc1ccc(CNC[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000076446101 1118072256 /nfs/dbraw/zinc/07/22/56/1118072256.db2.gz BUTFRVDTYXSJLB-HXUWFJFHSA-N 1 3 294.442 3.607 20 0 CHADHO Cc1ccc(CNC[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000076446101 1118072259 /nfs/dbraw/zinc/07/22/59/1118072259.db2.gz BUTFRVDTYXSJLB-HXUWFJFHSA-N 1 3 294.442 3.607 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)CSC(C)(C)C)CN1CCCCC1 ZINC000765240683 1118140084 /nfs/dbraw/zinc/14/00/84/1118140084.db2.gz WCELPZFMKDVMJI-GJZGRUSLSA-N 1 3 286.529 3.618 20 0 CHADHO Cc1cc2c(c(C)c1)[C@H](NC1CC[NH+](C3CCC3)CC1)CC2 ZINC000655702335 1118189438 /nfs/dbraw/zinc/18/94/38/1118189438.db2.gz UCUYARRDBGWXHN-LJQANCHMSA-N 1 3 298.474 3.897 20 0 CHADHO C[C@@H]1C[C@@H](C)CN(CCC[NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)C1 ZINC001648814906 1118222424 /nfs/dbraw/zinc/22/24/24/1118222424.db2.gz UIWRRQCFBNPTRT-DZVNLGKHSA-N 1 3 278.484 3.523 20 0 CHADHO CCCCCC[C@H](C)[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000715508921 1118308509 /nfs/dbraw/zinc/30/85/09/1118308509.db2.gz LTKUUMCWXPKYHH-ARFHVFGLSA-N 1 3 254.462 3.808 20 0 CHADHO CC(C)c1ccc(CN(C)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000123578125 1118339577 /nfs/dbraw/zinc/33/95/77/1118339577.db2.gz DBFCCOLSOIVMCP-YJBOKZPZSA-N 1 3 274.452 3.725 20 0 CHADHO CC(C)c1ccc(CN(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000123578125 1118339582 /nfs/dbraw/zinc/33/95/82/1118339582.db2.gz DBFCCOLSOIVMCP-YJBOKZPZSA-N 1 3 274.452 3.725 20 0 CHADHO Cc1ccccc1-c1cccc(CN2CC[C@@H]([NH3+])C[C@@H]2C)c1 ZINC000580841144 1118512578 /nfs/dbraw/zinc/51/25/78/1118512578.db2.gz IGZNFPCKQNYEMK-QFBILLFUSA-N 1 3 294.442 3.974 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CC[C@H](C)[C@@H](C)C1)CN1CCCCC1 ZINC000084987631 1118519629 /nfs/dbraw/zinc/51/96/29/1118519629.db2.gz BCUSXYCZYGAUMO-LTIDMASMSA-N 1 3 266.473 3.523 20 0 CHADHO CC[NH2+]CC1CCN([C@H](CC)c2ccc(F)cc2F)CC1 ZINC000430589824 1118576724 /nfs/dbraw/zinc/57/67/24/1118576724.db2.gz JCSGQDDXFAGQBV-QGZVFWFLSA-N 1 3 296.405 3.737 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@H](C)CCC(C)(C)C)C1 ZINC000306041020 1118583900 /nfs/dbraw/zinc/58/39/00/1118583900.db2.gz NGRJOWRHOPDJFB-CABCVRRESA-N 1 3 254.462 3.521 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)N(C)C[C@H]1CCC[N@H+](C)C1 ZINC000605421248 1118601567 /nfs/dbraw/zinc/60/15/67/1118601567.db2.gz NFXBEFAAFXVGQI-KGLIPLIRSA-N 1 3 280.843 3.675 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000605421248 1118601570 /nfs/dbraw/zinc/60/15/70/1118601570.db2.gz NFXBEFAAFXVGQI-KGLIPLIRSA-N 1 3 280.843 3.675 20 0 CHADHO C[C@H](Cc1ccsc1)N[C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000093516044 1118631373 /nfs/dbraw/zinc/63/13/73/1118631373.db2.gz HMISIGYAFMMJFU-YCPHGPKFSA-N 1 3 280.481 3.580 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+][C@H]1CCC[C@H]1CCCF ZINC000510756982 1118807251 /nfs/dbraw/zinc/80/72/51/1118807251.db2.gz UIIZUUKPIQAFBW-IKGGRYGDSA-N 1 3 284.463 3.759 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000510756984 1118807891 /nfs/dbraw/zinc/80/78/91/1118807891.db2.gz UIIZUUKPIQAFBW-ZACQAIPSSA-N 1 3 284.463 3.759 20 0 CHADHO C[C@H]1CCC[C@@H]([NH+]2CCC(NC3CC(C)(F)C3)CC2)C1 ZINC000449377795 1118817172 /nfs/dbraw/zinc/81/71/72/1118817172.db2.gz UOIZSQBZAHMIPA-MHABSNSOSA-N 1 3 282.447 3.510 20 0 CHADHO c1csc([C@@H](NC[C@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC000132152185 1118827338 /nfs/dbraw/zinc/82/73/38/1118827338.db2.gz UTRKZQYJDQJNBS-BBRMVZONSA-N 1 3 278.465 3.569 20 0 CHADHO CCN(C)C1CC[NH+](CC[C@H]2CC=C(C)C2(C)C)CC1 ZINC001207277238 1119010909 /nfs/dbraw/zinc/01/09/09/1119010909.db2.gz RCVTZABNDXGQHW-MRXNPFEDSA-N 1 3 278.484 3.785 20 0 CHADHO CCc1cccc(CNCc2cccc(C[NH+](C)C)c2)c1 ZINC000582305696 1119048178 /nfs/dbraw/zinc/04/81/78/1119048178.db2.gz KMNLFIYXCOUGOZ-UHFFFAOYSA-N 1 3 282.431 3.600 20 0 CHADHO CCSc1ccc([C@H](C)NC[C@H]2CCC[N@@H+]2CC)cc1 ZINC000535990245 1119337292 /nfs/dbraw/zinc/33/72/92/1119337292.db2.gz WZEUNXLWQFYYIT-GOEBONIOSA-N 1 3 292.492 3.934 20 0 CHADHO CCSc1ccc([C@H](C)NC[C@H]2CCC[N@H+]2CC)cc1 ZINC000535990245 1119337296 /nfs/dbraw/zinc/33/72/96/1119337296.db2.gz WZEUNXLWQFYYIT-GOEBONIOSA-N 1 3 292.492 3.934 20 0 CHADHO C[C@H](C[N@@H+]1CCC[C@@H](N(C)C)CC1)C1CCCCC1 ZINC000569628310 1119346633 /nfs/dbraw/zinc/34/66/33/1119346633.db2.gz ALWNAOSLOBRJAD-NVXWUHKLSA-N 1 3 266.473 3.619 20 0 CHADHO C[C@H](C[N@H+]1CCC[C@@H](N(C)C)CC1)C1CCCCC1 ZINC000569628310 1119346635 /nfs/dbraw/zinc/34/66/35/1119346635.db2.gz ALWNAOSLOBRJAD-NVXWUHKLSA-N 1 3 266.473 3.619 20 0 CHADHO CCCc1cccc(CNCc2ccccc2C[NH2+]C)c1 ZINC000650720693 1119380813 /nfs/dbraw/zinc/38/08/13/1119380813.db2.gz YXABWAHVNHBAHG-UHFFFAOYSA-N 1 3 282.431 3.648 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H](C)c2ccc(C)cc2C)C1 ZINC000151126520 1119405299 /nfs/dbraw/zinc/40/52/99/1119405299.db2.gz KRFGQEGXPQBAGA-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H](C)c2ccc(C)cc2C)C1 ZINC000151126520 1119405300 /nfs/dbraw/zinc/40/53/00/1119405300.db2.gz KRFGQEGXPQBAGA-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO C[C@@H]1C[C@@H]([N@@H+]2CCC[C@H]2C2CCCCC2)C[C@H](C)N1 ZINC000708386421 1119423470 /nfs/dbraw/zinc/42/34/70/1119423470.db2.gz MIINRQHBYMWJFW-FSDCSDTHSA-N 1 3 264.457 3.560 20 0 CHADHO C[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2C2CCCCC2)C[C@H](C)N1 ZINC000708386421 1119423471 /nfs/dbraw/zinc/42/34/71/1119423471.db2.gz MIINRQHBYMWJFW-FSDCSDTHSA-N 1 3 264.457 3.560 20 0 CHADHO CCC(C)(C)[C@@H](C)[NH2+]C1CCN(C2CCCC2)CC1 ZINC000584035354 1119464419 /nfs/dbraw/zinc/46/44/19/1119464419.db2.gz CNHCHKPYXGPIKD-CQSZACIVSA-N 1 3 266.473 3.808 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCc1cc(-c2ccccc2)cs1 ZINC000584409731 1119528588 /nfs/dbraw/zinc/52/85/88/1119528588.db2.gz DEHWUZZFRZJRSM-OLZOCXBDSA-N 1 3 274.433 3.631 20 0 CHADHO CCC1(C[NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000090219672 1119543446 /nfs/dbraw/zinc/54/34/46/1119543446.db2.gz YRTIQQWHRYCTRW-UHFFFAOYSA-N 1 3 264.457 3.563 20 0 CHADHO CC[NH+](CC)CCCNC1CC(c2cc(F)cc(F)c2)C1 ZINC000685425894 1119606057 /nfs/dbraw/zinc/60/60/57/1119606057.db2.gz HYVVNCYFDBYKJH-UHFFFAOYSA-N 1 3 296.405 3.532 20 0 CHADHO CCN(CC)CCC[NH2+]C1CC(c2cc(F)cc(F)c2)C1 ZINC000685425894 1119606059 /nfs/dbraw/zinc/60/60/59/1119606059.db2.gz HYVVNCYFDBYKJH-UHFFFAOYSA-N 1 3 296.405 3.532 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000685455660 1119610964 /nfs/dbraw/zinc/61/09/64/1119610964.db2.gz DYEPLTZXKGRUAL-ULQDDVLXSA-N 1 3 268.489 3.767 20 0 CHADHO CCCc1ccc(C[N@@H+]2CCC[C@@H]3CN(C)CC[C@H]32)cc1 ZINC000685470721 1119612298 /nfs/dbraw/zinc/61/22/98/1119612298.db2.gz LBZSUMNTSXDGKY-RTBURBONSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1ccc(C[N@H+]2CCC[C@@H]3CN(C)CC[C@H]32)cc1 ZINC000685470721 1119612300 /nfs/dbraw/zinc/61/23/00/1119612300.db2.gz LBZSUMNTSXDGKY-RTBURBONSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1ccc(CN2CCC[C@@H]3C[N@H+](C)CC[C@H]32)cc1 ZINC000685470721 1119612303 /nfs/dbraw/zinc/61/23/03/1119612303.db2.gz LBZSUMNTSXDGKY-RTBURBONSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1ccc(CN2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)cc1 ZINC000685470721 1119612304 /nfs/dbraw/zinc/61/23/04/1119612304.db2.gz LBZSUMNTSXDGKY-RTBURBONSA-N 1 3 286.463 3.555 20 0 CHADHO C[C@@H]([NH2+]C1CCN(C2CCCC2)CC1)C(C)(C)C(F)F ZINC000657899564 1119619549 /nfs/dbraw/zinc/61/95/49/1119619549.db2.gz CPABFDRQSBDUPV-GFCCVEGCSA-N 1 3 288.426 3.663 20 0 CHADHO CC(C)CN1CCC([NH2+]C[C@H]2C[C@@H]2c2ccccc2)CC1 ZINC000163440808 1119770422 /nfs/dbraw/zinc/77/04/22/1119770422.db2.gz BDXLQSAWMUYXSG-IEBWSBKVSA-N 1 3 286.463 3.500 20 0 CHADHO CCC[C@@H](NC[C@H]1CCC[N@H+](C)C1)c1ccsc1 ZINC000187711276 1120032437 /nfs/dbraw/zinc/03/24/37/1120032437.db2.gz SNJYAUDQMBSQGL-UKRRQHHQSA-N 1 3 266.454 3.521 20 0 CHADHO CCC[C@@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccsc1 ZINC000187711276 1120032441 /nfs/dbraw/zinc/03/24/41/1120032441.db2.gz SNJYAUDQMBSQGL-UKRRQHHQSA-N 1 3 266.454 3.521 20 0 CHADHO C[C@H](c1ccc(C(C)(C)C)cc1)N1CC[C@@H]([NH3+])[C@H](C)C1 ZINC000251538922 1128885784 /nfs/dbraw/zinc/88/57/84/1128885784.db2.gz ARIDXTVOXOLPDO-CKEIUWERSA-N 1 3 274.452 3.714 20 0 CHADHO c1csc(CN2CCC(C[NH+]3CCCCCC3)CC2)c1 ZINC000613644371 1120140190 /nfs/dbraw/zinc/14/01/90/1120140190.db2.gz AMLBRISBOYEHKL-UHFFFAOYSA-N 1 3 292.492 3.836 20 0 CHADHO CC1(C)[C@@H](c2ccccc2)[C@@H]1N[C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000629515987 1128913805 /nfs/dbraw/zinc/91/38/05/1128913805.db2.gz YSARZAAVXOXKTO-OYSTVDSJSA-N 1 3 298.474 3.689 20 0 CHADHO CCC[C@H](C)CCCN1CC[C@@H](C(F)(F)F)[C@H](C[NH3+])C1 ZINC000629564160 1128915992 /nfs/dbraw/zinc/91/59/92/1128915992.db2.gz RTKOLNLZPGCHEJ-BFHYXJOUSA-N 1 3 294.405 3.662 20 0 CHADHO C[C@H]1CC[NH2+]CC[C@@H]1N[C@@H]1CCCc2ccc(Cl)cc21 ZINC000629556420 1128916057 /nfs/dbraw/zinc/91/60/57/1128916057.db2.gz PJMHHRMLMGUKKA-AFAVFJNCSA-N 1 3 292.854 3.695 20 0 CHADHO CC(C)=CCC[NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000660257015 1120469931 /nfs/dbraw/zinc/46/99/31/1120469931.db2.gz PWZCBOHDTKVYQG-HOTGVXAUSA-N 1 3 264.457 3.585 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@@H+]1CC[C@@]2(C1)CCCNC2 ZINC001222141282 1120493115 /nfs/dbraw/zinc/49/31/15/1120493115.db2.gz JPHFZMQOIUTUMP-MSOLQXFVSA-N 1 3 278.484 3.835 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@H+]1CC[C@@]2(C1)CCCNC2 ZINC001222141282 1120493118 /nfs/dbraw/zinc/49/31/18/1120493118.db2.gz JPHFZMQOIUTUMP-MSOLQXFVSA-N 1 3 278.484 3.835 20 0 CHADHO CS[C@H](C[NH2+]C1CCN(C(C)(C)C)CC1)C(C)(C)C ZINC000543411498 1120515344 /nfs/dbraw/zinc/51/53/44/1120515344.db2.gz PEIRWEDUUDKEDP-CQSZACIVSA-N 1 3 286.529 3.617 20 0 CHADHO C[N@H+](CCCN1CCCC1)[C@@H]1CCc2c1cccc2Cl ZINC000499936998 1120553457 /nfs/dbraw/zinc/55/34/57/1120553457.db2.gz RJNSPDCOZLVJSB-QGZVFWFLSA-N 1 3 292.854 3.745 20 0 CHADHO C[N@@H+](CCCN1CCCC1)[C@@H]1CCc2c1cccc2Cl ZINC000499936998 1120553460 /nfs/dbraw/zinc/55/34/60/1120553460.db2.gz RJNSPDCOZLVJSB-QGZVFWFLSA-N 1 3 292.854 3.745 20 0 CHADHO CC[C@@H]1CCC[C@H]([NH2+]CCCN(C)C(C)C)CC1 ZINC000226334593 1120602013 /nfs/dbraw/zinc/60/20/13/1120602013.db2.gz ZQDCZGQTJCTVIL-CVEARBPZSA-N 1 3 254.462 3.665 20 0 CHADHO C[C@H]1C[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)CCS1 ZINC000922836466 1120607537 /nfs/dbraw/zinc/60/75/37/1120607537.db2.gz CIXCVFQDAGWFRZ-HOCLYGCPSA-N 1 3 296.524 3.657 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CC[C@]3(CC[N@H+](C)C3)C2)cc1 ZINC000429017186 1120617828 /nfs/dbraw/zinc/61/78/28/1120617828.db2.gz DUAZEDRIBQACLK-LPHOPBHVSA-N 1 3 286.463 3.899 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CC[C@]3(CC[N@@H+](C)C3)C2)cc1 ZINC000429017186 1120617832 /nfs/dbraw/zinc/61/78/32/1120617832.db2.gz DUAZEDRIBQACLK-LPHOPBHVSA-N 1 3 286.463 3.899 20 0 CHADHO c1ccc([C@H]2C[C@@H]2C[NH2+][C@H]2CCNC[C@@H]2C2CCCC2)cc1 ZINC000925712313 1120659029 /nfs/dbraw/zinc/65/90/29/1120659029.db2.gz OOIRIOUELURISR-WTGUMLROSA-N 1 3 298.474 3.548 20 0 CHADHO C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@]3(CCCNC3)C2)CC(C)(C)C1 ZINC000228080061 1120736657 /nfs/dbraw/zinc/73/66/57/1120736657.db2.gz XGVHUPSBOPHRGU-JFIYKMOQSA-N 1 3 278.484 3.667 20 0 CHADHO C[C@@H]1C[C@@H]([N@H+]2CCC[C@@]3(CCCNC3)C2)CC(C)(C)C1 ZINC000228080061 1120736661 /nfs/dbraw/zinc/73/66/61/1120736661.db2.gz XGVHUPSBOPHRGU-JFIYKMOQSA-N 1 3 278.484 3.667 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]C[C@H](C)c2ccccc2)C1 ZINC000249042227 1120879438 /nfs/dbraw/zinc/87/94/38/1120879438.db2.gz VATDKUSCLNFRAE-DLBZAZTESA-N 1 3 274.452 3.500 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H]2CCC(C)(C)C[C@H]2C)C1 ZINC000252117368 1120883862 /nfs/dbraw/zinc/88/38/62/1120883862.db2.gz KJYLCIXIBPTWOC-BZUAXINKSA-N 1 3 266.473 3.521 20 0 CHADHO C([NH2+][C@@H]1CCCC[C@@H]1C1CC1)[C@H]1CCCN(CC2CC2)C1 ZINC000663465107 1120980154 /nfs/dbraw/zinc/98/01/54/1120980154.db2.gz IBISMPHMZSYELW-BHIYHBOVSA-N 1 3 290.495 3.667 20 0 CHADHO FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663466331 1120981181 /nfs/dbraw/zinc/98/11/81/1120981181.db2.gz RAQGFPNTGVEPIY-SQNIBIBYSA-N 1 3 296.474 3.616 20 0 CHADHO CC(C)CC[C@@H](C)[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663470220 1120984944 /nfs/dbraw/zinc/98/49/44/1120984944.db2.gz SZGHQTXZRGXBKV-WBVHZDCISA-N 1 3 266.473 3.523 20 0 CHADHO C[C@H](Cc1coc2ccccc12)[NH2+][C@H]1CCNC2(CCC2)C1 ZINC000643548130 1121011959 /nfs/dbraw/zinc/01/19/59/1121011959.db2.gz MVDOYRHRNPNIOH-ZBFHGGJFSA-N 1 3 298.430 3.628 20 0 CHADHO C[C@H](Cc1coc2ccccc12)N[C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643548130 1121011963 /nfs/dbraw/zinc/01/19/63/1121011963.db2.gz MVDOYRHRNPNIOH-ZBFHGGJFSA-N 1 3 298.430 3.628 20 0 CHADHO CC(C)(C)N1CCC([NH2+]Cc2cccc(C3CC3)c2)CC1 ZINC000094519208 1121209367 /nfs/dbraw/zinc/20/93/67/1121209367.db2.gz OHQOYELEUDDVTG-UHFFFAOYSA-N 1 3 286.463 3.917 20 0 CHADHO CC(C)C[C@H](C)[NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000512334057 1121271037 /nfs/dbraw/zinc/27/10/37/1121271037.db2.gz ZFEWIPSLUFAGKA-ARFHVFGLSA-N 1 3 266.473 3.664 20 0 CHADHO CC(C)[NH+]1CCC(N[C@H]2C[C@H](C)c3ccccc32)CC1 ZINC000274223550 1121273517 /nfs/dbraw/zinc/27/35/17/1121273517.db2.gz OMQOOVNFFLAHNH-KSSFIOAISA-N 1 3 272.436 3.697 20 0 CHADHO CC[C@H](c1ccccc1)N1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000246241536 1121287272 /nfs/dbraw/zinc/28/72/72/1121287272.db2.gz UWNPGIRYSBHHRT-FUHWJXTLSA-N 1 3 272.436 3.555 20 0 CHADHO CC[C@H](c1ccccc1)[N@@H+]1CC[C@@H](CN2CCCC2)C1 ZINC000246241536 1121287277 /nfs/dbraw/zinc/28/72/77/1121287277.db2.gz UWNPGIRYSBHHRT-FUHWJXTLSA-N 1 3 272.436 3.555 20 0 CHADHO CC[C@H](c1ccccc1)[N@H+]1CC[C@@H](CN2CCCC2)C1 ZINC000246241536 1121287279 /nfs/dbraw/zinc/28/72/79/1121287279.db2.gz UWNPGIRYSBHHRT-FUHWJXTLSA-N 1 3 272.436 3.555 20 0 CHADHO [NH3+][C@@H]1C[C@@H](N[C@H]2CCSC3(CCC3)C2)c2ccccc21 ZINC000925857785 1121294345 /nfs/dbraw/zinc/29/43/45/1121294345.db2.gz IOSDUSWETHWPNJ-APHBMKBZSA-N 1 3 288.460 3.539 20 0 CHADHO CC[NH+]1CCC(NCc2ccc(F)c3ccccc23)CC1 ZINC000631035622 1128979968 /nfs/dbraw/zinc/97/99/68/1128979968.db2.gz SIYOKEGHTCWJOZ-UHFFFAOYSA-N 1 3 286.394 3.553 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@H]1CCCc2c(Cl)cccc21 ZINC000543599598 1121508615 /nfs/dbraw/zinc/50/86/15/1121508615.db2.gz CFSSWHYVMSPDHN-WBMJQRKESA-N 1 3 280.843 3.647 20 0 CHADHO C[C@@H]1CCCC[C@H]1[NH+]1CCC(N[C@@H]2CC23CCCC3)CC1 ZINC000429426373 1121575596 /nfs/dbraw/zinc/57/55/96/1121575596.db2.gz FVIABMUVKVHIHF-KBAYOESNSA-N 1 3 290.495 3.952 20 0 CHADHO CCN1CC[C@H](C[NH2+]CC[C@@H](C)CCC=C(C)C)C1 ZINC000512844338 1121622931 /nfs/dbraw/zinc/62/29/31/1121622931.db2.gz HHHLLOMNYVCMRX-DLBZAZTESA-N 1 3 266.473 3.690 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@H]2[N@H+](C)C[C@@H]2CCCNC2)cc1 ZINC000261747654 1121690347 /nfs/dbraw/zinc/69/03/47/1121690347.db2.gz BZWODTKXUVYZDN-NZSAHSFTSA-N 1 3 286.463 3.563 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@H]2[N@@H+](C)C[C@@H]2CCCNC2)cc1 ZINC000261747654 1121690351 /nfs/dbraw/zinc/69/03/51/1121690351.db2.gz BZWODTKXUVYZDN-NZSAHSFTSA-N 1 3 286.463 3.563 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@@H]2[N@H+](C)C[C@@H]2CCCNC2)cc1 ZINC000261747653 1121691143 /nfs/dbraw/zinc/69/11/43/1121691143.db2.gz BZWODTKXUVYZDN-NEWSRXKRSA-N 1 3 286.463 3.563 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@@H]2[N@@H+](C)C[C@@H]2CCCNC2)cc1 ZINC000261747653 1121691147 /nfs/dbraw/zinc/69/11/47/1121691147.db2.gz BZWODTKXUVYZDN-NEWSRXKRSA-N 1 3 286.463 3.563 20 0 CHADHO CC(C)(C)C1CCC([N@@H+]2CC[C@]3(C2)CCCNC3)CC1 ZINC000709968886 1121691902 /nfs/dbraw/zinc/69/19/02/1121691902.db2.gz CWKQTKJVESRDGZ-LEOMRAHMSA-N 1 3 278.484 3.667 20 0 CHADHO CC(C)(C)C1CCC([N@H+]2CC[C@]3(C2)CCCNC3)CC1 ZINC000709968886 1121691907 /nfs/dbraw/zinc/69/19/07/1121691907.db2.gz CWKQTKJVESRDGZ-LEOMRAHMSA-N 1 3 278.484 3.667 20 0 CHADHO CCCCN1CCC([NH2+][C@@H]2CCc3ccc(F)cc32)CC1 ZINC000164478226 1121700976 /nfs/dbraw/zinc/70/09/76/1121700976.db2.gz WBZSMEXDJBGOJN-GOSISDBHSA-N 1 3 290.426 3.667 20 0 CHADHO Cc1cc(C)c(/C=C/C[NH2+]C[C@@H]2CCN(C3CC3)C2)c(C)c1 ZINC001177226679 1121718809 /nfs/dbraw/zinc/71/88/09/1121718809.db2.gz VKEUIPLXUFVTPL-WRFKIARRSA-N 1 3 298.474 3.699 20 0 CHADHO CC1(C[NH2+]C2CCN(CC3CCCCC3)CC2)CCC1 ZINC001177580291 1121740018 /nfs/dbraw/zinc/74/00/18/1121740018.db2.gz DHGWXABOPIDSBM-UHFFFAOYSA-N 1 3 278.484 3.811 20 0 CHADHO C[NH+](C)CC[C@@H](NCc1cccc2ccoc21)C(C)(C)C ZINC001177823736 1121748756 /nfs/dbraw/zinc/74/87/56/1121748756.db2.gz YKXCKGFKBCANEY-MRXNPFEDSA-N 1 3 288.435 3.889 20 0 CHADHO CC1(C)CCC[C@H]([NH2+]C[C@H]2CCCN(CC3CC3)C2)C1 ZINC001179259529 1121866257 /nfs/dbraw/zinc/86/62/57/1121866257.db2.gz UTKWSZGSUMOJAZ-SJORKVTESA-N 1 3 278.484 3.667 20 0 CHADHO C[C@H]1CC([NH2+]C[C@@H]2CCCN(CC3CC3)C2)C[C@H](C)C1 ZINC001179266726 1121866324 /nfs/dbraw/zinc/86/63/24/1121866324.db2.gz WRHQOZFDLLEYHY-INMHGKMJSA-N 1 3 278.484 3.523 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN(C[C@H](C)c2ccc(C)cc2)C1 ZINC001179855703 1121916732 /nfs/dbraw/zinc/91/67/32/1121916732.db2.gz ZXNCDWKHERAEGS-ROUUACIJSA-N 1 3 288.479 3.762 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN(C[C@H](C)c2ccc(C)cc2)C1 ZINC001179855703 1121916740 /nfs/dbraw/zinc/91/67/40/1121916740.db2.gz ZXNCDWKHERAEGS-ROUUACIJSA-N 1 3 288.479 3.762 20 0 CHADHO CC(C)CCCCN1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC001179924866 1121922501 /nfs/dbraw/zinc/92/25/01/1121922501.db2.gz KQBNWIOJSFRRLE-AEFFLSMTSA-N 1 3 278.484 3.761 20 0 CHADHO CC(C)CCCCN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC001179924866 1121922506 /nfs/dbraw/zinc/92/25/06/1121922506.db2.gz KQBNWIOJSFRRLE-AEFFLSMTSA-N 1 3 278.484 3.761 20 0 CHADHO CCC[C@@H](C)[N@@H+]1CCC[C@@H](CN2CCC(C)CC2)C1 ZINC000501152282 1121960560 /nfs/dbraw/zinc/96/05/60/1121960560.db2.gz WZLKPTFPCUJIAQ-SJORKVTESA-N 1 3 266.473 3.619 20 0 CHADHO CCC[C@@H](C)[N@H+]1CCC[C@@H](CN2CCC(C)CC2)C1 ZINC000501152282 1121960563 /nfs/dbraw/zinc/96/05/63/1121960563.db2.gz WZLKPTFPCUJIAQ-SJORKVTESA-N 1 3 266.473 3.619 20 0 CHADHO CCC[N@H+](C[C@H](C)N)[C@@H](C)c1cc2ccccc2o1 ZINC000420295787 1121995431 /nfs/dbraw/zinc/99/54/31/1121995431.db2.gz ASNVLDYBTLLFRE-STQMWFEESA-N 1 3 260.381 3.553 20 0 CHADHO CCC[N@@H+](C[C@H](C)N)[C@@H](C)c1cc2ccccc2o1 ZINC000420295787 1121995437 /nfs/dbraw/zinc/99/54/37/1121995437.db2.gz ASNVLDYBTLLFRE-STQMWFEESA-N 1 3 260.381 3.553 20 0 CHADHO C[C@H](N)C[N@H+]([C@@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000420322912 1121995183 /nfs/dbraw/zinc/99/51/83/1121995183.db2.gz SSPKKZMHEXPACE-KBPBESRZSA-N 1 3 268.404 3.712 20 0 CHADHO C[C@H](N)C[N@@H+]([C@@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000420322912 1121995188 /nfs/dbraw/zinc/99/51/88/1121995188.db2.gz SSPKKZMHEXPACE-KBPBESRZSA-N 1 3 268.404 3.712 20 0 CHADHO CN1CCCC[C@@H]1CC[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420946055 1122048761 /nfs/dbraw/zinc/04/87/61/1122048761.db2.gz LMQIXPMOMHTETJ-UONOGXRCSA-N 1 3 292.389 3.525 20 0 CHADHO CN1CCCC[C@@H]1CC[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420946055 1122048754 /nfs/dbraw/zinc/04/87/54/1122048754.db2.gz LMQIXPMOMHTETJ-UONOGXRCSA-N 1 3 292.389 3.525 20 0 CHADHO C[C@@H](CC(C)(C)C)[NH2+]CC(C)(C)CN1CCCC1 ZINC001181426840 1122054639 /nfs/dbraw/zinc/05/46/39/1122054639.db2.gz FUQWCINNIVTPKY-AWEZNQCLSA-N 1 3 254.462 3.523 20 0 CHADHO CCCN(CCC[NH+](C)C)Cc1ccc2c(c1)CCCC2 ZINC001181514330 1122059877 /nfs/dbraw/zinc/05/98/77/1122059877.db2.gz FTSHOCMAQOGFCF-UHFFFAOYSA-N 1 3 288.479 3.729 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H](C)CCc1ccc(F)cc1F ZINC000513758576 1122152241 /nfs/dbraw/zinc/15/22/41/1122152241.db2.gz AASOQRCEABVORW-AWEZNQCLSA-N 1 3 298.421 3.607 20 0 CHADHO C(CC1CCCCC1)[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC001183096099 1122205979 /nfs/dbraw/zinc/20/59/79/1122205979.db2.gz ZXNNLUYFCYMJJP-GOSISDBHSA-N 1 3 278.484 3.668 20 0 CHADHO CC(C)(C)Oc1ccc(CN2CCC[C@](C)([NH3+])CC2)cc1 ZINC001205281296 1122240188 /nfs/dbraw/zinc/24/01/88/1122240188.db2.gz RUXXUYWJFJGHLC-SFHVURJKSA-N 1 3 290.451 3.567 20 0 CHADHO CCN(CC)CC[C@@H](C)[NH2+][C@@H](C)Cc1cccc(C)c1 ZINC001184418880 1122275878 /nfs/dbraw/zinc/27/58/78/1122275878.db2.gz SXOWRGYYRWCWAB-SJORKVTESA-N 1 3 276.468 3.636 20 0 CHADHO CC[C@@H]1CCC[C@H]([NH2+][C@@H](C)CCN(CC)CC)C1 ZINC001184418014 1122275947 /nfs/dbraw/zinc/27/59/47/1122275947.db2.gz JSXNDBVGUVCWED-XHSDSOJGSA-N 1 3 254.462 3.665 20 0 CHADHO CC(C)[C@@H](c1ccc(F)cc1)N(C)CC[C@@H]1CCC[N@@H+]1C ZINC000434623341 1122385064 /nfs/dbraw/zinc/38/50/64/1122385064.db2.gz LCEXWPIAPJFCIX-ROUUACIJSA-N 1 3 292.442 3.939 20 0 CHADHO CC(C)[C@@H](c1ccc(F)cc1)N(C)CC[C@@H]1CCC[N@H+]1C ZINC000434623341 1122385067 /nfs/dbraw/zinc/38/50/67/1122385067.db2.gz LCEXWPIAPJFCIX-ROUUACIJSA-N 1 3 292.442 3.939 20 0 CHADHO C[C@@H]1CCCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167960476 1122517748 /nfs/dbraw/zinc/51/77/48/1122517748.db2.gz ZEZPGRLEPVKOLO-POGJWJPPSA-N 1 3 276.468 3.560 20 0 CHADHO CC(C)C(CN[C@@H](CC[NH+](C)C)c1cccnc1)C(C)C ZINC001203749743 1122627869 /nfs/dbraw/zinc/62/78/69/1122627869.db2.gz BOXLXTWHDLBJQL-SFHVURJKSA-N 1 3 291.483 3.592 20 0 CHADHO C[C@H]1CCC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C1 ZINC001167962029 1122631142 /nfs/dbraw/zinc/63/11/42/1122631142.db2.gz SNWVWBVTEMCMAT-APXAPIIESA-N 1 3 276.468 3.560 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H](CCC(C)C)C2CC2)C1 ZINC000517042774 1122643331 /nfs/dbraw/zinc/64/33/31/1122643331.db2.gz ADVJPZKPNVNIMB-RDJZCZTQSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@H](CC[NH2+][C@@H](C)Cc1ccccc1F)N1CCCCC1 ZINC000437994822 1122670436 /nfs/dbraw/zinc/67/04/36/1122670436.db2.gz QFNQDKZMTHKNRD-JKSUJKDBSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@H](CCN[C@@H](C)Cc1ccccc1F)[NH+]1CCCCC1 ZINC000437994822 1122670437 /nfs/dbraw/zinc/67/04/37/1122670437.db2.gz QFNQDKZMTHKNRD-JKSUJKDBSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCC[C@@H]1c1ccccc1Cl)CN(C)C ZINC000425939315 1122671075 /nfs/dbraw/zinc/67/10/75/1122671075.db2.gz ZRNMTEMMPBUUHL-FRFSOERESA-N 1 3 294.870 3.763 20 0 CHADHO C[N@H+](C1CCCCC1)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167982138 1122900010 /nfs/dbraw/zinc/90/00/10/1122900010.db2.gz XYXIDMPNLFNHNP-JWTNVVGKSA-N 1 3 276.468 3.656 20 0 CHADHO C[N@@H+](C1CCCCC1)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167982138 1122900016 /nfs/dbraw/zinc/90/00/16/1122900016.db2.gz XYXIDMPNLFNHNP-JWTNVVGKSA-N 1 3 276.468 3.656 20 0 CHADHO C[C@@]1(F)CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001167985073 1122944814 /nfs/dbraw/zinc/94/48/14/1122944814.db2.gz UKLBPGWGWTWFDW-UJJTZGENSA-N 1 3 294.458 3.606 20 0 CHADHO C[C@@]1(F)CCC[N@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001167985073 1122944815 /nfs/dbraw/zinc/94/48/15/1122944815.db2.gz UKLBPGWGWTWFDW-UJJTZGENSA-N 1 3 294.458 3.606 20 0 CHADHO C[C@H]1CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C[C@H]1C ZINC001167985082 1122945456 /nfs/dbraw/zinc/94/54/56/1122945456.db2.gz VCVXMXPPJZBPML-FJSLRHLXSA-N 1 3 290.495 3.760 20 0 CHADHO C[C@H]1CCC[N@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C[C@H]1C ZINC001167985082 1122945459 /nfs/dbraw/zinc/94/54/59/1122945459.db2.gz VCVXMXPPJZBPML-FJSLRHLXSA-N 1 3 290.495 3.760 20 0 CHADHO C1=CC[C@@H](C[N@H+]2CCCC[C@@H]2CCN2CCCC2)CC1 ZINC001201418796 1123097278 /nfs/dbraw/zinc/09/72/78/1123097278.db2.gz SERFPZQKIGPJJT-QZTJIDSGSA-N 1 3 276.468 3.683 20 0 CHADHO C1=CC[C@@H](C[N@@H+]2CCCC[C@@H]2CCN2CCCC2)CC1 ZINC001201418796 1123097284 /nfs/dbraw/zinc/09/72/84/1123097284.db2.gz SERFPZQKIGPJJT-QZTJIDSGSA-N 1 3 276.468 3.683 20 0 CHADHO CCN(C)C1CC[NH+](C[C@H](C)CCC=C(C)C)CC1 ZINC001201497779 1123111333 /nfs/dbraw/zinc/11/13/33/1123111333.db2.gz YZTVYMPKBAOPSR-MRXNPFEDSA-N 1 3 266.473 3.785 20 0 CHADHO C[C@@H]1CC[C@@H]([NH2+]CC2(N)CCCC2)c2sccc21 ZINC000665246565 1123254145 /nfs/dbraw/zinc/25/41/45/1123254145.db2.gz IXAGBNNXZWLHHK-DGCLKSJQSA-N 1 3 264.438 3.548 20 0 CHADHO CC(C)C[C@@H](NCC[C@@H]([NH3+])C(C)C)c1cccs1 ZINC000665281126 1123312450 /nfs/dbraw/zinc/31/24/50/1123312450.db2.gz VISKCSZMGPEFSI-ZIAGYGMSSA-N 1 3 268.470 3.798 20 0 CHADHO Cc1cc([C@@H](NCC[C@@H]([NH3+])C(C)C)C2CC2)ccc1F ZINC000665280422 1123313968 /nfs/dbraw/zinc/31/39/68/1123313968.db2.gz ANBMTAQAZQPUTO-SJORKVTESA-N 1 3 278.415 3.548 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H](C)C2CCC(F)(F)CC2)C1 ZINC000474085264 1123423875 /nfs/dbraw/zinc/42/38/75/1123423875.db2.gz WTRABZBSVGHHEQ-KBPBESRZSA-N 1 3 288.426 3.522 20 0 CHADHO CC[C@@H](C[NH2+]C[C@@H]1CCCN(CC)C1)c1ccccc1 ZINC001648959940 1123439422 /nfs/dbraw/zinc/43/94/22/1123439422.db2.gz GEEIIJLOEOLHQE-IRXDYDNUSA-N 1 3 274.452 3.502 20 0 CHADHO CCc1ccc(C[NH2+]CCCN2CCC(C)CC2)s1 ZINC000051717335 1123469144 /nfs/dbraw/zinc/46/91/44/1123469144.db2.gz FGODAKCQZVBGLH-UHFFFAOYSA-N 1 3 280.481 3.522 20 0 CHADHO CC(C)C[C@H](C[N@@H+]1C[C@@H]2CCCN[C@@H]2C1)c1ccccc1 ZINC000474272478 1123499169 /nfs/dbraw/zinc/49/91/69/1123499169.db2.gz HATIKHGGGUCRBA-IPMKNSEASA-N 1 3 286.463 3.500 20 0 CHADHO CC(C)C[C@H](C[N@H+]1C[C@@H]2CCCN[C@@H]2C1)c1ccccc1 ZINC000474272478 1123499171 /nfs/dbraw/zinc/49/91/71/1123499171.db2.gz HATIKHGGGUCRBA-IPMKNSEASA-N 1 3 286.463 3.500 20 0 CHADHO CC1(C)CCC[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000157557038 1129129446 /nfs/dbraw/zinc/12/94/46/1129129446.db2.gz YXZSEFWCTOPQMV-KRWDZBQOSA-N 1 3 278.484 3.952 20 0 CHADHO CC(C)[C@@H]([NH2+]CC[C@@H](C)N1CCCCC1)c1cccnc1 ZINC000346855163 1123727218 /nfs/dbraw/zinc/72/72/18/1123727218.db2.gz CTCMVWWXABLMTO-SJLPKXTDSA-N 1 3 289.467 3.633 20 0 CHADHO C[C@H](CC[NH2+][C@H]1CCCc2sccc21)N1CCCCC1 ZINC000346876269 1123728778 /nfs/dbraw/zinc/72/87/78/1123728778.db2.gz JQNPUHWXVALQHM-ZBFHGGJFSA-N 1 3 292.492 3.980 20 0 CHADHO C[C@@H]1C[C@H](C[NH3+])CN1Cc1cc(-c2ccccc2)cs1 ZINC000469860037 1123757539 /nfs/dbraw/zinc/75/75/39/1123757539.db2.gz DRITXTWZOYNUOG-ZIAGYGMSSA-N 1 3 286.444 3.584 20 0 CHADHO Cc1ccc2nccc(NCC(C)(C)C[NH+](C)C)c2c1 ZINC000302107370 1123955193 /nfs/dbraw/zinc/95/51/93/1123955193.db2.gz AHSBUYJOGSFUMZ-UHFFFAOYSA-N 1 3 271.408 3.543 20 0 CHADHO C[C@H]1CC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)CS1 ZINC000655718432 1123998217 /nfs/dbraw/zinc/99/82/17/1123998217.db2.gz JKIUEZPRWGBBKT-HOCLYGCPSA-N 1 3 296.524 3.657 20 0 CHADHO C(C[C@@H]1CCCS1)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000865726299 1124008799 /nfs/dbraw/zinc/00/87/99/1124008799.db2.gz WTXWSODZYCLQJL-KRWDZBQOSA-N 1 3 296.524 3.659 20 0 CHADHO CCCc1cccc(C[NH2+]C2CC(N3CCCCC3)C2)c1 ZINC000475569590 1124015065 /nfs/dbraw/zinc/01/50/65/1124015065.db2.gz AQKBRGHQEPAHFJ-UHFFFAOYSA-N 1 3 286.463 3.746 20 0 CHADHO COc1ccc([C@H](C)[N@H+](C)CCCN2CCCCC2)cc1 ZINC000444574464 1124042494 /nfs/dbraw/zinc/04/24/94/1124042494.db2.gz QFAQNNJDKMRTNH-INIZCTEOSA-N 1 3 290.451 3.564 20 0 CHADHO COc1ccc([C@H](C)[N@@H+](C)CCCN2CCCCC2)cc1 ZINC000444574464 1124042500 /nfs/dbraw/zinc/04/25/00/1124042500.db2.gz QFAQNNJDKMRTNH-INIZCTEOSA-N 1 3 290.451 3.564 20 0 CHADHO CC[C@@H](NCc1cccc2c1CC[NH2+]C2)c1cccc(F)c1 ZINC000635007585 1129169205 /nfs/dbraw/zinc/16/92/05/1129169205.db2.gz DUVRQPMDZLOBRU-LJQANCHMSA-N 1 3 298.405 3.712 20 0 CHADHO CC[C@H](N[C@@H]1CC[NH2+]CC(C)(C)C1)c1ccc(OC)cc1 ZINC000635012184 1129170300 /nfs/dbraw/zinc/17/03/00/1129170300.db2.gz RPNMNCHFUUZRLP-WBVHZDCISA-N 1 3 290.451 3.514 20 0 CHADHO CC1(C)C[NH2+]CC[C@H](N[C@H](c2ccccc2)C2CC2)C1 ZINC000635008476 1129170607 /nfs/dbraw/zinc/17/06/07/1129170607.db2.gz DXDQOXZEZPXDSU-DLBZAZTESA-N 1 3 272.436 3.506 20 0 CHADHO C[C@@H]([NH2+]CC[C@@H]1CCCCN1C)c1cc2ccccc2o1 ZINC000526949596 1124527553 /nfs/dbraw/zinc/52/75/53/1124527553.db2.gz HDHCIEANHCUMIE-ZBFHGGJFSA-N 1 3 286.419 3.958 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2cccc3ccoc32)C[C@H]1C ZINC000449033237 1124637143 /nfs/dbraw/zinc/63/71/43/1124637143.db2.gz ZEIGBMOSWUASOA-RHSMWYFYSA-N 1 3 286.419 3.737 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2cccc3ccoc32)C[C@H]1C ZINC000449033237 1124637145 /nfs/dbraw/zinc/63/71/45/1124637145.db2.gz ZEIGBMOSWUASOA-RHSMWYFYSA-N 1 3 286.419 3.737 20 0 CHADHO CC[N@@H+]1CC[C@H](N[C@H]2CCCc3c(F)cccc32)[C@@H](C)C1 ZINC000449349857 1124697212 /nfs/dbraw/zinc/69/72/12/1124697212.db2.gz KNFVJMGQBVFWHY-KKXDTOCCSA-N 1 3 290.426 3.523 20 0 CHADHO CC[N@H+]1CC[C@H](N[C@H]2CCCc3c(F)cccc32)[C@@H](C)C1 ZINC000449349857 1124697215 /nfs/dbraw/zinc/69/72/15/1124697215.db2.gz KNFVJMGQBVFWHY-KKXDTOCCSA-N 1 3 290.426 3.523 20 0 CHADHO CC[NH+](CC)C[C@@H]1CCN(CCC2=CCCCC2)C1 ZINC000450460394 1125028920 /nfs/dbraw/zinc/02/89/20/1125028920.db2.gz NYTGTFXWEGTNIK-KRWDZBQOSA-N 1 3 264.457 3.541 20 0 CHADHO CCC(F)(F)C(C)(C)C[NH2+][C@H]1C[C@H](N)c2ccccc21 ZINC000530218427 1125134233 /nfs/dbraw/zinc/13/42/33/1125134233.db2.gz MLSGIQKDULDOJO-KBPBESRZSA-N 1 3 282.378 3.792 20 0 CHADHO CN1CCC2(CCC[N@@H+]2C[C@@H]2CCCC(C)(C)C2)CC1 ZINC000530442766 1125154168 /nfs/dbraw/zinc/15/41/68/1125154168.db2.gz KXHVFZIBVKLXHX-MRXNPFEDSA-N 1 3 278.484 3.763 20 0 CHADHO CN1CCC2(CCC[N@H+]2C[C@@H]2CCCC(C)(C)C2)CC1 ZINC000530442766 1125154170 /nfs/dbraw/zinc/15/41/70/1125154170.db2.gz KXHVFZIBVKLXHX-MRXNPFEDSA-N 1 3 278.484 3.763 20 0 CHADHO CCN1CC[C@H]([N@H+](C)C/C=C\c2ccccc2)C[C@H]1C ZINC000531381984 1125213998 /nfs/dbraw/zinc/21/39/98/1125213998.db2.gz QVAVCBJWJMQQIU-MPCXQGPMSA-N 1 3 272.436 3.504 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)C/C=C\c2ccccc2)C[C@H]1C ZINC000531381984 1125214000 /nfs/dbraw/zinc/21/40/00/1125214000.db2.gz QVAVCBJWJMQQIU-MPCXQGPMSA-N 1 3 272.436 3.504 20 0 CHADHO CCN1CC[C@H]([N@H+](C)C/C=C/c2ccccc2)C[C@H]1C ZINC000531381983 1125214226 /nfs/dbraw/zinc/21/42/26/1125214226.db2.gz QVAVCBJWJMQQIU-KDALUPEMSA-N 1 3 272.436 3.504 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)C/C=C/c2ccccc2)C[C@H]1C ZINC000531381983 1125214231 /nfs/dbraw/zinc/21/42/31/1125214231.db2.gz QVAVCBJWJMQQIU-KDALUPEMSA-N 1 3 272.436 3.504 20 0 CHADHO C[C@@H](CCN1CCC2(CCC2)C1)[N@@H+]1CCC2(CCC2)C1 ZINC000178316819 1129342705 /nfs/dbraw/zinc/34/27/05/1129342705.db2.gz ZMIMEQWQDGIMQS-INIZCTEOSA-N 1 3 276.468 3.517 20 0 CHADHO C[C@@H](CCN1CCC2(CCC2)C1)[N@H+]1CCC2(CCC2)C1 ZINC000178316819 1129342708 /nfs/dbraw/zinc/34/27/08/1129342708.db2.gz ZMIMEQWQDGIMQS-INIZCTEOSA-N 1 3 276.468 3.517 20 0 CHADHO C[C@@H](CC[N@@H+]1CCC2(CCC2)C1)N1CCC2(CCC2)C1 ZINC000178316819 1129342711 /nfs/dbraw/zinc/34/27/11/1129342711.db2.gz ZMIMEQWQDGIMQS-INIZCTEOSA-N 1 3 276.468 3.517 20 0 CHADHO C[C@@H](CC[N@H+]1CCC2(CCC2)C1)N1CCC2(CCC2)C1 ZINC000178316819 1129342715 /nfs/dbraw/zinc/34/27/15/1129342715.db2.gz ZMIMEQWQDGIMQS-INIZCTEOSA-N 1 3 276.468 3.517 20 0 CHADHO CC[N@@H+](Cc1ccoc1)C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000093818824 1129427571 /nfs/dbraw/zinc/42/75/71/1129427571.db2.gz XDJLMFIUSAHLPJ-SFHVURJKSA-N 1 3 298.430 3.624 20 0 CHADHO CC[N@H+](Cc1ccoc1)C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000093818824 1129427576 /nfs/dbraw/zinc/42/75/76/1129427576.db2.gz XDJLMFIUSAHLPJ-SFHVURJKSA-N 1 3 298.430 3.624 20 0 CHADHO C[C@H]1CCCC[N@@H+]1CCC1CCN(Cc2ccoc2)CC1 ZINC000093844579 1129428472 /nfs/dbraw/zinc/42/84/72/1129428472.db2.gz QEIUOKSAWYUGNI-INIZCTEOSA-N 1 3 290.451 3.756 20 0 CHADHO C[C@H]1CCCC[N@H+]1CCC1CCN(Cc2ccoc2)CC1 ZINC000093844579 1129428473 /nfs/dbraw/zinc/42/84/73/1129428473.db2.gz QEIUOKSAWYUGNI-INIZCTEOSA-N 1 3 290.451 3.756 20 0 CHADHO C[C@@H](N[C@@H]1CC12CC[NH2+]CC2)c1cc(Cl)ccc1Cl ZINC000643534454 1129444808 /nfs/dbraw/zinc/44/48/08/1129444808.db2.gz VLNOXIWBUGCIGL-QMTHXVAHSA-N 1 3 299.245 3.786 20 0 CHADHO Clc1ccc2c(c1)[C@@H](N[C@H]1CCC[NH2+]CC1)CCCC2 ZINC000643522687 1129444903 /nfs/dbraw/zinc/44/49/03/1129444903.db2.gz RVDDNDWAKJORPK-RDJZCZTQSA-N 1 3 292.854 3.839 20 0 CHADHO CCCC1CCC([N@H+]2C[C@H]3CN(CCC)C[C@H]3C2)CC1 ZINC001258534669 1129449886 /nfs/dbraw/zinc/44/98/86/1129449886.db2.gz NKZHSRBJLMBXNZ-ZTOOSOLZSA-N 1 3 278.484 3.619 20 0 CHADHO CCCC1CCC([N@@H+]2C[C@H]3CN(CCC)C[C@H]3C2)CC1 ZINC001258534669 1129449888 /nfs/dbraw/zinc/44/98/88/1129449888.db2.gz NKZHSRBJLMBXNZ-ZTOOSOLZSA-N 1 3 278.484 3.619 20 0 CHADHO C[C@@H]1SCC[C@H]1NC1CC[NH+]([C@H]2CCCC[C@H]2C)CC1 ZINC000647358842 1129575104 /nfs/dbraw/zinc/57/51/04/1129575104.db2.gz YNZKZQSBKZMAIF-WTTBNOFXSA-N 1 3 296.524 3.513 20 0 CHADHO C[C@@H]1SCC[C@@H]1NC1CC[NH+]([C@H]2CCCC[C@H]2C)CC1 ZINC000647358840 1129575147 /nfs/dbraw/zinc/57/51/47/1129575147.db2.gz YNZKZQSBKZMAIF-OHFALNGGSA-N 1 3 296.524 3.513 20 0 CHADHO Clc1ccc(C2(NC[C@@H]3CC[NH2+]C3)CCCCC2)cc1 ZINC000647892214 1129587011 /nfs/dbraw/zinc/58/70/11/1129587011.db2.gz CRJAUUOHCVWZIM-CQSZACIVSA-N 1 3 292.854 3.699 20 0 CHADHO CC[C@H]1CN(CCCc2cccc3ccccc32)CC[C@@H]1[NH3+] ZINC000647936279 1129588003 /nfs/dbraw/zinc/58/80/03/1129588003.db2.gz ATUGROIZTGPUIP-JXFKEZNVSA-N 1 3 296.458 3.832 20 0 CHADHO CC[C@H]1C[N@H+](CCCc2cccc3ccccc32)CC[C@@H]1N ZINC000647936279 1129588005 /nfs/dbraw/zinc/58/80/05/1129588005.db2.gz ATUGROIZTGPUIP-JXFKEZNVSA-N 1 3 296.458 3.832 20 0 CHADHO CC[C@H]1C[N@@H+](CCCc2cccc3ccccc32)CC[C@@H]1N ZINC000647936279 1129588009 /nfs/dbraw/zinc/58/80/09/1129588009.db2.gz ATUGROIZTGPUIP-JXFKEZNVSA-N 1 3 296.458 3.832 20 0 CHADHO C[C@@H](c1ccc(Cl)cc1)N1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000647970009 1129590288 /nfs/dbraw/zinc/59/02/88/1129590288.db2.gz RHIXHSKSKOHNSW-BBRMVZONSA-N 1 3 292.854 3.723 20 0 CHADHO CSC1CCC(CN[C@@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC000720556663 1129657389 /nfs/dbraw/zinc/65/73/89/1129657389.db2.gz JPSZCZFNSUHKDJ-DNDXXGFKSA-N 1 3 290.476 3.643 20 0 CHADHO Cc1ccc(Cl)c(CN2CCC[C@@H](C[NH3+])[C@@H](C)C2)c1F ZINC001205996566 1129690783 /nfs/dbraw/zinc/69/07/83/1129690783.db2.gz XHMVOSPLNGEWBR-STQMWFEESA-N 1 3 298.833 3.594 20 0 CHADHO CC(C)[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)N2C)c1ccccc1F ZINC001169101123 1129697938 /nfs/dbraw/zinc/69/79/38/1129697938.db2.gz OQWYQXVDAAGYQS-KRXQYRFLSA-N 1 3 290.426 3.738 20 0 CHADHO CC[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(C)cc1C ZINC001169116626 1129699878 /nfs/dbraw/zinc/69/98/78/1129699878.db2.gz RKKSCCFZEYIVLR-SFNKJDCFSA-N 1 3 286.463 3.969 20 0 CHADHO CC[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(C)cc1C ZINC001169116626 1129699880 /nfs/dbraw/zinc/69/98/80/1129699880.db2.gz RKKSCCFZEYIVLR-SFNKJDCFSA-N 1 3 286.463 3.969 20 0 CHADHO CC1(C)C[C@@H](Nc2c[nH]cc3ccnc2-3)C[C@](C)(C[NH3+])C1 ZINC001169142516 1129704572 /nfs/dbraw/zinc/70/45/72/1129704572.db2.gz HCBJSJZXTJRQTP-DYVFJYSZSA-N 1 3 286.423 3.519 20 0 CHADHO CC1(C)C[C@@H](Nc2cncc3cc[nH]c32)C[C@](C)(C[NH3+])C1 ZINC001169142516 1129704574 /nfs/dbraw/zinc/70/45/74/1129704574.db2.gz HCBJSJZXTJRQTP-DYVFJYSZSA-N 1 3 286.423 3.519 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)N(C)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169147185 1129704592 /nfs/dbraw/zinc/70/45/92/1129704592.db2.gz SWPRZCMKHLBVHJ-VZEFYGNVSA-N 1 3 292.854 3.958 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)N(C)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169147185 1129704594 /nfs/dbraw/zinc/70/45/94/1129704594.db2.gz SWPRZCMKHLBVHJ-VZEFYGNVSA-N 1 3 292.854 3.958 20 0 CHADHO CC[NH+]1CCC(N[C@@H](C)c2ccc(C)c(Cl)c2)CC1 ZINC001169232889 1129711195 /nfs/dbraw/zinc/71/11/95/1129711195.db2.gz HKWBTMDXXOSZER-ZDUSSCGKSA-N 1 3 280.843 3.783 20 0 CHADHO CCCCCC[C@H](CCC)[NH2+][C@H]1CCNC[C@H]1C ZINC001246212413 1131402161 /nfs/dbraw/zinc/40/21/61/1131402161.db2.gz VDILVXGMJVZWAX-PMPSAXMXSA-N 1 3 254.462 3.713 20 0 CHADHO CCCC[C@@H](CC)COCCC[NH2+][C@H]1CCNC(C)(C)C1 ZINC001246217587 1131405553 /nfs/dbraw/zinc/40/55/53/1131405553.db2.gz UGHCRBGXHSCCSZ-SJORKVTESA-N 1 3 298.515 3.730 20 0 CHADHO CCC(CC)[C@@H](NC[C@@H]([NH3+])CC(F)F)c1ccccc1 ZINC000903925600 1130209675 /nfs/dbraw/zinc/20/96/75/1130209675.db2.gz OUMFWYGWWBMGID-GOEBONIOSA-N 1 3 284.394 3.736 20 0 CHADHO CCN(C)C1CC[NH+]([C@@H](C)CCCC(C)C)CC1 ZINC001170090683 1130213926 /nfs/dbraw/zinc/21/39/26/1130213926.db2.gz NKDPDKOJNHXNDJ-HNNXBMFYSA-N 1 3 254.462 3.617 20 0 CHADHO C[C@H]1CC[C@H](N2CCC([NH3+])(c3ccc(Cl)cc3)CC2)C1 ZINC001170122406 1130282963 /nfs/dbraw/zinc/28/29/63/1130282963.db2.gz QDTAGZXFWCXVIX-BBRMVZONSA-N 1 3 292.854 3.778 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@@H](c2ccccc2)C2CCC2)C1 ZINC000791133277 1130354251 /nfs/dbraw/zinc/35/42/51/1130354251.db2.gz AEDNFTMHTWEHNL-OTWHNJEPSA-N 1 3 286.463 3.990 20 0 CHADHO C[NH+](C)[C@@H]1CCC[C@H](N[C@@H](c2ccccc2)C2CCC2)C1 ZINC000791133277 1130354257 /nfs/dbraw/zinc/35/42/57/1130354257.db2.gz AEDNFTMHTWEHNL-OTWHNJEPSA-N 1 3 286.463 3.990 20 0 CHADHO CCCCN1CCC([NH2+][C@@H](C)c2ccc(C)nc2C)CC1 ZINC000678415364 1130412736 /nfs/dbraw/zinc/41/27/36/1130412736.db2.gz BHEXXKMTCRNGIY-INIZCTEOSA-N 1 3 289.467 3.614 20 0 CHADHO CCOc1ccc([C@H](C)[NH2+]CC[C@H]2CCCCN2C)cc1 ZINC000678733861 1130448429 /nfs/dbraw/zinc/44/84/29/1130448429.db2.gz YTIXAYJPBBEWGB-DOTOQJQBSA-N 1 3 290.451 3.610 20 0 CHADHO CCC[NH+]1CCC(N(C)CC(C)(C)c2ccccc2)CC1 ZINC000678818334 1130460285 /nfs/dbraw/zinc/46/02/85/1130460285.db2.gz SJGDKCUBDVSSGQ-UHFFFAOYSA-N 1 3 288.479 3.770 20 0 CHADHO CCCCN1CCC([N@H+](C)Cc2ccc(C)s2)CC1 ZINC001204035785 1130477580 /nfs/dbraw/zinc/47/75/80/1130477580.db2.gz UVKHXPXJAXGNJB-UHFFFAOYSA-N 1 3 280.481 3.753 20 0 CHADHO CCCCN1CCC([N@@H+](C)Cc2ccc(C)s2)CC1 ZINC001204035785 1130477584 /nfs/dbraw/zinc/47/75/84/1130477584.db2.gz UVKHXPXJAXGNJB-UHFFFAOYSA-N 1 3 280.481 3.753 20 0 CHADHO Cc1ccc2ccccc2c1CN1CCC[C@]2(CC[NH2+]C2)C1 ZINC001234995120 1130701331 /nfs/dbraw/zinc/70/13/31/1130701331.db2.gz XROLXIRRVAULSX-HXUWFJFHSA-N 1 3 294.442 3.724 20 0 CHADHO C[C@@H](CCN1CCC[C@@]2(CC[NH2+]C2)C1)CC(C)(C)C ZINC001234991479 1130701370 /nfs/dbraw/zinc/70/13/70/1130701370.db2.gz HUCMWJKKJBRRKL-RDJZCZTQSA-N 1 3 266.473 3.524 20 0 CHADHO Cc1cc(C)c(CN2CCC[C@]3(CCC[NH2+]3)CC2)cc1C ZINC001235042355 1130705918 /nfs/dbraw/zinc/70/59/18/1130705918.db2.gz AVMVPEBWLVCSBN-LJQANCHMSA-N 1 3 286.463 3.720 20 0 CHADHO CC1=CC[C@H](CC[N@@H+]2CCCC23CCNCC3)C1(C)C ZINC001235141801 1130715256 /nfs/dbraw/zinc/71/52/56/1130715256.db2.gz ZBKIKBFBKJZADW-MRXNPFEDSA-N 1 3 276.468 3.587 20 0 CHADHO CC1=CC[C@H](CC[N@H+]2CCCC23CCNCC3)C1(C)C ZINC001235141801 1130715260 /nfs/dbraw/zinc/71/52/60/1130715260.db2.gz ZBKIKBFBKJZADW-MRXNPFEDSA-N 1 3 276.468 3.587 20 0 CHADHO Cc1ccccc1-c1ccccc1CN1C[C@@H]2C[C@H]1C[C@@H]2[NH3+] ZINC001235253806 1130726961 /nfs/dbraw/zinc/72/69/61/1130726961.db2.gz FFNHBLPWXPFONS-ZWOKBUDYSA-N 1 3 292.426 3.584 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CC[C@@]2(C1)CNCC[C@@H]2F ZINC001235403561 1130739372 /nfs/dbraw/zinc/73/93/72/1130739372.db2.gz LALPFNBYJQMTAC-OOUWWJCLSA-N 1 3 296.474 3.927 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CC[C@@]2(C1)CNCC[C@@H]2F ZINC001235403561 1130739374 /nfs/dbraw/zinc/73/93/74/1130739374.db2.gz LALPFNBYJQMTAC-OOUWWJCLSA-N 1 3 296.474 3.927 20 0 CHADHO CC/C=C\CCCCCCN1CC[C@@]2(C1)C[NH2+]CC[C@@H]2F ZINC001235403561 1130739376 /nfs/dbraw/zinc/73/93/76/1130739376.db2.gz LALPFNBYJQMTAC-OOUWWJCLSA-N 1 3 296.474 3.927 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CC[C@]2(C1)CNCC[C@@H]2F ZINC001235410506 1130740957 /nfs/dbraw/zinc/74/09/57/1130740957.db2.gz YILLZPCZUDEQSC-OKZBNKHCSA-N 1 3 296.474 3.783 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CC[C@]2(C1)CNCC[C@@H]2F ZINC001235410506 1130740961 /nfs/dbraw/zinc/74/09/61/1130740961.db2.gz YILLZPCZUDEQSC-OKZBNKHCSA-N 1 3 296.474 3.783 20 0 CHADHO Cc1cccc(N(C)c2ccc(CN(C)CCC[NH3+])cc2)c1 ZINC001235435379 1130743790 /nfs/dbraw/zinc/74/37/90/1130743790.db2.gz LXVBGSFGTVGTRM-UHFFFAOYSA-N 1 3 297.446 3.544 20 0 CHADHO CCCCN(CC[C@@H]1CCCC[NH2+]1)Cc1ccccc1 ZINC001235663572 1130763304 /nfs/dbraw/zinc/76/33/04/1130763304.db2.gz JABDVPAHDGJZFI-SFHVURJKSA-N 1 3 274.452 3.821 20 0 CHADHO CCCCc1ccc(CN(CC)C2CC[NH2+]CC2)cc1 ZINC001235759903 1130776298 /nfs/dbraw/zinc/77/62/98/1130776298.db2.gz FEPWMQALJKBSFO-UHFFFAOYSA-N 1 3 274.452 3.603 20 0 CHADHO CCCCc1ccc(C[N@H+](CC)C2CCNCC2)cc1 ZINC001235759903 1130776304 /nfs/dbraw/zinc/77/63/04/1130776304.db2.gz FEPWMQALJKBSFO-UHFFFAOYSA-N 1 3 274.452 3.603 20 0 CHADHO CCCCc1ccc(C[N@@H+](CC)C2CCNCC2)cc1 ZINC001235759903 1130776308 /nfs/dbraw/zinc/77/63/08/1130776308.db2.gz FEPWMQALJKBSFO-UHFFFAOYSA-N 1 3 274.452 3.603 20 0 CHADHO CCN(Cc1ccc(C2CCC2)cc1)C1CC[NH2+]CC1 ZINC001235764951 1130778889 /nfs/dbraw/zinc/77/88/89/1130778889.db2.gz UAPCZVQLYHVPOL-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO CC[N@H+](Cc1ccc(C2CCC2)cc1)C1CCNCC1 ZINC001235764951 1130778893 /nfs/dbraw/zinc/77/88/93/1130778893.db2.gz UAPCZVQLYHVPOL-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO CC[N@@H+](Cc1ccc(C2CCC2)cc1)C1CCNCC1 ZINC001235764951 1130778894 /nfs/dbraw/zinc/77/88/94/1130778894.db2.gz UAPCZVQLYHVPOL-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO [NH3+]C1CC2(C1)CN(Cc1ccc(C3CCCCC3)cc1)C2 ZINC001235819619 1130782632 /nfs/dbraw/zinc/78/26/32/1130782632.db2.gz GAMLUFOQCZGUCJ-UHFFFAOYSA-N 1 3 284.447 3.657 20 0 CHADHO [NH3+]CCCCN1CC[C@H](c2cccc(Cl)c2Cl)C1 ZINC001235885737 1130793521 /nfs/dbraw/zinc/79/35/21/1130793521.db2.gz XGCHPCVCDSFSBQ-NSHDSACASA-N 1 3 287.234 3.522 20 0 CHADHO NCC[C@@H]1CCC[N@@H+]1CC(c1ccccc1)c1ccccc1 ZINC001235925569 1130806122 /nfs/dbraw/zinc/80/61/22/1130806122.db2.gz VPEQEKMJYOZJBL-IBGZPJMESA-N 1 3 294.442 3.632 20 0 CHADHO NCC[C@@H]1CCC[N@H+]1CC(c1ccccc1)c1ccccc1 ZINC001235925569 1130806126 /nfs/dbraw/zinc/80/61/26/1130806126.db2.gz VPEQEKMJYOZJBL-IBGZPJMESA-N 1 3 294.442 3.632 20 0 CHADHO CC(C)[N@H+](CCN)Cc1ccc2oc3ccccc3c2c1 ZINC001235948118 1130812782 /nfs/dbraw/zinc/81/27/82/1130812782.db2.gz UMVMXGOCXBFNTM-UHFFFAOYSA-N 1 3 282.387 3.755 20 0 CHADHO CC(C)[N@@H+](CCN)Cc1ccc2oc3ccccc3c2c1 ZINC001235948118 1130812788 /nfs/dbraw/zinc/81/27/88/1130812788.db2.gz UMVMXGOCXBFNTM-UHFFFAOYSA-N 1 3 282.387 3.755 20 0 CHADHO Cc1ccc(-c2ccc(C[N@@H+]3C[C@H]4CC[C@]4(N)C3)cc2)cc1 ZINC001235995465 1130825121 /nfs/dbraw/zinc/82/51/21/1130825121.db2.gz VYRWCVVVYZONEA-UXHICEINSA-N 1 3 292.426 3.585 20 0 CHADHO Cc1ccc(-c2ccc(C[N@H+]3C[C@H]4CC[C@]4(N)C3)cc2)cc1 ZINC001235995465 1130825128 /nfs/dbraw/zinc/82/51/28/1130825128.db2.gz VYRWCVVVYZONEA-UXHICEINSA-N 1 3 292.426 3.585 20 0 CHADHO C[NH2+]C[C@H]1CCN(Cc2cccc3c4ccccc4oc32)C1 ZINC001236068909 1130847520 /nfs/dbraw/zinc/84/75/20/1130847520.db2.gz YQVQBFNOSYNXLX-CQSZACIVSA-N 1 3 294.398 3.627 20 0 CHADHO [NH3+]CCCCCCN1CCC[C@@H]1c1ccc(F)cc1F ZINC001236130007 1130871602 /nfs/dbraw/zinc/87/16/02/1130871602.db2.gz QGBDGEMHKOFWOO-MRXNPFEDSA-N 1 3 282.378 3.621 20 0 CHADHO CC[C@@H](N)C[N@H+](C)[C@H](C)c1cccc2ccccc21 ZINC001236189356 1130881267 /nfs/dbraw/zinc/88/12/67/1130881267.db2.gz LRJLSBCUDYAWJQ-UKRRQHHQSA-N 1 3 256.393 3.570 20 0 CHADHO CC[C@@H](N)C[N@@H+](C)[C@H](C)c1cccc2ccccc21 ZINC001236189356 1130881274 /nfs/dbraw/zinc/88/12/74/1130881274.db2.gz LRJLSBCUDYAWJQ-UKRRQHHQSA-N 1 3 256.393 3.570 20 0 CHADHO Cc1c2ccccc2sc1C[N@@H+](C)[C@H]1CCCC[C@H]1N ZINC001236218188 1130894268 /nfs/dbraw/zinc/89/42/68/1130894268.db2.gz RNANEDGEKBVAPA-CABCVRRESA-N 1 3 288.460 3.911 20 0 CHADHO Cc1c2ccccc2sc1C[N@H+](C)[C@H]1CCCC[C@H]1N ZINC001236218188 1130894272 /nfs/dbraw/zinc/89/42/72/1130894272.db2.gz RNANEDGEKBVAPA-CABCVRRESA-N 1 3 288.460 3.911 20 0 CHADHO CC(C)c1ccc(C[C@H](C)C[NH+]2CCCNCCC2)cc1 ZINC001236240597 1130901478 /nfs/dbraw/zinc/90/14/78/1130901478.db2.gz QATDCUKZCXJIPU-KRWDZBQOSA-N 1 3 288.479 3.674 20 0 CHADHO CCN(Cc1ccc(C)c2ccccc12)C[C@H]1CC[NH2+]C1 ZINC001236408007 1130931716 /nfs/dbraw/zinc/93/17/16/1130931716.db2.gz JIZUAIYUVRSVBN-INIZCTEOSA-N 1 3 282.431 3.580 20 0 CHADHO Clc1ccc(CN(CCC2CC2)C2CC[NH2+]CC2)cc1 ZINC001236452572 1130945470 /nfs/dbraw/zinc/94/54/70/1130945470.db2.gz GCLWNWQFAINQAN-UHFFFAOYSA-N 1 3 292.854 3.694 20 0 CHADHO Clc1ccc(C[N@H+](CCC2CC2)C2CCNCC2)cc1 ZINC001236452572 1130945474 /nfs/dbraw/zinc/94/54/74/1130945474.db2.gz GCLWNWQFAINQAN-UHFFFAOYSA-N 1 3 292.854 3.694 20 0 CHADHO Clc1ccc(C[N@@H+](CCC2CC2)C2CCNCC2)cc1 ZINC001236452572 1130945476 /nfs/dbraw/zinc/94/54/76/1130945476.db2.gz GCLWNWQFAINQAN-UHFFFAOYSA-N 1 3 292.854 3.694 20 0 CHADHO CC(C)(C)C[N@H+](Cc1ccc2[nH]ccc2c1)C1CCNCC1 ZINC001236456238 1130946137 /nfs/dbraw/zinc/94/61/37/1130946137.db2.gz AHKILBSXQSKXFD-UHFFFAOYSA-N 1 3 299.462 3.768 20 0 CHADHO CC(C)(C)C[N@@H+](Cc1ccc2[nH]ccc2c1)C1CCNCC1 ZINC001236456238 1130946138 /nfs/dbraw/zinc/94/61/38/1130946138.db2.gz AHKILBSXQSKXFD-UHFFFAOYSA-N 1 3 299.462 3.768 20 0 CHADHO Cc1cc(F)ccc1[C@H](C)[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000815586160 1131003755 /nfs/dbraw/zinc/00/37/55/1131003755.db2.gz ARDPKKYXXAOBCP-NUEKZKHPSA-N 1 3 278.415 3.658 20 0 CHADHO CCCN(Cc1cc2ccccc2s1)C[C@H]1CC[NH2+]C1 ZINC001236835351 1131019118 /nfs/dbraw/zinc/01/91/18/1131019118.db2.gz LUUSPMCBSIXFNG-AWEZNQCLSA-N 1 3 288.460 3.723 20 0 CHADHO CCCN(Cc1c[nH]c2c1cccc2CC)C[C@H]1CC[NH2+]C1 ZINC001236835571 1131020035 /nfs/dbraw/zinc/02/00/35/1131020035.db2.gz NJIGDPYXUQKKSV-HNNXBMFYSA-N 1 3 299.462 3.552 20 0 CHADHO CC(C)N(CC[C@H]1CCCC[NH2+]1)[C@@H](C)c1ccccc1 ZINC001236859286 1131025946 /nfs/dbraw/zinc/02/59/46/1131025946.db2.gz JDCCFICYIKVUQZ-FUHWJXTLSA-N 1 3 274.452 3.990 20 0 CHADHO CCC(CC)N(Cc1c[nH]c(N)[nH+]1)[C@H](C)c1ccccc1 ZINC001236860671 1131026224 /nfs/dbraw/zinc/02/62/24/1131026224.db2.gz SHJLTESZPYGIOH-CYBMUJFWSA-N 1 3 286.423 3.744 20 0 CHADHO CC/C=C\CCC[N@@H+]1Cc2ccccc2C12CCNCC2 ZINC001237300912 1131080877 /nfs/dbraw/zinc/08/08/77/1131080877.db2.gz QTYPOPJBGCGDGR-ARJAWSKDSA-N 1 3 284.447 3.827 20 0 CHADHO CC/C=C\CCC[N@H+]1Cc2ccccc2C12CCNCC2 ZINC001237300912 1131080883 /nfs/dbraw/zinc/08/08/83/1131080883.db2.gz QTYPOPJBGCGDGR-ARJAWSKDSA-N 1 3 284.447 3.827 20 0 CHADHO Cc1ccc(CN2CC[C@@H]3[NH2+]CCC[C@H]3C2)c2ccccc12 ZINC001237389108 1131095467 /nfs/dbraw/zinc/09/54/67/1131095467.db2.gz FSMDPPCAMJERQM-PXNSSMCTSA-N 1 3 294.442 3.722 20 0 CHADHO Cc1cc(C)c(Cl)c(CN(C)CC2CC[NH+](C)CC2)c1 ZINC001237705222 1131131522 /nfs/dbraw/zinc/13/15/22/1131131522.db2.gz ZXQYREGYCLNNTR-UHFFFAOYSA-N 1 3 294.870 3.730 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2ccnc(Cl)c2)cc1 ZINC000817961886 1131192774 /nfs/dbraw/zinc/19/27/74/1131192774.db2.gz CCEYNFRLOJWBGH-VXGBXAGGSA-N 1 3 289.810 3.606 20 0 CHADHO C1CC2(C1)C[C@@H]([NH2+][C@@H]1CC[C@@H]3CCCC[C@@H]3C1)CCN2 ZINC000817985063 1131195459 /nfs/dbraw/zinc/19/54/59/1131195459.db2.gz GFFITFXQTLVWCA-HZMVEIRTSA-N 1 3 276.468 3.610 20 0 CHADHO C[C@H](CC1CCCCC1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246316793 1131465702 /nfs/dbraw/zinc/46/57/02/1131465702.db2.gz UFSLLKFQVROVQW-SIXLDLHFSA-N 1 3 264.457 3.608 20 0 CHADHO CCCCCC1CCC([NH2+]C(C)(C)CCN)CC1 ZINC001246362405 1131487497 /nfs/dbraw/zinc/48/74/97/1131487497.db2.gz LDSUSFMMDOQMEK-UHFFFAOYSA-N 1 3 254.462 3.843 20 0 CHADHO CCN(CCC[NH+](C)C)Cc1sc2ccccc2c1C ZINC001138463683 1131509659 /nfs/dbraw/zinc/50/96/59/1131509659.db2.gz KVZDWQVIIPQVJA-UHFFFAOYSA-N 1 3 290.476 3.983 20 0 CHADHO CCC[C@H](C)CC[C@@H](C)N1CCC(F)(F)[C@@H](C[NH3+])C1 ZINC001246556594 1131618674 /nfs/dbraw/zinc/61/86/74/1131618674.db2.gz JRBAMKIHWTXMPW-MJBXVCDLSA-N 1 3 276.415 3.507 20 0 CHADHO CCCCC[C@H](CCC)[N@@H+]1CCC[C@H](CN)[C@H]1C ZINC001246564305 1131628628 /nfs/dbraw/zinc/62/86/28/1131628628.db2.gz MNHZRLPECFKWPV-OAGGEKHMSA-N 1 3 254.462 3.795 20 0 CHADHO CCCCC[C@H](CCC)[N@H+]1CCC[C@H](CN)[C@H]1C ZINC001246564305 1131628630 /nfs/dbraw/zinc/62/86/30/1131628630.db2.gz MNHZRLPECFKWPV-OAGGEKHMSA-N 1 3 254.462 3.795 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[N@@H+]1CC[C@]2(C1)CCCNC2 ZINC001246602847 1131714895 /nfs/dbraw/zinc/71/48/95/1131714895.db2.gz JTCKKYDZQXYUJT-YESZJQIVSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[N@H+]1CC[C@]2(C1)CCCNC2 ZINC001246602847 1131714899 /nfs/dbraw/zinc/71/48/99/1131714899.db2.gz JTCKKYDZQXYUJT-YESZJQIVSA-N 1 3 266.473 3.523 20 0 CHADHO CCCC[C@H]1C[C@@H]([NH+]2CCC(C(C)C)CC2)CCN1 ZINC001246843483 1131788887 /nfs/dbraw/zinc/78/88/87/1131788887.db2.gz CSMFLXZXOGCQNT-IRXDYDNUSA-N 1 3 266.473 3.665 20 0 CHADHO C[N@H+](CC1CCCCC1)[C@@H]1CCN[C@H](C(C)(C)C)C1 ZINC001246847276 1131789632 /nfs/dbraw/zinc/78/96/32/1131789632.db2.gz RTQHYWRZLVJFLT-CVEARBPZSA-N 1 3 266.473 3.665 20 0 CHADHO C[N@@H+](CC1CCCCC1)[C@@H]1CCN[C@H](C(C)(C)C)C1 ZINC001246847276 1131789641 /nfs/dbraw/zinc/78/96/41/1131789641.db2.gz RTQHYWRZLVJFLT-CVEARBPZSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC000036968096 1131982275 /nfs/dbraw/zinc/98/22/75/1131982275.db2.gz MAMULAUWASPGRH-HQSKLWIPSA-N 1 3 290.426 3.738 20 0 CHADHO CC(C)[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC000036968096 1131982280 /nfs/dbraw/zinc/98/22/80/1131982280.db2.gz MAMULAUWASPGRH-HQSKLWIPSA-N 1 3 290.426 3.738 20 0 CHADHO CN1C(C)(C)CC([N@@H+]2CCc3ccccc3C2)CC1(C)C ZINC001171628878 1132060514 /nfs/dbraw/zinc/06/05/14/1132060514.db2.gz KXCZROCWQKYGFW-UHFFFAOYSA-N 1 3 286.463 3.696 20 0 CHADHO CN1C(C)(C)CC([N@H+]2CCc3ccccc3C2)CC1(C)C ZINC001171628878 1132060521 /nfs/dbraw/zinc/06/05/21/1132060521.db2.gz KXCZROCWQKYGFW-UHFFFAOYSA-N 1 3 286.463 3.696 20 0 CHADHO C[NH+]1C(C)(C)CC(N2CCc3ccccc3C2)CC1(C)C ZINC001171628878 1132060528 /nfs/dbraw/zinc/06/05/28/1132060528.db2.gz KXCZROCWQKYGFW-UHFFFAOYSA-N 1 3 286.463 3.696 20 0 CHADHO CN1C(C)(C)CC([NH2+]C2CCC(F)(F)CC2)CC1(C)C ZINC001171614276 1132064933 /nfs/dbraw/zinc/06/49/33/1132064933.db2.gz WSSWMRRAHQIMHB-UHFFFAOYSA-N 1 3 288.426 3.805 20 0 CHADHO Cc1ccc(CC[C@H](C)[NH2+][C@H]2CCC[C@H](N(C)C)C2)cc1 ZINC001171664334 1132072550 /nfs/dbraw/zinc/07/25/50/1132072550.db2.gz XWIQTEFHLUFHLT-WDSOQIARSA-N 1 3 288.479 3.779 20 0 CHADHO CN1C(C)(C)CC([N@H+](C)C[C@H]2CC2(C)C)CC1(C)C ZINC001171639609 1132081405 /nfs/dbraw/zinc/08/14/05/1132081405.db2.gz QGGWGWGJAZYZJE-CYBMUJFWSA-N 1 3 266.473 3.616 20 0 CHADHO CN1C(C)(C)CC([N@@H+](C)C[C@H]2CC2(C)C)CC1(C)C ZINC001171639609 1132081410 /nfs/dbraw/zinc/08/14/10/1132081410.db2.gz QGGWGWGJAZYZJE-CYBMUJFWSA-N 1 3 266.473 3.616 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CC[C@H]3CCCC[C@@H]3C1)C2 ZINC001172131038 1132127356 /nfs/dbraw/zinc/12/73/56/1132127356.db2.gz UCVHNSNFTYFCNE-HSFUPAIVSA-N 1 3 276.468 3.514 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CC[C@H]3CCCC[C@@H]3C1)C2 ZINC001172131038 1132127358 /nfs/dbraw/zinc/12/73/58/1132127358.db2.gz UCVHNSNFTYFCNE-HSFUPAIVSA-N 1 3 276.468 3.514 20 0 CHADHO CCN(Cc1ccc(F)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172128590 1132128111 /nfs/dbraw/zinc/12/81/11/1132128111.db2.gz SOACLEDMOCQTPI-BCDXTJNWSA-N 1 3 290.426 3.663 20 0 CHADHO CCN(Cc1ccc(F)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172128590 1132128114 /nfs/dbraw/zinc/12/81/14/1132128114.db2.gz SOACLEDMOCQTPI-BCDXTJNWSA-N 1 3 290.426 3.663 20 0 CHADHO CC[C@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001172107587 1132130644 /nfs/dbraw/zinc/13/06/44/1132130644.db2.gz FPFSCUJUAXIAIS-FJIDUMEYSA-N 1 3 290.426 3.882 20 0 CHADHO CC[C@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001172107587 1132130647 /nfs/dbraw/zinc/13/06/47/1132130647.db2.gz FPFSCUJUAXIAIS-FJIDUMEYSA-N 1 3 290.426 3.882 20 0 CHADHO Cc1cc(C)cc([C@@H](C)N[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC001172111523 1132134530 /nfs/dbraw/zinc/13/45/30/1132134530.db2.gz RYLZSDDOPAZQCX-OQIJWPOYSA-N 1 3 286.463 3.969 20 0 CHADHO Cc1cc(C)cc([C@@H](C)N[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC001172111523 1132134533 /nfs/dbraw/zinc/13/45/33/1132134533.db2.gz RYLZSDDOPAZQCX-OQIJWPOYSA-N 1 3 286.463 3.969 20 0 CHADHO CC(C)P(CC[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)N2C)C(C)C ZINC001172111874 1132134569 /nfs/dbraw/zinc/13/45/69/1132134569.db2.gz XMKIPZLQZFZOFO-OSYLJGHBSA-N 1 3 298.455 3.890 20 0 CHADHO CC[C@H](CC(C)C)[N@H+](CCCN)C1CCCCC1 ZINC001172384189 1132209715 /nfs/dbraw/zinc/20/97/15/1132209715.db2.gz FEQZJFGUMZADGP-OAHLLOKOSA-N 1 3 254.462 3.795 20 0 CHADHO CC[C@H](CC(C)C)[N@@H+](CCCN)C1CCCCC1 ZINC001172384189 1132209722 /nfs/dbraw/zinc/20/97/22/1132209722.db2.gz FEQZJFGUMZADGP-OAHLLOKOSA-N 1 3 254.462 3.795 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001172560599 1132268242 /nfs/dbraw/zinc/26/82/42/1132268242.db2.gz PTLYYVSDQLWZBM-AKHDSKFASA-N 1 3 286.463 3.785 20 0 CHADHO CCCOC1CCC([N@H+](CCCN)C2CCCCC2)CC1 ZINC001173091772 1132384067 /nfs/dbraw/zinc/38/40/67/1132384067.db2.gz ZMKYEKBQRWYTMS-UHFFFAOYSA-N 1 3 296.499 3.708 20 0 CHADHO CCCOC1CCC([N@@H+](CCCN)C2CCCCC2)CC1 ZINC001173091772 1132384076 /nfs/dbraw/zinc/38/40/76/1132384076.db2.gz ZMKYEKBQRWYTMS-UHFFFAOYSA-N 1 3 296.499 3.708 20 0 CHADHO C[N@H+](CCc1cccc(Cl)c1)Cc1cc2cnccc2[nH]1 ZINC001232014262 1132410978 /nfs/dbraw/zinc/41/09/78/1132410978.db2.gz MMWQZMTXPCNQNX-UHFFFAOYSA-N 1 3 299.805 3.891 20 0 CHADHO C[N@@H+](CCc1cccc(Cl)c1)Cc1cc2cnccc2[nH]1 ZINC001232014262 1132410981 /nfs/dbraw/zinc/41/09/81/1132410981.db2.gz MMWQZMTXPCNQNX-UHFFFAOYSA-N 1 3 299.805 3.891 20 0 CHADHO c1c2cnccc2[nH]c1C[N@@H+]1CCC2(C1)CCCCC2 ZINC001232018440 1132412774 /nfs/dbraw/zinc/41/27/74/1132412774.db2.gz LFIBBHDCIXHOTQ-UHFFFAOYSA-N 1 3 269.392 3.719 20 0 CHADHO c1c2cnccc2[nH]c1C[N@H+]1CCC2(C1)CCCCC2 ZINC001232018440 1132412777 /nfs/dbraw/zinc/41/27/77/1132412777.db2.gz LFIBBHDCIXHOTQ-UHFFFAOYSA-N 1 3 269.392 3.719 20 0 CHADHO C[C@H](CC(c1ccccc1)c1ccccc1)[NH2+]C[C@@H](C)CN ZINC001173209966 1132416501 /nfs/dbraw/zinc/41/65/01/1132416501.db2.gz HRULUHCAPBBVPF-DLBZAZTESA-N 1 3 296.458 3.782 20 0 CHADHO CCCC[C@@H](CC(C)C)[NH2+]CCCN1CCCC1 ZINC001173247562 1132419192 /nfs/dbraw/zinc/41/91/92/1132419192.db2.gz WSNJMTWWPQXLPT-INIZCTEOSA-N 1 3 254.462 3.667 20 0 CHADHO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc(F)cc(CN(C)C)c1 ZINC001232144205 1132427007 /nfs/dbraw/zinc/42/70/07/1132427007.db2.gz KGBIVJCTXTVSHY-OKILXGFUSA-N 1 3 278.415 3.650 20 0 CHADHO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cc(F)cc(CN(C)C)c1 ZINC001232144205 1132427009 /nfs/dbraw/zinc/42/70/09/1132427009.db2.gz KGBIVJCTXTVSHY-OKILXGFUSA-N 1 3 278.415 3.650 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@@H+]2CCCC3(CCC3)C2)c1 ZINC001232148300 1132428022 /nfs/dbraw/zinc/42/80/22/1132428022.db2.gz BAPJISQVTFAQGK-UHFFFAOYSA-N 1 3 290.426 3.653 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@H+]2CCCC3(CCC3)C2)c1 ZINC001232148300 1132428028 /nfs/dbraw/zinc/42/80/28/1132428028.db2.gz BAPJISQVTFAQGK-UHFFFAOYSA-N 1 3 290.426 3.653 20 0 CHADHO CC[C@@H]1CCC[N@H+](Cc2cc(F)cc(CN(C)C)c2)C1 ZINC001232146668 1132428702 /nfs/dbraw/zinc/42/87/02/1132428702.db2.gz XROZRVAECPQCEB-CQSZACIVSA-N 1 3 278.415 3.509 20 0 CHADHO CC[C@@H]1CCC[N@@H+](Cc2cc(F)cc(CN(C)C)c2)C1 ZINC001232146668 1132428703 /nfs/dbraw/zinc/42/87/03/1132428703.db2.gz XROZRVAECPQCEB-CQSZACIVSA-N 1 3 278.415 3.509 20 0 CHADHO CC[C@H]1CC[C@@H]([NH+]2C(C)(C)CC(N)CC2(C)C)C1 ZINC001173261828 1132428998 /nfs/dbraw/zinc/42/89/98/1132428998.db2.gz DGINHYKBYWIJSO-GXTWGEPZSA-N 1 3 252.446 3.545 20 0 CHADHO CCC(CC)N1CCC([NH2+][C@@H]2CC[C@@H](CC)C2)CC1 ZINC001173270179 1132435299 /nfs/dbraw/zinc/43/52/99/1132435299.db2.gz BAZOCPQWCXWKLU-GDBMZVCRSA-N 1 3 266.473 3.808 20 0 CHADHO CC[C@@H]1CC[C@@H]([N@@H+](Cc2ccccc2)C[C@@H](C)CN)C1 ZINC001173272852 1132437355 /nfs/dbraw/zinc/43/73/55/1132437355.db2.gz LNLCIFRWRUKATM-LZLYRXPVSA-N 1 3 274.452 3.662 20 0 CHADHO CC[C@@H]1CC[C@@H]([N@H+](Cc2ccccc2)C[C@@H](C)CN)C1 ZINC001173272852 1132437357 /nfs/dbraw/zinc/43/73/57/1132437357.db2.gz LNLCIFRWRUKATM-LZLYRXPVSA-N 1 3 274.452 3.662 20 0 CHADHO Cc1nc(-n2ccc3cc([C@H](C)[NH3+])ccc32)cc2[nH]ccc21 ZINC001155349656 1132655411 /nfs/dbraw/zinc/65/54/11/1132655411.db2.gz UMBCDJDDJUUIHL-NSHDSACASA-N 1 3 290.370 3.835 20 0 CHADHO CCCC(C[NH3+])(CCC)Nc1nc(C)cc2[nH]ccc21 ZINC001163038478 1133127549 /nfs/dbraw/zinc/12/75/49/1133127549.db2.gz GSJLGTGRQDCCTF-UHFFFAOYSA-N 1 3 274.412 3.581 20 0 CHADHO Cc1ccccc1CN1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001203706798 1133356351 /nfs/dbraw/zinc/35/63/51/1133356351.db2.gz PRKYYPPTVJTULR-IBGZPJMESA-N 1 3 286.463 3.835 20 0 CHADHO Cc1ccccc1C[N@@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001203706798 1133356358 /nfs/dbraw/zinc/35/63/58/1133356358.db2.gz PRKYYPPTVJTULR-IBGZPJMESA-N 1 3 286.463 3.835 20 0 CHADHO Cc1ccccc1C[N@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001203706798 1133356364 /nfs/dbraw/zinc/35/63/64/1133356364.db2.gz PRKYYPPTVJTULR-IBGZPJMESA-N 1 3 286.463 3.835 20 0 CHADHO Cc1ccsc1C[N@H+]1CCCC[C@@H]1C[C@@H]1CCCN1C ZINC001204023832 1133401643 /nfs/dbraw/zinc/40/16/43/1133401643.db2.gz PJJNPSVPBDQMJV-JKSUJKDBSA-N 1 3 292.492 3.895 20 0 CHADHO Cc1ccsc1C[N@@H+]1CCCC[C@@H]1C[C@@H]1CCCN1C ZINC001204023832 1133401647 /nfs/dbraw/zinc/40/16/47/1133401647.db2.gz PJJNPSVPBDQMJV-JKSUJKDBSA-N 1 3 292.492 3.895 20 0 CHADHO Cc1ccsc1CN1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C ZINC001204023832 1133401648 /nfs/dbraw/zinc/40/16/48/1133401648.db2.gz PJJNPSVPBDQMJV-JKSUJKDBSA-N 1 3 292.492 3.895 20 0 CHADHO Cc1ccsc1CN1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C ZINC001204023832 1133401651 /nfs/dbraw/zinc/40/16/51/1133401651.db2.gz PJJNPSVPBDQMJV-JKSUJKDBSA-N 1 3 292.492 3.895 20 0 CHADHO C[C@H]1CCC[C@H](C)N1CCC[NH2+]C1CCCCC1 ZINC001204599352 1133465050 /nfs/dbraw/zinc/46/50/50/1133465050.db2.gz XLTQMZIKKIOQPF-GJZGRUSLSA-N 1 3 252.446 3.562 20 0 CHADHO [NH3+][C@H]1CCCN(Cc2cccc(-c3ccc(F)cc3)c2)CC1 ZINC001205103112 1133530210 /nfs/dbraw/zinc/53/02/10/1133530210.db2.gz ZJFRVHWOITZYJD-IBGZPJMESA-N 1 3 298.405 3.806 20 0 CHADHO Cc1csc2sc(CN3CCC[C@H]([NH3+])CC3)c(C)c12 ZINC001205117160 1133532251 /nfs/dbraw/zinc/53/22/51/1133532251.db2.gz MDBLBERPWVSAEQ-LBPRGKRZSA-N 1 3 294.489 3.893 20 0 CHADHO C[C@H]1CN(Cc2ccc3oc4ccccc4c3c2)C[C@H]1C[NH3+] ZINC001205141073 1133536431 /nfs/dbraw/zinc/53/64/31/1133536431.db2.gz VCGVHZUYAJCXQB-DZGCQCFKSA-N 1 3 294.398 3.613 20 0 CHADHO CC(C)(C)c1ccc(CN2CCC[C@@](C)([NH3+])CC2)cc1 ZINC001205264327 1133551729 /nfs/dbraw/zinc/55/17/29/1133551729.db2.gz KNPCEEOGUJUVNQ-GOSISDBHSA-N 1 3 274.452 3.687 20 0 CHADHO Cc1ccc(F)c(CN2CC[C@@H](C)[C@@H](C[NH3+])CC2)c1Cl ZINC001205617230 1133594897 /nfs/dbraw/zinc/59/48/97/1133594897.db2.gz INOPYZKAIWAQLW-DGCLKSJQSA-N 1 3 298.833 3.594 20 0 CHADHO C[C@H]1CC[C@@H](CN)[N@H+](Cc2ccc(F)c3ccccc23)C1 ZINC001205816516 1133618438 /nfs/dbraw/zinc/61/84/38/1133618438.db2.gz NFUAEXDQSPEQOH-ZFWWWQNUSA-N 1 3 286.394 3.538 20 0 CHADHO C[C@H]1CC[C@@H](CN)[N@@H+](Cc2ccc(F)c3ccccc23)C1 ZINC001205816516 1133618441 /nfs/dbraw/zinc/61/84/41/1133618441.db2.gz NFUAEXDQSPEQOH-ZFWWWQNUSA-N 1 3 286.394 3.538 20 0 CHADHO C[C@]1(F)CCCN(CCC[NH2+]C2CCCCC2)CC1 ZINC001205855895 1133623199 /nfs/dbraw/zinc/62/31/99/1133623199.db2.gz QHVGPGFCGMKLLT-INIZCTEOSA-N 1 3 270.436 3.513 20 0 CHADHO Cc1ccc(-c2ccc(C[N@@H+]3CCCC[C@@H](N)C3)cc2)cc1 ZINC001205930785 1133632419 /nfs/dbraw/zinc/63/24/19/1133632419.db2.gz DJCHVVRYMJPRAJ-HXUWFJFHSA-N 1 3 294.442 3.975 20 0 CHADHO Cc1ccc(-c2ccc(C[N@H+]3CCCC[C@@H](N)C3)cc2)cc1 ZINC001205930785 1133632422 /nfs/dbraw/zinc/63/24/22/1133632422.db2.gz DJCHVVRYMJPRAJ-HXUWFJFHSA-N 1 3 294.442 3.975 20 0 CHADHO N[C@@H]1CCCC[N@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001205930808 1133633068 /nfs/dbraw/zinc/63/30/68/1133633068.db2.gz DLYDTQRFNZBWLM-GOSISDBHSA-N 1 3 298.405 3.806 20 0 CHADHO N[C@@H]1CCCC[N@@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001205930808 1133633072 /nfs/dbraw/zinc/63/30/72/1133633072.db2.gz DLYDTQRFNZBWLM-GOSISDBHSA-N 1 3 298.405 3.806 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@@H+]1CCCC[C@@H](N)C1 ZINC001205932386 1133633494 /nfs/dbraw/zinc/63/34/94/1133633494.db2.gz RGZPSLRATZBYBX-GOSISDBHSA-N 1 3 294.442 3.975 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@H+]1CCCC[C@@H](N)C1 ZINC001205932386 1133633496 /nfs/dbraw/zinc/63/34/96/1133633496.db2.gz RGZPSLRATZBYBX-GOSISDBHSA-N 1 3 294.442 3.975 20 0 CHADHO CC(C)(C)c1ccc(C[N@@H+]2CCCC[C@](F)(CN)C2)cc1 ZINC001206344090 1133692569 /nfs/dbraw/zinc/69/25/69/1133692569.db2.gz NEVWNTACDITZLL-SFHVURJKSA-N 1 3 292.442 3.637 20 0 CHADHO CC(C)(C)c1ccc(C[N@H+]2CCCC[C@](F)(CN)C2)cc1 ZINC001206344090 1133692572 /nfs/dbraw/zinc/69/25/72/1133692572.db2.gz NEVWNTACDITZLL-SFHVURJKSA-N 1 3 292.442 3.637 20 0 CHADHO CC(C)c1cccc(CN2CCCC[C@@](C)(C[NH3+])C2)c1 ZINC001206573215 1133721044 /nfs/dbraw/zinc/72/10/44/1133721044.db2.gz JZSKVFZYRUVEPD-SFHVURJKSA-N 1 3 274.452 3.761 20 0 CHADHO CCc1cccc(C[N@@H+]2CCC(C)(C)NC(C)(C)C2)c1 ZINC001207838461 1133851423 /nfs/dbraw/zinc/85/14/23/1133851423.db2.gz YXVKYUYDSAITIV-UHFFFAOYSA-N 1 3 274.452 3.602 20 0 CHADHO CCc1cccc(C[N@H+]2CCC(C)(C)NC(C)(C)C2)c1 ZINC001207838461 1133851434 /nfs/dbraw/zinc/85/14/34/1133851434.db2.gz YXVKYUYDSAITIV-UHFFFAOYSA-N 1 3 274.452 3.602 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@@H]1CCC[C@@H](C2CC2)C1 ZINC001207858152 1133855828 /nfs/dbraw/zinc/85/58/28/1133855828.db2.gz FOSZGPATCCVLOF-USXIJHARSA-N 1 3 266.473 3.665 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@@H]1CC(C)(C)C[C@@H]1C ZINC001207857996 1133855691 /nfs/dbraw/zinc/85/56/91/1133855691.db2.gz AGYWAZYUQYBPCW-SOUVJXGZSA-N 1 3 254.462 3.521 20 0 CHADHO CC1=C[C@H](C)[C@H](C[NH+]2CCC(N3CCCCC3)CC2)CC1 ZINC001208160166 1133890928 /nfs/dbraw/zinc/89/09/28/1133890928.db2.gz GBFJEJZIEXSJSU-ROUUACIJSA-N 1 3 290.495 3.929 20 0 CHADHO CC1=C[C@H](C)[C@H](CN2CCC([NH+]3CCCCC3)CC2)CC1 ZINC001208160166 1133890935 /nfs/dbraw/zinc/89/09/35/1133890935.db2.gz GBFJEJZIEXSJSU-ROUUACIJSA-N 1 3 290.495 3.929 20 0 CHADHO CCN(CCC[NH+](C)C)CC1(c2ccccc2)CCCC1 ZINC001208780390 1133945140 /nfs/dbraw/zinc/94/51/40/1133945140.db2.gz PTLVVTYSJBFWLJ-UHFFFAOYSA-N 1 3 288.479 3.772 20 0 CHADHO c1cc(NC2=CC[C@@H]([NH+]3CCCC3)CC2)cc(C2CC2)n1 ZINC001210707948 1134277062 /nfs/dbraw/zinc/27/70/62/1134277062.db2.gz GOHVOVQRVBCMDB-QGZVFWFLSA-N 1 3 283.419 3.903 20 0 CHADHO c1cc(CN2CCC[C@]3(CCC[NH2+]C3)C2)c2cccccc1-2 ZINC001222276091 1135217076 /nfs/dbraw/zinc/21/70/76/1135217076.db2.gz BDNMGWCITLOGKB-FQEVSTJZSA-N 1 3 294.442 3.757 20 0 CHADHO CN(C)Cc1ccc(C[NH2+][C@H]2CCCC23CCCC3)cc1 ZINC000574263132 335004870 /nfs/dbraw/zinc/00/48/70/335004870.db2.gz KUHKMZOQUZRDNR-SFHVURJKSA-N 1 3 286.463 3.951 20 0 CHADHO CC[C@@H](NCc1ccc(C[NH+](C)C)cc1)c1ccccc1 ZINC000171133097 335056333 /nfs/dbraw/zinc/05/63/33/335056333.db2.gz RLZHVNQTNAEDJG-LJQANCHMSA-N 1 3 282.431 3.989 20 0 CHADHO C[C@H](CCc1ccccc1)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000020143206 171028835 /nfs/dbraw/zinc/02/88/35/171028835.db2.gz YIJPHBCGUJNFOE-OAHLLOKOSA-N 1 3 288.479 3.907 20 0 CHADHO C[C@H](CCc1ccccc1)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000020143206 171028837 /nfs/dbraw/zinc/02/88/37/171028837.db2.gz YIJPHBCGUJNFOE-OAHLLOKOSA-N 1 3 288.479 3.907 20 0 CHADHO CC[C@H](NC1CC[NH+](C(C)C)CC1)c1ccc(C)cc1 ZINC000020189272 171054957 /nfs/dbraw/zinc/05/49/57/171054957.db2.gz YBYOEARQLVILKN-SFHVURJKSA-N 1 3 274.452 3.909 20 0 CHADHO Cc1ccc([C@@H](C)NC2CC[NH+](C(C)C)CC2)s1 ZINC000020189368 171056072 /nfs/dbraw/zinc/05/60/72/171056072.db2.gz XESQLVWWRGDOAV-CYBMUJFWSA-N 1 3 266.454 3.580 20 0 CHADHO C[C@H]([NH2+]CCCN1CCC(C)CC1)c1ccc(F)cc1 ZINC000021010741 171286622 /nfs/dbraw/zinc/28/66/22/171286622.db2.gz PUCVEGCNMPPIDP-HNNXBMFYSA-N 1 3 278.415 3.598 20 0 CHADHO CCN(CC)CCC[NH2+]C1CCC(C(C)(C)C)CC1 ZINC000021012417 171288073 /nfs/dbraw/zinc/28/80/73/171288073.db2.gz WHKASSPCICNETO-UHFFFAOYSA-N 1 3 268.489 3.913 20 0 CHADHO C[NH+](C)CCCN[C@H](CC(C)(C)C)c1ccccc1 ZINC000037213752 173034072 /nfs/dbraw/zinc/03/40/72/173034072.db2.gz UECFRJAQBRGSDV-MRXNPFEDSA-N 1 3 262.441 3.705 20 0 CHADHO C[C@@H]([NH2+]C[C@H](C)CN1CCCCC1)c1cccs1 ZINC000038041734 174043721 /nfs/dbraw/zinc/04/37/21/174043721.db2.gz FCYDXHWALHDBEZ-UONOGXRCSA-N 1 3 266.454 3.521 20 0 CHADHO C[C@@H]1CN(Cc2cccc(-c3ccccc3)c2)CC[C@@H]1[NH3+] ZINC000347058558 226008421 /nfs/dbraw/zinc/00/84/21/226008421.db2.gz WRDJPWPKNGNSAB-BEFAXECRSA-N 1 3 280.415 3.523 20 0 CHADHO C[NH+](C)CCC1CCN(Cc2ccc3occc3c2)CC1 ZINC000347641347 226222431 /nfs/dbraw/zinc/22/24/31/226222431.db2.gz RNVIRPCXTQVKEY-UHFFFAOYSA-N 1 3 286.419 3.597 20 0 CHADHO CCc1ccc([C@@H](CC)NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000322973141 260112639 /nfs/dbraw/zinc/11/26/39/260112639.db2.gz YZOONMLALYTORT-XVLXNVKGSA-N 1 3 286.463 3.915 20 0 CHADHO CCc1ccc([C@@H](CC)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000322973141 260112641 /nfs/dbraw/zinc/11/26/41/260112641.db2.gz YZOONMLALYTORT-XVLXNVKGSA-N 1 3 286.463 3.915 20 0 CHADHO C[C@@H]([NH2+]CC(C)(C)CN(C)C)c1cnc2ccsc2c1 ZINC000068690356 260145559 /nfs/dbraw/zinc/14/55/59/260145559.db2.gz VBOKLUBXQIBWII-GFCCVEGCSA-N 1 3 291.464 3.535 20 0 CHADHO [NH3+]CC[C@H]1CCCCN1Cc1csc2ccccc12 ZINC000070148846 260152462 /nfs/dbraw/zinc/15/24/62/260152462.db2.gz IIPZNBOEMJHCGK-CQSZACIVSA-N 1 3 274.433 3.605 20 0 CHADHO C[C@@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1cccs1 ZINC000037786279 260163921 /nfs/dbraw/zinc/16/39/21/260163921.db2.gz QDQWYBYOJNCRJO-GFCCVEGCSA-N 1 3 266.454 3.662 20 0 CHADHO C[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1cccc2ccccc21 ZINC000093210339 260273222 /nfs/dbraw/zinc/27/32/22/260273222.db2.gz HDGPVFWLXOQYNH-BPUTZDHNSA-N 1 3 268.404 3.760 20 0 CHADHO CC[C@H]([NH2+]C1CCN(C2CCCC2)CC1)C1CCC1 ZINC000449180910 260282337 /nfs/dbraw/zinc/28/23/37/260282337.db2.gz CXICJFNYVRIGDW-KRWDZBQOSA-N 1 3 264.457 3.562 20 0 CHADHO CC(C)[C@@H](N[C@H]1CCC[NH2+]CC1)c1ccc(Cl)cc1 ZINC000128998509 260380035 /nfs/dbraw/zinc/38/00/35/260380035.db2.gz AOBDKMZULPIMOG-JKSUJKDBSA-N 1 3 280.843 3.769 20 0 CHADHO c1ccc2c(c1)CCCC[C@@H]2N[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000130218326 260394415 /nfs/dbraw/zinc/39/44/15/260394415.db2.gz KGYBEUXMEKWTNH-SCTDSRPQSA-N 1 3 284.447 3.671 20 0 CHADHO c1ccc2c(c1)CCCC[C@@H]2N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000130218326 260394417 /nfs/dbraw/zinc/39/44/17/260394417.db2.gz KGYBEUXMEKWTNH-SCTDSRPQSA-N 1 3 284.447 3.671 20 0 CHADHO CC(C)[NH+](CCNc1ccnc2ccccc21)C(C)C ZINC000041720256 260609176 /nfs/dbraw/zinc/60/91/76/260609176.db2.gz PFUWZDMIOOITMO-UHFFFAOYSA-N 1 3 271.408 3.766 20 0 CHADHO CC(C)CN1CCC([NH2+][C@@H](C)c2cccs2)CC1 ZINC000154474789 261092229 /nfs/dbraw/zinc/09/22/29/261092229.db2.gz OSVVZAPXNCTUFT-ZDUSSCGKSA-N 1 3 266.454 3.519 20 0 CHADHO CC[N@H+](C)Cc1cccc(CN[C@@H](C)c2cncc(C)c2)c1 ZINC000184344410 262017615 /nfs/dbraw/zinc/01/76/15/262017615.db2.gz WKXOQWVBZWHSJG-INIZCTEOSA-N 1 3 297.446 3.693 20 0 CHADHO CC[N@@H+](C)Cc1cccc(CN[C@@H](C)c2cncc(C)c2)c1 ZINC000184344410 262017616 /nfs/dbraw/zinc/01/76/16/262017616.db2.gz WKXOQWVBZWHSJG-INIZCTEOSA-N 1 3 297.446 3.693 20 0 CHADHO CCC[NH2+][C@@H]1CCCC[C@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000514085699 262160047 /nfs/dbraw/zinc/16/00/47/262160047.db2.gz WQXFPZSTEQYWJL-GBESFXJTSA-N 1 3 286.463 3.677 20 0 CHADHO Cc1ccc(C)c([C@H](C)[NH2+]CCCN(C)C(C)C)c1 ZINC000221913173 262322709 /nfs/dbraw/zinc/32/27/09/262322709.db2.gz BBKKOXWXOJTICW-INIZCTEOSA-N 1 3 262.441 3.684 20 0 CHADHO CCCC[C@H]([NH2+]C[C@H](C)CN(C)C)c1ccccc1 ZINC000311854319 262342602 /nfs/dbraw/zinc/34/26/02/262342602.db2.gz TUSBPGRUHSMJMU-RDJZCZTQSA-N 1 3 262.441 3.705 20 0 CHADHO CCCC[C@H](NC[C@H](C)C[NH+](C)C)c1ccccc1 ZINC000311854319 262342603 /nfs/dbraw/zinc/34/26/03/262342603.db2.gz TUSBPGRUHSMJMU-RDJZCZTQSA-N 1 3 262.441 3.705 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]CCCN2CCC(C)CC2)s1 ZINC000021502624 262387405 /nfs/dbraw/zinc/38/74/05/262387405.db2.gz NQIIZPXVDZXJJU-OAHLLOKOSA-N 1 3 280.481 3.829 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCCc2sccc21)CN1CCCCC1 ZINC000061328606 262394327 /nfs/dbraw/zinc/39/43/27/262394327.db2.gz SBNWULZJBKEQLP-ZBFHGGJFSA-N 1 3 292.492 3.837 20 0 CHADHO CC[C@H](C[N@H+](CC)[C@H]1CCCNCC1)c1ccccc1 ZINC000414714097 263034218 /nfs/dbraw/zinc/03/42/18/263034218.db2.gz LUIILGCXPVTZQD-AEFFLSMTSA-N 1 3 274.452 3.644 20 0 CHADHO CC[C@H](C[N@@H+](CC)[C@H]1CCCNCC1)c1ccccc1 ZINC000414714097 263034219 /nfs/dbraw/zinc/03/42/19/263034219.db2.gz LUIILGCXPVTZQD-AEFFLSMTSA-N 1 3 274.452 3.644 20 0 CHADHO Cc1cc(Cl)ccc1CNCc1ccc([C@@H](C)[NH3+])cc1 ZINC000414803931 263051654 /nfs/dbraw/zinc/05/16/54/263051654.db2.gz DHMMLQUUSJVYAR-CYBMUJFWSA-N 1 3 288.822 3.958 20 0 CHADHO CC(C)[C@H]([NH3+])CN[C@H]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000414805981 263051730 /nfs/dbraw/zinc/05/17/30/263051730.db2.gz ZAJBFMFBWCTOKX-OAGGEKHMSA-N 1 3 280.843 3.549 20 0 CHADHO CCC(N)(CC)C[NH2+]Cc1cc2ccccc2s1 ZINC000414812780 263053331 /nfs/dbraw/zinc/05/33/31/263053331.db2.gz RSXFASDNNBFIHQ-UHFFFAOYSA-N 1 3 262.422 3.508 20 0 CHADHO CCC[C@@H](Cc1ccccc1)NCC([NH3+])(CC)CC ZINC000414815445 263053881 /nfs/dbraw/zinc/05/38/81/263053881.db2.gz XPUNHYICRAIILD-INIZCTEOSA-N 1 3 262.441 3.505 20 0 CHADHO C[C@H]([NH3+])c1ccc(CNCc2ccc(C3CC3)cc2)cc1 ZINC000414817121 263053981 /nfs/dbraw/zinc/05/39/81/263053981.db2.gz RLTJBEMRCZLPSU-AWEZNQCLSA-N 1 3 280.415 3.874 20 0 CHADHO C[C@H](CC(C)(C)c1ccccc1)[NH2+]C[C@@]1(C)CCCNC1 ZINC000414906057 263112961 /nfs/dbraw/zinc/11/29/61/263112961.db2.gz LYFVHWNHYHCROA-APWZRJJASA-N 1 3 288.479 3.722 20 0 CHADHO C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@@H]1CCC[C@H](N)C1 ZINC000414925101 263129759 /nfs/dbraw/zinc/12/97/59/263129759.db2.gz KZWPNQPHAAAKKZ-HYVNUMGLSA-N 1 3 274.452 3.602 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+][C@@H]1CCN[C@H](C)C1 ZINC000414944331 263153610 /nfs/dbraw/zinc/15/36/10/263153610.db2.gz GRRXVQRCXRYAPI-KBAYOESNSA-N 1 3 274.452 3.518 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H]1CCC[C@@H]1c1ccccc1Cl ZINC000414948124 263155868 /nfs/dbraw/zinc/15/58/68/263155868.db2.gz XQXOOYUTORPPCO-IRWJRLHMSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2CCCC[C@@H](c3ccccc3)C2)CCN1 ZINC000414954994 263158834 /nfs/dbraw/zinc/15/88/34/263158834.db2.gz TVSQVEVOUXFXFN-OQIJWPOYSA-N 1 3 286.463 3.833 20 0 CHADHO Cc1ccc(-c2ccc(C[NH2+][C@H](C)[C@H](C)N)s2)cc1 ZINC000415002021 263202247 /nfs/dbraw/zinc/20/22/47/263202247.db2.gz DEBRKLJLOOVIGJ-QWHCGFSZSA-N 1 3 274.433 3.549 20 0 CHADHO Cc1oc2ccccc2c1CN1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000415060911 263258795 /nfs/dbraw/zinc/25/87/95/263258795.db2.gz ZKSRWCQSJOPLOL-CRAIPNDOSA-N 1 3 298.430 3.705 20 0 CHADHO Cc1ccc(CN[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)s1 ZINC000415086963 263271704 /nfs/dbraw/zinc/27/17/04/263271704.db2.gz SILJKQGHXCRXNP-WBVHZDCISA-N 1 3 286.444 3.639 20 0 CHADHO Cc1ccccc1C1(CN[C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)CC1 ZINC000415099200 263273095 /nfs/dbraw/zinc/27/30/95/263273095.db2.gz GHEUQXRWFDXJHW-YTQUADARSA-N 1 3 298.474 3.537 20 0 CHADHO C[C@@H]([NH2+]C[C@H](C)CN1CCCC1)[C@@H]1C[C@H]1c1cccs1 ZINC000417309407 263795413 /nfs/dbraw/zinc/79/54/13/263795413.db2.gz GGOINQBWZWNPAX-XUWVNRHRSA-N 1 3 292.492 3.562 20 0 CHADHO C[NH+](C)C1CCN([C@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC000189696419 264322701 /nfs/dbraw/zinc/32/27/01/264322701.db2.gz UBGHWNPLZIJGBQ-OALUTQOASA-N 1 3 286.463 3.523 20 0 CHADHO C[NH+](C)C1CCN([C@@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC000189696463 264322720 /nfs/dbraw/zinc/32/27/20/264322720.db2.gz UBGHWNPLZIJGBQ-MOPGFXCFSA-N 1 3 286.463 3.523 20 0 CHADHO C[C@H](CCc1ccco1)N[C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000093513425 265186518 /nfs/dbraw/zinc/18/65/18/265186518.db2.gz UFOUIJJIICIKQP-OAGGEKHMSA-N 1 3 278.440 3.501 20 0 CHADHO C[N@@H+]1CCCC[C@H]1CCN1CCC[C@H]1c1cccs1 ZINC000356853075 266191112 /nfs/dbraw/zinc/19/11/12/266191112.db2.gz NSTPVJFXHFBDBV-GJZGRUSLSA-N 1 3 278.465 3.759 20 0 CHADHO C[N@H+]1CCCC[C@H]1CCN1CCC[C@H]1c1cccs1 ZINC000356853075 266191115 /nfs/dbraw/zinc/19/11/15/266191115.db2.gz NSTPVJFXHFBDBV-GJZGRUSLSA-N 1 3 278.465 3.759 20 0 CHADHO c1cc(C2CC2)ccc1C[NH2+]C1CCN(CC2CC2)CC1 ZINC000357783627 266361365 /nfs/dbraw/zinc/36/13/65/266361365.db2.gz FCYQKHASEHGANM-UHFFFAOYSA-N 1 3 284.447 3.528 20 0 CHADHO CCC[C@H](CN[C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000368401748 267170030 /nfs/dbraw/zinc/17/00/30/267170030.db2.gz GCSYTGGPFPHRNV-QYZOEREBSA-N 1 3 286.463 3.787 20 0 CHADHO CCC[C@H](CN[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000368401748 267170031 /nfs/dbraw/zinc/17/00/31/267170031.db2.gz GCSYTGGPFPHRNV-QYZOEREBSA-N 1 3 286.463 3.787 20 0 CHADHO C[C@@H](NCc1ccc(C[NH+](C)C)cc1)c1ccccc1 ZINC000119547894 267344895 /nfs/dbraw/zinc/34/48/95/267344895.db2.gz LGAXCSKHSLNQKI-OAHLLOKOSA-N 1 3 268.404 3.599 20 0 CHADHO c1cc2cc(C[NH2+]C3CC(N4CCCCC4)C3)ccc2o1 ZINC000377159079 268051775 /nfs/dbraw/zinc/05/17/75/268051775.db2.gz VIUZEQUPNWLOMM-UHFFFAOYSA-N 1 3 284.403 3.539 20 0 CHADHO [NH3+]Cc1ccc(CN[C@H]2CCc3cc(Cl)ccc32)cc1 ZINC000563154229 327931297 /nfs/dbraw/zinc/93/12/97/327931297.db2.gz UCSKCQLYKUJWCI-KRWDZBQOSA-N 1 3 286.806 3.576 20 0 CHADHO CC1=C[C@@H](C)C[C@@H](C[NH2+]C2CCN(CC(C)C)CC2)C1 ZINC000575030806 328230103 /nfs/dbraw/zinc/23/01/03/328230103.db2.gz XSSKJFLNXIOILY-NVXWUHKLSA-N 1 3 278.484 3.689 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@@H](C)c1cccc(C2CC2)c1 ZINC000340208691 328247875 /nfs/dbraw/zinc/24/78/75/328247875.db2.gz FYQHBKVCUNDEMK-KGLIPLIRSA-N 1 3 260.425 3.555 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000414946066 328279092 /nfs/dbraw/zinc/27/90/92/328279092.db2.gz SJSOQGHUOAGXIL-ZCPGHIKRSA-N 1 3 292.854 3.564 20 0 CHADHO CCC[NH+]1CCC(Nc2ccnc3ccccc32)CC1 ZINC000049558056 328373065 /nfs/dbraw/zinc/37/30/65/328373065.db2.gz ZXLONVUDLSSQOG-UHFFFAOYSA-N 1 3 269.392 3.521 20 0 CHADHO CC[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1cccc(Cl)c1 ZINC000093211234 328510663 /nfs/dbraw/zinc/51/06/63/328510663.db2.gz DSONIKPJPQXKJH-ZNMIVQPWSA-N 1 3 266.816 3.651 20 0 CHADHO C[C@H](CC(C)(C)C)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000394997299 328590257 /nfs/dbraw/zinc/59/02/57/328590257.db2.gz DLPCUUVBWGIJBG-GFCCVEGCSA-N 1 3 254.462 3.710 20 0 CHADHO CC(C)C[C@@H](CN1CC[C@]2(CC[NH2+]C2)C1)c1ccccc1 ZINC000566230419 327248647 /nfs/dbraw/zinc/24/86/47/327248647.db2.gz QMRJEALFWLCNNA-OALUTQOASA-N 1 3 286.463 3.502 20 0 CHADHO C[C@@H](NCc1ccc(C[NH3+])cc1)c1ccc(F)c(Cl)c1 ZINC000564988342 327339882 /nfs/dbraw/zinc/33/98/82/327339882.db2.gz CELZXJXEYRGTHT-LLVKDONJSA-N 1 3 292.785 3.789 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+]C[C@@H]2CCCC(C)(C)C2)C1 ZINC000583408936 327348893 /nfs/dbraw/zinc/34/88/93/327348893.db2.gz SYOAMYHDEZWDRB-CVEARBPZSA-N 1 3 266.473 3.523 20 0 CHADHO CCc1ccc(CN[C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)s1 ZINC000261630300 327401223 /nfs/dbraw/zinc/40/12/23/327401223.db2.gz BHEXUCJLOHMOMP-BRWVUGGUSA-N 1 3 292.492 3.711 20 0 CHADHO CC1=C[C@H](C)C[C@@H](C[N@@H+]2CC[C@H](CN(C)CC3CC3)C2)C1 ZINC000582479472 329095164 /nfs/dbraw/zinc/09/51/64/329095164.db2.gz YNXGVPZIWSMLKQ-KFKAGJAMSA-N 1 3 290.495 3.643 20 0 CHADHO CC1=C[C@H](C)C[C@@H](C[N@H+]2CC[C@H](CN(C)CC3CC3)C2)C1 ZINC000582479472 329095166 /nfs/dbraw/zinc/09/51/66/329095166.db2.gz YNXGVPZIWSMLKQ-KFKAGJAMSA-N 1 3 290.495 3.643 20 0 CHADHO CCC[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000582779591 329185243 /nfs/dbraw/zinc/18/52/43/329185243.db2.gz ZKVXHKGEOWJBLL-DAYGRLMNSA-N 1 3 289.467 3.858 20 0 CHADHO C[C@H](NCCCC[N@@H+]1CCC[C@@H](C)C1)c1ccsc1 ZINC000178098997 329192464 /nfs/dbraw/zinc/19/24/64/329192464.db2.gz UXLLBRIDDJOQPD-CABCVRRESA-N 1 3 280.481 3.911 20 0 CHADHO C[C@H](NCCCC[N@H+]1CCC[C@@H](C)C1)c1ccsc1 ZINC000178098997 329192466 /nfs/dbraw/zinc/19/24/66/329192466.db2.gz UXLLBRIDDJOQPD-CABCVRRESA-N 1 3 280.481 3.911 20 0 CHADHO C1CC2(CCCC2)[C@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000189145367 329376386 /nfs/dbraw/zinc/37/63/86/329376386.db2.gz DLPSSCRREVQOIO-KRWDZBQOSA-N 1 3 276.468 3.706 20 0 CHADHO CN(C)Cc1cccc(C[NH2+][C@H]2CC[C@H]2C(C)(C)C)c1 ZINC000514684462 329540868 /nfs/dbraw/zinc/54/08/68/329540868.db2.gz UFDZNYAZSUBQTN-SJORKVTESA-N 1 3 274.452 3.663 20 0 CHADHO C[NH+](C)Cc1ccc(CNCc2cccc3cc[nH]c32)cc1 ZINC000237066804 329692656 /nfs/dbraw/zinc/69/26/56/329692656.db2.gz SLDSFGVFIXAALJ-UHFFFAOYSA-N 1 3 293.414 3.519 20 0 CHADHO CCC[C@@H](NCc1ccc(C[NH3+])cc1)c1ccc(OC)cc1 ZINC000580445789 330139763 /nfs/dbraw/zinc/13/97/63/330139763.db2.gz FAWHDAUTNCQTTB-LJQANCHMSA-N 1 3 298.430 3.785 20 0 CHADHO C[C@@H]([NH2+]C1CCNCC1)c1ccc(-c2ccccc2)cc1 ZINC000422690536 330150895 /nfs/dbraw/zinc/15/08/95/330150895.db2.gz GPSKXLWJWFUMTA-OAHLLOKOSA-N 1 3 280.415 3.756 20 0 CHADHO c1ccc2cc(CN[C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)ccc2c1 ZINC000422706516 330151191 /nfs/dbraw/zinc/15/11/91/330151191.db2.gz UPCICSIYTGYEHE-SLFFLAALSA-N 1 3 294.442 3.850 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@H]1CCCC[C@@H]1Cc1ccccc1 ZINC000422710423 330151370 /nfs/dbraw/zinc/15/13/70/330151370.db2.gz LFRNFSVKAUSAAO-ONIAQPFYSA-N 1 3 274.452 3.503 20 0 CHADHO CC[C@H](Cc1ccccc1)N[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422713778 330151910 /nfs/dbraw/zinc/15/19/10/330151910.db2.gz QCPGGXJQSHCQPV-LZQZEXGQSA-N 1 3 280.415 3.742 20 0 CHADHO C[C@H](NC1CCC(C[NH3+])CC1)c1ccc(F)cc1Cl ZINC000422762679 330153995 /nfs/dbraw/zinc/15/39/95/330153995.db2.gz SOPOGPOHAFZWTI-ZBOXLXRLSA-N 1 3 284.806 3.647 20 0 CHADHO Cc1ccc(SCC[NH2+][C@H]2C[C@H](N)c3ccccc32)cc1 ZINC000422764722 330154097 /nfs/dbraw/zinc/15/40/97/330154097.db2.gz KIPRGALDXYYATQ-ROUUACIJSA-N 1 3 298.455 3.822 20 0 CHADHO C[C@@H](N)C[C@H](C)[NH2+]CC1(c2cccs2)CCCCC1 ZINC000422772737 330154392 /nfs/dbraw/zinc/15/43/92/330154392.db2.gz XQMYOTZBQDCIBB-KGLIPLIRSA-N 1 3 280.481 3.665 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCC1(c2cccs2)CCCCC1 ZINC000422772737 330154393 /nfs/dbraw/zinc/15/43/93/330154393.db2.gz XQMYOTZBQDCIBB-KGLIPLIRSA-N 1 3 280.481 3.665 20 0 CHADHO C[C@H](C[NH2+][C@H]1C[C@@H](N)c2ccccc21)Sc1ccccc1 ZINC000422778975 330154944 /nfs/dbraw/zinc/15/49/44/330154944.db2.gz BIKOBDMTFRAMTN-XWIAVFTESA-N 1 3 298.455 3.902 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCc1ccc(-c2ccccc2)cc1 ZINC000422791026 330155331 /nfs/dbraw/zinc/15/53/31/330155331.db2.gz YCRJLKSTKQQBOO-GJZGRUSLSA-N 1 3 268.404 3.569 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CC[C@H](C)c1ccccc1 ZINC000422849924 330157565 /nfs/dbraw/zinc/15/75/65/330157565.db2.gz MOEFYJJCDGDCJT-LSDHHAIUSA-N 1 3 297.446 3.693 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC1(CC(C)C)CCC1 ZINC000422870201 330158439 /nfs/dbraw/zinc/15/84/39/330158439.db2.gz BMAYSMDTFKOYJL-AWEZNQCLSA-N 1 3 289.467 3.716 20 0 CHADHO C[C@H](N[C@H](c1cccc(F)c1)C1CCCC1)[C@@H]1CC[NH2+]C1 ZINC000422873907 330158596 /nfs/dbraw/zinc/15/85/96/330158596.db2.gz MKKQUZZWCMIADP-XCRHUMRWSA-N 1 3 290.426 3.645 20 0 CHADHO [NH3+][C@H]1CCC[C@@H]1NCC1(Sc2ccccc2)CCCC1 ZINC000422912487 330159972 /nfs/dbraw/zinc/15/99/72/330159972.db2.gz WGZPJMVBIQPXBT-HOTGVXAUSA-N 1 3 290.476 3.561 20 0 CHADHO C[C@@H]1C[C@@H]1[C@H]([NH2+][C@@H]1CCC[C@H]1N)c1ccc(Cl)cc1 ZINC000422926815 330160925 /nfs/dbraw/zinc/16/09/25/330160925.db2.gz XOCZDNWHGHARLZ-RNPDWPAJSA-N 1 3 278.827 3.507 20 0 CHADHO [NH3+][C@H]1CCCCC[C@H]1NCCc1csc2ccccc12 ZINC000422931944 330161243 /nfs/dbraw/zinc/16/12/43/330161243.db2.gz DFEXPWTUFFBRGH-JKSUJKDBSA-N 1 3 288.460 3.693 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@H]1NCC1(Sc2ccccc2)CC1 ZINC000422901447 330162280 /nfs/dbraw/zinc/16/22/80/330162280.db2.gz CARHZGPQJHIFTM-HZPDHXFCSA-N 1 3 290.476 3.561 20 0 CHADHO c1ccc(CC2(CN[C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)CC2)cc1 ZINC000422998905 330163442 /nfs/dbraw/zinc/16/34/42/330163442.db2.gz RPPZIFZHZSSZNY-GBESFXJTSA-N 1 3 298.474 3.520 20 0 CHADHO CC(C)C[C@H](N[C@H]1CCC[NH2+]CC1)c1cccs1 ZINC000422949578 330163688 /nfs/dbraw/zinc/16/36/88/330163688.db2.gz UJPLGOWCABQDDB-KBPBESRZSA-N 1 3 266.454 3.567 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CC(C)(C)C1CCCC1 ZINC000423007313 330165053 /nfs/dbraw/zinc/16/50/53/330165053.db2.gz XMLZOAPBYVMCPT-CYBMUJFWSA-N 1 3 289.467 3.716 20 0 CHADHO C[C@H](Cc1c(Cl)cccc1Cl)N[C@@H](C)C[C@H](C)[NH3+] ZINC000423017137 330165261 /nfs/dbraw/zinc/16/52/61/330165261.db2.gz VMPLDGIQZVOVNV-GARJFASQSA-N 1 3 289.250 3.640 20 0 CHADHO C[C@H](Cc1c(Cl)cccc1Cl)[NH2+][C@@H](C)C[C@H](C)N ZINC000423017137 330165263 /nfs/dbraw/zinc/16/52/63/330165263.db2.gz VMPLDGIQZVOVNV-GARJFASQSA-N 1 3 289.250 3.640 20 0 CHADHO CC(C)CSCCC[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCCN1 ZINC000423016827 330165380 /nfs/dbraw/zinc/16/53/80/330165380.db2.gz UQYKOSDDXXQLFF-IXDOHACOSA-N 1 3 298.540 3.666 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC1(C)CCCCCC1 ZINC000423021945 330165675 /nfs/dbraw/zinc/16/56/75/330165675.db2.gz DBEJNTKSYZSORP-AWEZNQCLSA-N 1 3 289.467 3.860 20 0 CHADHO CS[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCCN1)C(C)(C)C ZINC000423036775 330166483 /nfs/dbraw/zinc/16/64/83/330166483.db2.gz UTEQPIYJNOWZDF-QKPAOTATSA-N 1 3 298.540 3.665 20 0 CHADHO C[C@@H](N)C[C@@H](C)[NH2+]CC1(Cc2ccccc2)CCCC1 ZINC000423044258 330166707 /nfs/dbraw/zinc/16/67/07/330166707.db2.gz QTWVBJDHSHZBGZ-HZPDHXFCSA-N 1 3 274.452 3.505 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]CC1(Cc2ccccc2)CCCC1 ZINC000423044260 330166826 /nfs/dbraw/zinc/16/68/26/330166826.db2.gz QTWVBJDHSHZBGZ-JKSUJKDBSA-N 1 3 274.452 3.505 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)C[C@H](C)N)C1(c2ccccc2)CCCC1 ZINC000423048113 330166942 /nfs/dbraw/zinc/16/69/42/330166942.db2.gz HRGKZECHMVUPEQ-HRCADAONSA-N 1 3 274.452 3.602 20 0 CHADHO CC(C)[C@H]1CCc2ccccc2[C@H]1NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423052515 330167549 /nfs/dbraw/zinc/16/75/49/330167549.db2.gz QOJALBLJLBRPEC-BISRIHTFSA-N 1 3 298.474 3.819 20 0 CHADHO C[C@@H]1CCNCC[C@H]1[NH2+]CCCCCc1ccc(F)cc1 ZINC000423064560 330167962 /nfs/dbraw/zinc/16/79/62/330167962.db2.gz RSIPLRNHGMVKAN-CRAIPNDOSA-N 1 3 292.442 3.516 20 0 CHADHO C[C@@H](N[C@H]1CCC[NH2+]CC1)c1cc2ccccc2s1 ZINC000423062652 330167986 /nfs/dbraw/zinc/16/79/86/330167986.db2.gz UOXLFFKBDUTLAH-OCCSQVGLSA-N 1 3 274.433 3.694 20 0 CHADHO C[C@@H]1CCNCC[C@@H]1[NH2+]CCCCCc1ccc(F)cc1 ZINC000423064562 330168090 /nfs/dbraw/zinc/16/80/90/330168090.db2.gz RSIPLRNHGMVKAN-QAPCUYQASA-N 1 3 292.442 3.516 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000423084388 330168768 /nfs/dbraw/zinc/16/87/68/330168768.db2.gz HYGTVMLXMNQVQG-ATLSCFEFSA-N 1 3 290.426 3.569 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@H](C)CC1CCCCC1 ZINC000423087647 330169028 /nfs/dbraw/zinc/16/90/28/330169028.db2.gz ONSWYZSJDDFNPO-ZIAGYGMSSA-N 1 3 289.467 3.858 20 0 CHADHO Clc1ccc(CCCCNC2C[C@H]3CC[C@@H](C2)[NH2+]3)s1 ZINC000423099528 330170066 /nfs/dbraw/zinc/17/00/66/330170066.db2.gz FJJMZEQYQXKHAT-FUNVUKJBSA-N 1 3 298.883 3.597 20 0 CHADHO [NH3+]C[C@H]1CCCC[C@@H]1NCc1ccc2sccc2c1 ZINC000423121861 330171402 /nfs/dbraw/zinc/17/14/02/330171402.db2.gz JLIJOVGJAZRSEI-CABCVRRESA-N 1 3 274.433 3.508 20 0 CHADHO [NH3+][C@H]1C[C@H](NC[C@@H]2C[C@H]2c2ccccc2)c2ccccc21 ZINC000423127990 330171568 /nfs/dbraw/zinc/17/15/68/330171568.db2.gz CTGYCMXSMAKNAX-QZHFEQFPSA-N 1 3 278.399 3.525 20 0 CHADHO C[C@@H](N)C[C@@H](C)[NH2+]C1(Cc2ccc(Cl)cc2)CCC1 ZINC000423136547 330172204 /nfs/dbraw/zinc/17/22/04/330172204.db2.gz VGUVFNIJINQWJL-CHWSQXEVSA-N 1 3 280.843 3.521 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NC1(Cc2ccc(Cl)cc2)CCC1 ZINC000423136547 330172205 /nfs/dbraw/zinc/17/22/05/330172205.db2.gz VGUVFNIJINQWJL-CHWSQXEVSA-N 1 3 280.843 3.521 20 0 CHADHO NC[C@H]1CCCC[C@@H]1[NH2+]CCc1cc2ccccc2s1 ZINC000423138056 330172380 /nfs/dbraw/zinc/17/23/80/330172380.db2.gz RXHFYUXEXBOCCY-ZBFHGGJFSA-N 1 3 288.460 3.551 20 0 CHADHO [NH3+][C@@H]1C[C@H](NCC[C@@H]2CCc3ccccc32)c2ccccc21 ZINC000423146256 330172515 /nfs/dbraw/zinc/17/25/15/330172515.db2.gz OWPWDSBTCTUNKV-BEVDRBHNSA-N 1 3 292.426 3.841 20 0 CHADHO C[C@H]1CCNCC[C@H]1[NH2+][C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423144798 330172693 /nfs/dbraw/zinc/17/26/93/330172693.db2.gz ICAWMACNWZFFBS-AYMQEEERSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@H]1CC[NH2+]CC[C@H]1N[C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423144798 330172695 /nfs/dbraw/zinc/17/26/95/330172695.db2.gz ICAWMACNWZFFBS-AYMQEEERSA-N 1 3 292.854 3.564 20 0 CHADHO N[C@@H]1C[C@@H]([NH2+]C2(Cc3ccc(F)cc3)CC2)c2ccccc21 ZINC000423150726 330172865 /nfs/dbraw/zinc/17/28/65/330172865.db2.gz CCPZBVQLDBKFHB-QZTJIDSGSA-N 1 3 296.389 3.635 20 0 CHADHO CC(C)=CCC[C@H](C)N[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423150603 330172875 /nfs/dbraw/zinc/17/28/75/330172875.db2.gz BLKSXMAKTMGSFD-IAOVAPTHSA-N 1 3 258.409 3.856 20 0 CHADHO Cc1ccc(CN[C@@H]2CC[NH2+]CC[C@@H]2C)c2ccccc12 ZINC000423172108 330174481 /nfs/dbraw/zinc/17/44/81/330174481.db2.gz RIMZWDLAPSDYTK-HNAYVOBHSA-N 1 3 282.431 3.626 20 0 CHADHO C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C1CCNCC1 ZINC000423175691 330174676 /nfs/dbraw/zinc/17/46/76/330174676.db2.gz ASPKYFWQPSKUGX-AWEZNQCLSA-N 1 3 299.462 3.566 20 0 CHADHO C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)NC1CC[NH2+]CC1 ZINC000423175691 330174677 /nfs/dbraw/zinc/17/46/77/330174677.db2.gz ASPKYFWQPSKUGX-AWEZNQCLSA-N 1 3 299.462 3.566 20 0 CHADHO C[C@@H](CCc1c(F)cccc1F)NCC1([NH3+])CCCCC1 ZINC000423175115 330174862 /nfs/dbraw/zinc/17/48/62/330174862.db2.gz DAGZGKKAFXJGRM-ZDUSSCGKSA-N 1 3 296.405 3.537 20 0 CHADHO Clc1ccc([C@H](CC2CC2)[NH2+]C2CCNCC2)cc1 ZINC000423179654 330175019 /nfs/dbraw/zinc/17/50/19/330175019.db2.gz HWXVBXLWSLCPRT-INIZCTEOSA-N 1 3 278.827 3.523 20 0 CHADHO c1ccc2c(c1)sc1c2CCC[C@H]1NC1CC[NH2+]CC1 ZINC000423176703 330175048 /nfs/dbraw/zinc/17/50/48/330175048.db2.gz CQPMXMIUQOGJLR-OAHLLOKOSA-N 1 3 286.444 3.620 20 0 CHADHO c1ccc2c(c1)sc1c2CCC[C@H]1[NH2+]C1CCNCC1 ZINC000423176703 330175049 /nfs/dbraw/zinc/17/50/49/330175049.db2.gz CQPMXMIUQOGJLR-OAHLLOKOSA-N 1 3 286.444 3.620 20 0 CHADHO Clc1ccc([C@H]([NH2+]C2CCNCC2)C2CCC2)cc1 ZINC000423190903 330176021 /nfs/dbraw/zinc/17/60/21/330176021.db2.gz SVGCBJIMDJSCDO-MRXNPFEDSA-N 1 3 278.827 3.523 20 0 CHADHO Clc1ccc([C@@H]([NH2+]C2CCNCC2)C2CCC2)cc1 ZINC000423190901 330176074 /nfs/dbraw/zinc/17/60/74/330176074.db2.gz SVGCBJIMDJSCDO-INIZCTEOSA-N 1 3 278.827 3.523 20 0 CHADHO Clc1cccc([C@@H]2CC[C@H]([NH2+]C[C@H]3CCCNC3)C2)c1 ZINC000423208250 330177494 /nfs/dbraw/zinc/17/74/94/330177494.db2.gz HOXMLRJQOBRBHF-LXZKKBNFSA-N 1 3 292.854 3.565 20 0 CHADHO c1ccc([C@@H](NC[C@@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC000423210041 330177715 /nfs/dbraw/zinc/17/77/15/330177715.db2.gz JMCOXPDMVFPEIC-CRAIPNDOSA-N 1 3 272.436 3.507 20 0 CHADHO c1ccc([C@@H]([NH2+]C[C@@H]2CCCNC2)C2CCCC2)cc1 ZINC000423210041 330177717 /nfs/dbraw/zinc/17/77/17/330177717.db2.gz JMCOXPDMVFPEIC-CRAIPNDOSA-N 1 3 272.436 3.507 20 0 CHADHO COc1ccccc1-c1ccc([C@H](C)NCC[C@H](C)[NH3+])cc1 ZINC000423225501 330180155 /nfs/dbraw/zinc/18/01/55/330180155.db2.gz NAPNGRISVDNEJB-GJZGRUSLSA-N 1 3 298.430 3.750 20 0 CHADHO C[C@@H]([NH3+])CCN[C@@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423226018 330180403 /nfs/dbraw/zinc/18/04/03/330180403.db2.gz PCYLQPMBRXANJG-ABAIWWIYSA-N 1 3 266.816 3.508 20 0 CHADHO C[C@H]([NH3+])CCN[C@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423226021 330180470 /nfs/dbraw/zinc/18/04/70/330180470.db2.gz PCYLQPMBRXANJG-XHDPSFHLSA-N 1 3 266.816 3.508 20 0 CHADHO CC[C@@H](NCC[C@H](C)[NH3+])c1ccc2cc(OC)ccc2c1 ZINC000423232780 330180958 /nfs/dbraw/zinc/18/09/58/330180958.db2.gz NGAKJZDUUNOPIW-SCLBCKFNSA-N 1 3 286.419 3.626 20 0 CHADHO Clc1cc2c(c(Cl)c1)[C@@H](NCC[C@H]1CC[NH2+]C1)CC2 ZINC000423251691 330182990 /nfs/dbraw/zinc/18/29/90/330182990.db2.gz SKSLNICWIABMGA-YGRLFVJLSA-N 1 3 299.245 3.570 20 0 CHADHO CC(C)[C@@H](N)C[NH2+][C@H](C)c1cc2ccccc2s1 ZINC000423262979 330183777 /nfs/dbraw/zinc/18/37/77/330183777.db2.gz ACUMTLDWJZLPRI-YPMHNXCESA-N 1 3 262.422 3.535 20 0 CHADHO CC(C)[C@H]([NH3+])CN[C@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000423278293 330185382 /nfs/dbraw/zinc/18/53/82/330185382.db2.gz QMWLRWCERZGDBR-VNQPRFMTSA-N 1 3 280.843 3.549 20 0 CHADHO C[C@H](N[C@@H]1CCCC[C@@H]1C[NH3+])c1ccc(F)c(Cl)c1 ZINC000423281985 330185871 /nfs/dbraw/zinc/18/58/71/330185871.db2.gz VQMQTKNROHZYPG-JVLSTEMRSA-N 1 3 284.806 3.647 20 0 CHADHO C[C@H]([NH2+]CC(C)(C)N)c1ccc(OCc2ccccc2)cc1 ZINC000423287499 330186159 /nfs/dbraw/zinc/18/61/59/330186159.db2.gz MRJYXXRVWPZIQU-HNNXBMFYSA-N 1 3 298.430 3.654 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2ccccc2N(C)C)cc1 ZINC000423290080 330186844 /nfs/dbraw/zinc/18/68/44/330186844.db2.gz CHYFIWZBLVBVQS-HUUCEWRRSA-N 1 3 297.446 3.623 20 0 CHADHO CCC(N)(CC)C[NH2+][C@H]1CC[C@@H](C)c2ccsc21 ZINC000423291766 330187325 /nfs/dbraw/zinc/18/73/25/330187325.db2.gz JTDBVEAPBXBGIS-YPMHNXCESA-N 1 3 266.454 3.794 20 0 CHADHO CCC([NH3+])(CC)CN[C@@H](C)[C@H](C)c1ccc(Cl)cc1 ZINC000423293702 330188078 /nfs/dbraw/zinc/18/80/78/330188078.db2.gz RZAKOJDFGAUVJK-STQMWFEESA-N 1 3 282.859 3.939 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H](c2ccccc2)C2CC2)cc1 ZINC000423293417 330188107 /nfs/dbraw/zinc/18/81/07/330188107.db2.gz RHMHAMLCFWAYGL-LIRRHRJNSA-N 1 3 280.415 3.947 20 0 CHADHO CC(C)[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1cccnc1 ZINC000423296257 330188202 /nfs/dbraw/zinc/18/82/02/330188202.db2.gz YTDGLBTVTTVSPU-KDOFPFPSSA-N 1 3 283.419 3.588 20 0 CHADHO Cc1ccc([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000423296584 330188672 /nfs/dbraw/zinc/18/86/72/330188672.db2.gz ZLZVMQFBOMZFHU-CABCVRRESA-N 1 3 268.404 3.866 20 0 CHADHO C[C@H](C[NH3+])CN[C@@H](C)c1cccc(-c2ccccc2)c1 ZINC000423297728 330188743 /nfs/dbraw/zinc/18/87/43/330188743.db2.gz LMZWXIAUGLCXGX-CABCVRRESA-N 1 3 268.404 3.599 20 0 CHADHO C[C@H](C[NH3+])CN[C@@H](c1cc2ccccc2o1)C(C)(C)C ZINC000423313718 330189772 /nfs/dbraw/zinc/18/97/72/330189772.db2.gz XGMFMRJLHACYRD-WBMJQRKESA-N 1 3 274.408 3.704 20 0 CHADHO CCC[C@H](NC[C@]1(C)CCC[NH2+]C1)c1ccccc1 ZINC000423316968 330189985 /nfs/dbraw/zinc/18/99/85/330189985.db2.gz AZLSMDNPNMODST-DLBZAZTESA-N 1 3 260.425 3.507 20 0 CHADHO CCC[C@H]([NH2+]C[C@]1(C)CCCNC1)c1ccccc1 ZINC000423316968 330189986 /nfs/dbraw/zinc/18/99/86/330189986.db2.gz AZLSMDNPNMODST-DLBZAZTESA-N 1 3 260.425 3.507 20 0 CHADHO Clc1ccc([C@@H]2CCC[C@@H](NC[C@H]3CC[NH2+]C3)C2)cc1 ZINC000423328500 330191222 /nfs/dbraw/zinc/19/12/22/330191222.db2.gz DSJPOHXDZQHUDP-YSVLISHTSA-N 1 3 292.854 3.565 20 0 CHADHO C[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1cc2ccccc2s1 ZINC000423363450 330194024 /nfs/dbraw/zinc/19/40/24/330194024.db2.gz IYWMPFQPMKCWNH-UBHSHLNASA-N 1 3 274.433 3.822 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H](Cc2ccccc2)c2ccccc2)CCN1 ZINC000423366377 330194677 /nfs/dbraw/zinc/19/46/77/330194677.db2.gz COLPQIUCRSKXOC-NSISKUIASA-N 1 3 294.442 3.701 20 0 CHADHO CC(C)C[C@H]([NH2+][C@@H]1CCN[C@@H](C)C1)c1cccs1 ZINC000423371023 330195090 /nfs/dbraw/zinc/19/50/90/330195090.db2.gz HGISZUGBOJJGJS-MJBXVCDLSA-N 1 3 266.454 3.565 20 0 CHADHO C[C@H](N[C@H]1CC[NH2+]C[C@@H]1C)c1ccc(F)c2ccccc21 ZINC000423397653 330195903 /nfs/dbraw/zinc/19/59/03/330195903.db2.gz OIIUREAGEDVUPK-LXIYXOSZSA-N 1 3 286.394 3.628 20 0 CHADHO C[C@H]([NH2+][C@H]1CCNC[C@@H]1C)c1ccc(F)c2ccccc21 ZINC000423397653 330195904 /nfs/dbraw/zinc/19/59/04/330195904.db2.gz OIIUREAGEDVUPK-LXIYXOSZSA-N 1 3 286.394 3.628 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)CCN1 ZINC000423401768 330196417 /nfs/dbraw/zinc/19/64/17/330196417.db2.gz XIPOHZGCHYUAKK-FSPWUOQZSA-N 1 3 290.426 3.787 20 0 CHADHO Cc1ccc(CC[C@@H](C)[NH2+]Cc2ccc3c(c2)CNC3)cc1 ZINC000423406505 330196846 /nfs/dbraw/zinc/19/68/46/330196846.db2.gz YTXSIIARNHUTTP-MRXNPFEDSA-N 1 3 294.442 3.709 20 0 CHADHO C[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)c1ccc2ccccc2c1 ZINC000423403939 330196869 /nfs/dbraw/zinc/19/68/69/330196869.db2.gz XKXCRAWUNDXJND-VHSSKADRSA-N 1 3 268.404 3.760 20 0 CHADHO C[C@H](CCc1cccc(F)c1)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423406637 330196919 /nfs/dbraw/zinc/19/69/19/330196919.db2.gz ZCXMEEKKHWQERS-CQSZACIVSA-N 1 3 298.405 3.540 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCN[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000423379808 330198860 /nfs/dbraw/zinc/19/88/60/330198860.db2.gz NHRGXNVNWGNZTJ-CQDKDKBSSA-N 1 3 266.816 3.521 20 0 CHADHO C[C@@H]1CC(C)(C)CC[C@H]1[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423381964 330199394 /nfs/dbraw/zinc/19/93/94/330199394.db2.gz JQIXWSXGMMZJCB-CXAGYDPISA-N 1 3 272.436 3.594 20 0 CHADHO Cc1cc([C@@H](C)NCc2ccc3c(c2)C[NH2+]C3)cs1 ZINC000423386586 330199561 /nfs/dbraw/zinc/19/95/61/330199561.db2.gz LYVPIQAVHIDOAZ-GFCCVEGCSA-N 1 3 272.417 3.511 20 0 CHADHO C[C@H]1C[C@@H]([NH2+]C2CCC3(CCCCC3)CC2)CCN1 ZINC000423385792 330199754 /nfs/dbraw/zinc/19/97/54/330199754.db2.gz RBEFRMXVSPCQOP-HOCLYGCPSA-N 1 3 264.457 3.610 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@H]1N[C@@H](c1ccc(F)cc1)C1CCCC1 ZINC000423391289 330200352 /nfs/dbraw/zinc/20/03/52/330200352.db2.gz KSBOUJTXOGFOBD-FSPWUOQZSA-N 1 3 290.426 3.645 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@@H](c1ccc(F)cc1)C1CCCC1 ZINC000423391289 330200354 /nfs/dbraw/zinc/20/03/54/330200354.db2.gz KSBOUJTXOGFOBD-FSPWUOQZSA-N 1 3 290.426 3.645 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H](c3cccc(Cl)c3)C2)CCN1 ZINC000423394431 330200737 /nfs/dbraw/zinc/20/07/37/330200737.db2.gz ZQWOHNUBJHYGFY-ODVANORSSA-N 1 3 292.854 3.706 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)c1cccc(-c2ccccc2)c1)[C@H](C)N ZINC000423434576 330201138 /nfs/dbraw/zinc/20/11/38/330201138.db2.gz CZOMIAJSXBASKF-ZNMIVQPWSA-N 1 3 268.404 3.740 20 0 CHADHO C[C@H](N)[C@H](C)[NH2+][C@H](c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000423437088 330201506 /nfs/dbraw/zinc/20/15/06/330201506.db2.gz FWELDSOYEOEGOY-FZNYLWTLSA-N 1 3 287.234 3.770 20 0 CHADHO C[C@@H](N[C@H](C)[C@H](C)[NH3+])C(c1ccccc1)c1ccccc1 ZINC000423446102 330202295 /nfs/dbraw/zinc/20/22/95/330202295.db2.gz NUCLVLXZEUMQHG-ARFHVFGLSA-N 1 3 282.431 3.532 20 0 CHADHO C[C@@H](N)[C@@H](C)[NH2+][C@@H](C)c1ccc(OCc2ccccc2)cc1 ZINC000423450196 330202804 /nfs/dbraw/zinc/20/28/04/330202804.db2.gz SQNUXXPOMRWULY-OAGGEKHMSA-N 1 3 298.430 3.652 20 0 CHADHO C[C@H](CCC[NH3+])N[C@@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000423451972 330202813 /nfs/dbraw/zinc/20/28/13/330202813.db2.gz JCJLOXGNZSBCGC-NOZJJQNGSA-N 1 3 287.234 3.698 20 0 CHADHO CCCCCOc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H](C)N)cc1 ZINC000423450693 330202848 /nfs/dbraw/zinc/20/28/48/330202848.db2.gz UAAWCTJZJIEXNH-ILXRZTDVSA-N 1 3 278.440 3.642 20 0 CHADHO CCC[C@H]([NH2+][C@H](C)[C@@H](C)N)c1ccc(Cl)cc1 ZINC000423454139 330203332 /nfs/dbraw/zinc/20/33/32/330203332.db2.gz YQSKOLCZQHUZHW-GYSYKLTISA-N 1 3 254.805 3.507 20 0 CHADHO CC[C@H](N)C[NH2+][C@H](C)c1cccc(OCc2ccccc2)c1 ZINC000423464630 330204241 /nfs/dbraw/zinc/20/42/41/330204241.db2.gz MHXCPOFPSKHZST-QAPCUYQASA-N 1 3 298.430 3.654 20 0 CHADHO CC[C@@H](NCCC[C@@H]1CCC[NH2+]1)c1cc(F)ccc1F ZINC000423490679 330207368 /nfs/dbraw/zinc/20/73/68/330207368.db2.gz XYDBOGVXNSRFBG-XJKSGUPXSA-N 1 3 282.378 3.538 20 0 CHADHO C[C@H](N[C@H]1CC[C@H](C[NH3+])C1)c1cc(Cl)sc1Cl ZINC000423494178 330207576 /nfs/dbraw/zinc/20/75/76/330207576.db2.gz RWQPYCVIAUPYEH-CIUDSAMLSA-N 1 3 293.263 3.833 20 0 CHADHO COc1ccccc1[C@@H](C)N[C@H](CCC[NH3+])c1ccccc1 ZINC000423498595 330208130 /nfs/dbraw/zinc/20/81/30/330208130.db2.gz IHBCLONVWKHWRT-CRAIPNDOSA-N 1 3 298.430 3.826 20 0 CHADHO C[C@@H]([NH2+]CCCNC1CC1)c1cccc(-c2ccncc2)c1 ZINC000423524708 330209954 /nfs/dbraw/zinc/20/99/54/330209954.db2.gz JXAXRLBBPXUTIY-OAHLLOKOSA-N 1 3 295.430 3.541 20 0 CHADHO C[C@@H]([NH2+]CCCNC1CC1)[C@H](C)c1ccc(Cl)cc1 ZINC000423550949 330211614 /nfs/dbraw/zinc/21/16/14/330211614.db2.gz IUJYRCSAIRSTPX-QWHCGFSZSA-N 1 3 280.843 3.564 20 0 CHADHO C1CC([C@@H]([NH2+][C@@H]2CCN3CCC[C@@H]3C2)C2CCCCC2)C1 ZINC000424273274 330333261 /nfs/dbraw/zinc/33/32/61/330333261.db2.gz WGACJLHUNYJCMQ-QRVBRYPASA-N 1 3 290.495 3.952 20 0 CHADHO Cc1ccc2c(c1)[C@H](NCc1ccc(C[NH+](C)C)cc1)CC2 ZINC000106479659 330338661 /nfs/dbraw/zinc/33/86/61/330338661.db2.gz HRIBVSIKUSGLHR-HXUWFJFHSA-N 1 3 294.442 3.834 20 0 CHADHO C[C@H](N[C@@H]1CCCC[C@@H]1C[NH3+])c1cccc(Cl)c1 ZINC000089139996 330380806 /nfs/dbraw/zinc/38/08/06/330380806.db2.gz MUZQWDAOIPKCBH-NJZAAPMLSA-N 1 3 266.816 3.508 20 0 CHADHO C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)N1CC[C@@H]1CCC[N@@H+]1C ZINC000451146910 331017418 /nfs/dbraw/zinc/01/74/18/331017418.db2.gz NJGWJOHXQILRAM-DGAVXFQQSA-N 1 3 292.389 3.522 20 0 CHADHO C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)N1CC[C@@H]1CCC[N@H+]1C ZINC000451146910 331017419 /nfs/dbraw/zinc/01/74/19/331017419.db2.gz NJGWJOHXQILRAM-DGAVXFQQSA-N 1 3 292.389 3.522 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)c1ccsc1 ZINC000453139558 331093400 /nfs/dbraw/zinc/09/34/00/331093400.db2.gz RSDWXMNENIOIIH-ILXRZTDVSA-N 1 3 266.454 3.662 20 0 CHADHO CC[C@H](N[C@@H](CC(C)C)C[NH+]1CCCC1)c1ccncc1 ZINC000453259623 331108614 /nfs/dbraw/zinc/10/86/14/331108614.db2.gz QHYHKZFMZZRJLJ-ROUUACIJSA-N 1 3 289.467 3.633 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]CCc2ccc(Cl)cc2)C1 ZINC000459419173 331280608 /nfs/dbraw/zinc/28/06/08/331280608.db2.gz BDHXNKYEHGAULR-MRXNPFEDSA-N 1 3 294.870 3.593 20 0 CHADHO CC(C)[N@@H+]1CCC[C@H](CNCCc2ccc(Cl)cc2)C1 ZINC000459419173 331280609 /nfs/dbraw/zinc/28/06/09/331280609.db2.gz BDHXNKYEHGAULR-MRXNPFEDSA-N 1 3 294.870 3.593 20 0 CHADHO CC(C)[N@H+]1CCC[C@H](CNCCc2ccc(Cl)cc2)C1 ZINC000459419173 331280610 /nfs/dbraw/zinc/28/06/10/331280610.db2.gz BDHXNKYEHGAULR-MRXNPFEDSA-N 1 3 294.870 3.593 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]CCc2cccc(Cl)c2)C1 ZINC000459425979 331280863 /nfs/dbraw/zinc/28/08/63/331280863.db2.gz LOLCHJOQDDFSIH-INIZCTEOSA-N 1 3 294.870 3.593 20 0 CHADHO CC(C)[N@@H+]1CCC[C@@H](CNCCc2cccc(Cl)c2)C1 ZINC000459425979 331280864 /nfs/dbraw/zinc/28/08/64/331280864.db2.gz LOLCHJOQDDFSIH-INIZCTEOSA-N 1 3 294.870 3.593 20 0 CHADHO CC(C)[N@H+]1CCC[C@@H](CNCCc2cccc(Cl)c2)C1 ZINC000459425979 331280865 /nfs/dbraw/zinc/28/08/65/331280865.db2.gz LOLCHJOQDDFSIH-INIZCTEOSA-N 1 3 294.870 3.593 20 0 CHADHO CC1(C)CC([NH2+]C[C@@H]2C[C@H]2c2ccccc2)CC(C)(C)N1 ZINC000459467945 331283200 /nfs/dbraw/zinc/28/32/00/331283200.db2.gz QFQGQROWLWPZJI-RDJZCZTQSA-N 1 3 286.463 3.689 20 0 CHADHO CC1(C)CC(NC[C@@H]2C[C@H]2c2ccccc2)CC(C)(C)[NH2+]1 ZINC000459467945 331283201 /nfs/dbraw/zinc/28/32/01/331283201.db2.gz QFQGQROWLWPZJI-RDJZCZTQSA-N 1 3 286.463 3.689 20 0 CHADHO CC(C)c1cccc(CNC2CC[NH+](C3CC3)CC2)c1 ZINC000459540972 331286624 /nfs/dbraw/zinc/28/66/24/331286624.db2.gz VZOQTPWRHVCXMN-UHFFFAOYSA-N 1 3 272.436 3.526 20 0 CHADHO C[C@@H]1CCCC[C@@H]1N1CCC([NH2+][C@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000459779018 331300498 /nfs/dbraw/zinc/30/04/98/331300498.db2.gz WPRKKWGJXSZFOC-PTGCCPEKSA-N 1 3 290.495 3.808 20 0 CHADHO CN1CC=C(C[NH2+]Cc2ccc(C3CCCC3)cc2)CC1 ZINC000462784517 331328786 /nfs/dbraw/zinc/32/87/86/331328786.db2.gz FWKRKHRSTRJCKH-UHFFFAOYSA-N 1 3 284.447 3.696 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)C1CCC(F)(F)CC1 ZINC000474059248 331566398 /nfs/dbraw/zinc/56/63/98/331566398.db2.gz NYKUSFRUWIUPKP-CFVMTHIKSA-N 1 3 288.426 3.663 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC2C(C)(C)C2(C)C)CC1 ZINC000475634442 331639948 /nfs/dbraw/zinc/63/99/48/331639948.db2.gz MLWBHUJGGHDQQG-UHFFFAOYSA-N 1 3 266.473 3.521 20 0 CHADHO C[C@H](C[NH2+]CC(C)(C)CN1CCCC1)Cc1ccccc1 ZINC000483406831 331872574 /nfs/dbraw/zinc/87/25/74/331872574.db2.gz MSJMEIMFNCGRAN-KRWDZBQOSA-N 1 3 288.479 3.577 20 0 CHADHO C[C@@H]([NH2+]C1CCN(CC2CCCC2)CC1)[C@H]1CC1(C)C ZINC000486989563 331954362 /nfs/dbraw/zinc/95/43/62/331954362.db2.gz UKBQPKWOUZGXMX-RHSMWYFYSA-N 1 3 278.484 3.665 20 0 CHADHO CC(C)C1CC([NH2+]C2CCN(CC3CCCC3)CC2)C1 ZINC000488431916 332007642 /nfs/dbraw/zinc/00/76/42/332007642.db2.gz HSYVYZCOFYCPKA-UHFFFAOYSA-N 1 3 278.484 3.665 20 0 CHADHO CC(C)C1CC(NC2CC[NH+](CC3CCCC3)CC2)C1 ZINC000488431916 332007643 /nfs/dbraw/zinc/00/76/43/332007643.db2.gz HSYVYZCOFYCPKA-UHFFFAOYSA-N 1 3 278.484 3.665 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+][C@H]1CS[C@@H](C(C)(C)C)C1 ZINC000488433278 332007689 /nfs/dbraw/zinc/00/76/89/332007689.db2.gz HQRDMIPDTBKDQM-BZUAXINKSA-N 1 3 298.540 3.761 20 0 CHADHO C[C@@H]1CCCC[N@@H+]1CCCN[C@H]1CS[C@@H](C(C)(C)C)C1 ZINC000488433278 332007691 /nfs/dbraw/zinc/00/76/91/332007691.db2.gz HQRDMIPDTBKDQM-BZUAXINKSA-N 1 3 298.540 3.761 20 0 CHADHO C[C@@H]1CCCC[N@H+]1CCCN[C@H]1CS[C@@H](C(C)(C)C)C1 ZINC000488433278 332007692 /nfs/dbraw/zinc/00/76/92/332007692.db2.gz HQRDMIPDTBKDQM-BZUAXINKSA-N 1 3 298.540 3.761 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+][C@@H]1CS[C@H](C(C)(C)C)C1 ZINC000488433281 332007742 /nfs/dbraw/zinc/00/77/42/332007742.db2.gz HQRDMIPDTBKDQM-PMPSAXMXSA-N 1 3 298.540 3.761 20 0 CHADHO C[C@@H]1CCCC[N@@H+]1CCCN[C@@H]1CS[C@H](C(C)(C)C)C1 ZINC000488433281 332007743 /nfs/dbraw/zinc/00/77/43/332007743.db2.gz HQRDMIPDTBKDQM-PMPSAXMXSA-N 1 3 298.540 3.761 20 0 CHADHO C[C@@H]1CCCC[N@H+]1CCCN[C@@H]1CS[C@H](C(C)(C)C)C1 ZINC000488433281 332007745 /nfs/dbraw/zinc/00/77/45/332007745.db2.gz HQRDMIPDTBKDQM-PMPSAXMXSA-N 1 3 298.540 3.761 20 0 CHADHO CC1CCN(CCC[NH2+][C@@H]2CS[C@H](C(C)(C)C)C2)CC1 ZINC000488445278 332009394 /nfs/dbraw/zinc/00/93/94/332009394.db2.gz DXIRGLCLBZTTOX-HOTGVXAUSA-N 1 3 298.540 3.618 20 0 CHADHO CC1CC[NH+](CCCN[C@@H]2CS[C@H](C(C)(C)C)C2)CC1 ZINC000488445278 332009395 /nfs/dbraw/zinc/00/93/95/332009395.db2.gz DXIRGLCLBZTTOX-HOTGVXAUSA-N 1 3 298.540 3.618 20 0 CHADHO C[NH+](C)CC1CCN([C@@H]2CCc3c2cccc3Cl)CC1 ZINC000488453720 332010746 /nfs/dbraw/zinc/01/07/46/332010746.db2.gz XIJDZQXOTJMYRR-QGZVFWFLSA-N 1 3 292.854 3.601 20 0 CHADHO CC[C@@H]1C[C@@H](C)CN1CCC[N@@H+]1C[C@@H](C)C[C@H]1CC ZINC000489296639 332045968 /nfs/dbraw/zinc/04/59/68/332045968.db2.gz SKGPLVRTXLAOLG-YYIAUSFCSA-N 1 3 266.473 3.617 20 0 CHADHO CC[C@@H]1C[C@@H](C)CN1CCC[N@H+]1C[C@@H](C)C[C@H]1CC ZINC000489296639 332045969 /nfs/dbraw/zinc/04/59/69/332045969.db2.gz SKGPLVRTXLAOLG-YYIAUSFCSA-N 1 3 266.473 3.617 20 0 CHADHO CC[C@@H]1C[C@H](C)CN1CCC[N@@H+]1C[C@H](C)C[C@H]1CC ZINC000489296639 332045970 /nfs/dbraw/zinc/04/59/70/332045970.db2.gz SKGPLVRTXLAOLG-YYIAUSFCSA-N 1 3 266.473 3.617 20 0 CHADHO CC[C@@H]1C[C@H](C)CN1CCC[N@H+]1C[C@H](C)C[C@H]1CC ZINC000489296639 332045971 /nfs/dbraw/zinc/04/59/71/332045971.db2.gz SKGPLVRTXLAOLG-YYIAUSFCSA-N 1 3 266.473 3.617 20 0 CHADHO C(CN1C[C@@H]2CCCC[C@H]2C1)C[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000489356388 332048331 /nfs/dbraw/zinc/04/83/31/332048331.db2.gz DUUZPDVZKQEWHP-CADBVGFASA-N 1 3 290.495 3.621 20 0 CHADHO C(CN1C[C@@H]2CCCC[C@H]2C1)C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000489356388 332048333 /nfs/dbraw/zinc/04/83/33/332048333.db2.gz DUUZPDVZKQEWHP-CADBVGFASA-N 1 3 290.495 3.621 20 0 CHADHO C(CN1C[C@@H]2CCCC[C@@H]2C1)C[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC000489356388 332048335 /nfs/dbraw/zinc/04/83/35/332048335.db2.gz DUUZPDVZKQEWHP-CADBVGFASA-N 1 3 290.495 3.621 20 0 CHADHO CC[C@@H](C)[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000310027202 333052876 /nfs/dbraw/zinc/05/28/76/333052876.db2.gz VWQGKXUOUCKLAC-AEFFLSMTSA-N 1 3 274.452 3.677 20 0 CHADHO CN(C/C=C\C[N@H+](C)Cc1ccccc1)Cc1ccccc1 ZINC000514077807 333064944 /nfs/dbraw/zinc/06/49/44/333064944.db2.gz ZYMSXEPOQNNKKC-KTKRTIGZSA-N 1 3 294.442 3.807 20 0 CHADHO CN(C/C=C\C[N@@H+](C)Cc1ccccc1)Cc1ccccc1 ZINC000514077807 333064945 /nfs/dbraw/zinc/06/49/45/333064945.db2.gz ZYMSXEPOQNNKKC-KTKRTIGZSA-N 1 3 294.442 3.807 20 0 CHADHO C[C@@H]([NH2+]C1CCN(C2CCCC2)CC1)C1CCSCC1 ZINC000187279212 333169042 /nfs/dbraw/zinc/16/90/42/333169042.db2.gz RWAQWDOBLYTXBR-CQSZACIVSA-N 1 3 296.524 3.515 20 0 CHADHO C1C[C@H]2C[C@H]([NH2+][C@@H]3CC[C@@H]4CCCC[C@@H]4C3)CCN2C1 ZINC000223485225 333208513 /nfs/dbraw/zinc/20/85/13/333208513.db2.gz IMEUTJXEPMANOL-TZNCUMHOSA-N 1 3 276.468 3.562 20 0 CHADHO Cc1cc(C)c(C[N@@H+]2CC[C@H](CN3CCCC3)C2)c(C)c1 ZINC000523556642 333332916 /nfs/dbraw/zinc/33/29/16/333332916.db2.gz GUYZODYYEQSFRV-GOSISDBHSA-N 1 3 286.463 3.530 20 0 CHADHO Cc1cc(C)c(C[N@H+]2CC[C@H](CN3CCCC3)C2)c(C)c1 ZINC000523556642 333332917 /nfs/dbraw/zinc/33/29/17/333332917.db2.gz GUYZODYYEQSFRV-GOSISDBHSA-N 1 3 286.463 3.530 20 0 CHADHO Cc1ccc(CN2CCC([C@@H]3CCC[NH2+]3)CC2)cc1Cl ZINC000235998880 333372896 /nfs/dbraw/zinc/37/28/96/333372896.db2.gz QIASUMSHRIMPRM-KRWDZBQOSA-N 1 3 292.854 3.612 20 0 CHADHO C[C@H](C[NH2+]C[C@@H](C)c1ccccc1)CN1CCCCC1 ZINC000037997574 333544087 /nfs/dbraw/zinc/54/40/87/333544087.db2.gz HAKFHFURGFSVKZ-IAGOWNOFSA-N 1 3 274.452 3.502 20 0 CHADHO CC(C)CC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000564318909 334083837 /nfs/dbraw/zinc/08/38/37/334083837.db2.gz LRSUCJQEEYJEIQ-SQNIBIBYSA-N 1 3 280.500 3.911 20 0 CHADHO C[C@@H]1CC[N@H+](CCCN2CCCCC2)[C@@H]2CCCC[C@H]12 ZINC000547737601 334113368 /nfs/dbraw/zinc/11/33/68/334113368.db2.gz ZZKPMJSVJIYBRL-KZNAEPCWSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@@H]1CC[N@@H+](CCCN2CCCCC2)[C@@H]2CCCC[C@H]12 ZINC000547737601 334113370 /nfs/dbraw/zinc/11/33/70/334113370.db2.gz ZZKPMJSVJIYBRL-KZNAEPCWSA-N 1 3 278.484 3.763 20 0 CHADHO CC[C@@H](C[NH2+]CCCN1CCCCC1)c1ccccc1 ZINC000135610875 334134558 /nfs/dbraw/zinc/13/45/58/334134558.db2.gz SIASWFSVQWUOLO-KRWDZBQOSA-N 1 3 274.452 3.646 20 0 CHADHO CC(C)CCC[NH2+]CC1CCN(Cc2cccs2)CC1 ZINC000548985228 334181990 /nfs/dbraw/zinc/18/19/90/334181990.db2.gz VYRBDZGRBPKLQZ-UHFFFAOYSA-N 1 3 294.508 3.986 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN([C@@H](CC)c2ccccc2)C1 ZINC000081570265 334197301 /nfs/dbraw/zinc/19/73/01/334197301.db2.gz GBMQPWYONNCEER-AEFFLSMTSA-N 1 3 274.452 3.801 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN([C@@H](CC)c2ccccc2)C1 ZINC000081570265 334197303 /nfs/dbraw/zinc/19/73/03/334197303.db2.gz GBMQPWYONNCEER-AEFFLSMTSA-N 1 3 274.452 3.801 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+]([C@@H](CC)c2ccccc2)C1 ZINC000081570265 334197304 /nfs/dbraw/zinc/19/73/04/334197304.db2.gz GBMQPWYONNCEER-AEFFLSMTSA-N 1 3 274.452 3.801 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+]([C@@H](CC)c2ccccc2)C1 ZINC000081570265 334197305 /nfs/dbraw/zinc/19/73/05/334197305.db2.gz GBMQPWYONNCEER-AEFFLSMTSA-N 1 3 274.452 3.801 20 0 CHADHO Fc1ccc(CNCCCCC[NH+]2CCCC2)cc1Cl ZINC000549874574 334207748 /nfs/dbraw/zinc/20/77/48/334207748.db2.gz KHFTUKPMXLXQFO-UHFFFAOYSA-N 1 3 298.833 3.835 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN([C@H](C)CCc2ccccc2)C1 ZINC000246218383 334242038 /nfs/dbraw/zinc/24/20/38/334242038.db2.gz OREMQJXMFQRYOZ-MJGOQNOKSA-N 1 3 288.479 3.671 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN([C@H](C)CCc2ccccc2)C1 ZINC000246218383 334242040 /nfs/dbraw/zinc/24/20/40/334242040.db2.gz OREMQJXMFQRYOZ-MJGOQNOKSA-N 1 3 288.479 3.671 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+]([C@H](C)CCc2ccccc2)C1 ZINC000246218383 334242042 /nfs/dbraw/zinc/24/20/42/334242042.db2.gz OREMQJXMFQRYOZ-MJGOQNOKSA-N 1 3 288.479 3.671 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+]([C@H](C)CCc2ccccc2)C1 ZINC000246218383 334242044 /nfs/dbraw/zinc/24/20/44/334242044.db2.gz OREMQJXMFQRYOZ-MJGOQNOKSA-N 1 3 288.479 3.671 20 0 CHADHO Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H](N(C)C)C2)cc1 ZINC000247231194 334277992 /nfs/dbraw/zinc/27/79/92/334277992.db2.gz WZTRFVSULVPTKM-BHYGNILZSA-N 1 3 260.425 3.518 20 0 CHADHO CC[C@H](c1ccccc1)N1CC[C@@H](C[NH+](CC)CC)C1 ZINC000247503797 334282981 /nfs/dbraw/zinc/28/29/81/334282981.db2.gz LYOOWHYPBOQGCH-FUHWJXTLSA-N 1 3 274.452 3.801 20 0 CHADHO CC[C@H](c1ccccc1)[N@@H+]1CC[C@@H](CN(CC)CC)C1 ZINC000247503797 334282983 /nfs/dbraw/zinc/28/29/83/334282983.db2.gz LYOOWHYPBOQGCH-FUHWJXTLSA-N 1 3 274.452 3.801 20 0 CHADHO CC[C@H](c1ccccc1)[N@H+]1CC[C@@H](CN(CC)CC)C1 ZINC000247503797 334282984 /nfs/dbraw/zinc/28/29/84/334282984.db2.gz LYOOWHYPBOQGCH-FUHWJXTLSA-N 1 3 274.452 3.801 20 0 CHADHO CC[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@H]2[C@@H](CCCN2C)C1 ZINC000248157356 334296208 /nfs/dbraw/zinc/29/62/08/334296208.db2.gz RNQSWNDTVRPTIZ-JQHSSLGASA-N 1 3 290.426 3.693 20 0 CHADHO CC[C@H](c1ccc(F)cc1)[N@H+]1CC[C@H]2[C@@H](CCCN2C)C1 ZINC000248157356 334296209 /nfs/dbraw/zinc/29/62/09/334296209.db2.gz RNQSWNDTVRPTIZ-JQHSSLGASA-N 1 3 290.426 3.693 20 0 CHADHO C[C@@H]([NH2+][C@H]1CCCC[C@H]1C)[C@H]1CCCN(C2CCC2)C1 ZINC000248399810 334300297 /nfs/dbraw/zinc/30/02/97/334300297.db2.gz KHTIQUILXCCIQQ-CBZIJGRNSA-N 1 3 278.484 3.808 20 0 CHADHO CC[N@@H+]1CCC[C@H]1CN[C@H](C)c1ccc(SC)cc1 ZINC000248533635 334304992 /nfs/dbraw/zinc/30/49/92/334304992.db2.gz UEIBCRSWBMYJRH-HIFRSBDPSA-N 1 3 278.465 3.543 20 0 CHADHO CC[N@H+]1CCC[C@H]1CN[C@H](C)c1ccc(SC)cc1 ZINC000248533635 334304993 /nfs/dbraw/zinc/30/49/93/334304993.db2.gz UEIBCRSWBMYJRH-HIFRSBDPSA-N 1 3 278.465 3.543 20 0 CHADHO C[C@@H]1CCCc2ccccc2[C@@H]1N[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000248749135 334315892 /nfs/dbraw/zinc/31/58/92/334315892.db2.gz FRBTUEWMQXWMNC-MJKGWSOKSA-N 1 3 298.474 3.917 20 0 CHADHO C[C@@H]1CCCc2ccccc2[C@@H]1N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000248749135 334315895 /nfs/dbraw/zinc/31/58/95/334315895.db2.gz FRBTUEWMQXWMNC-MJKGWSOKSA-N 1 3 298.474 3.917 20 0 CHADHO C[C@H](CCN1CC[C@@H](C[NH+]2CCCC2)C1)c1ccccc1 ZINC000248872467 334320171 /nfs/dbraw/zinc/32/01/71/334320171.db2.gz IEOLZAIFFRFSIG-MSOLQXFVSA-N 1 3 286.463 3.598 20 0 CHADHO C[C@H](CC[N@@H+]1CC[C@@H](CN2CCCC2)C1)c1ccccc1 ZINC000248872467 334320172 /nfs/dbraw/zinc/32/01/72/334320172.db2.gz IEOLZAIFFRFSIG-MSOLQXFVSA-N 1 3 286.463 3.598 20 0 CHADHO C[C@H](CC[N@H+]1CC[C@@H](CN2CCCC2)C1)c1ccccc1 ZINC000248872467 334320173 /nfs/dbraw/zinc/32/01/73/334320173.db2.gz IEOLZAIFFRFSIG-MSOLQXFVSA-N 1 3 286.463 3.598 20 0 CHADHO C[C@@H]1CCC[N@H+](CCCCN[C@H]2CCCc3occc32)C1 ZINC000248877626 334320378 /nfs/dbraw/zinc/32/03/78/334320378.db2.gz JTMBPZWVAHTFEE-WBVHZDCISA-N 1 3 290.451 3.759 20 0 CHADHO C[C@@H]1CCC[N@@H+](CCCCN[C@H]2CCCc3occc32)C1 ZINC000248877626 334320380 /nfs/dbraw/zinc/32/03/80/334320380.db2.gz JTMBPZWVAHTFEE-WBVHZDCISA-N 1 3 290.451 3.759 20 0 CHADHO CC(C)[C@H](N[C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(F)cc1 ZINC000251798971 334369851 /nfs/dbraw/zinc/36/98/51/334369851.db2.gz GFLGAJHXMDNPEN-XYPHTWIQSA-N 1 3 278.415 3.595 20 0 CHADHO CC(C)[C@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(F)cc1 ZINC000251798971 334369852 /nfs/dbraw/zinc/36/98/52/334369852.db2.gz GFLGAJHXMDNPEN-XYPHTWIQSA-N 1 3 278.415 3.595 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@@H](c2ccc(C)cc2)C2CC2)C1 ZINC000091305947 334375962 /nfs/dbraw/zinc/37/59/62/334375962.db2.gz ANOQLZNYPUDACM-LPHOPBHVSA-N 1 3 286.463 3.768 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@@H](c2ccc(C)cc2)C2CC2)C1 ZINC000091305947 334375963 /nfs/dbraw/zinc/37/59/63/334375963.db2.gz ANOQLZNYPUDACM-LPHOPBHVSA-N 1 3 286.463 3.768 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H](c2ccc(C)cc2)C2CC2)C1 ZINC000091305947 334375964 /nfs/dbraw/zinc/37/59/64/334375964.db2.gz ANOQLZNYPUDACM-LPHOPBHVSA-N 1 3 286.463 3.768 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H](c2ccccc2)C2CC2)C1 ZINC000091333255 334376425 /nfs/dbraw/zinc/37/64/25/334376425.db2.gz SLBAPKIMAPXUNV-LPHOPBHVSA-N 1 3 286.463 3.848 20 0 CHADHO CC(C)[N@@H+]1CCC[C@@H](CN[C@@H](c2ccccc2)C2CC2)C1 ZINC000091333255 334376426 /nfs/dbraw/zinc/37/64/26/334376426.db2.gz SLBAPKIMAPXUNV-LPHOPBHVSA-N 1 3 286.463 3.848 20 0 CHADHO CC(C)[N@H+]1CCC[C@@H](CN[C@@H](c2ccccc2)C2CC2)C1 ZINC000091333255 334376427 /nfs/dbraw/zinc/37/64/27/334376427.db2.gz SLBAPKIMAPXUNV-LPHOPBHVSA-N 1 3 286.463 3.848 20 0 CHADHO CC(C)[NH2+]CCCN[C@H](C)CCc1ccc(Cl)s1 ZINC000566088303 334621329 /nfs/dbraw/zinc/62/13/29/334621329.db2.gz IPXRWPWJQSABST-GFCCVEGCSA-N 1 3 288.888 3.700 20 0 CHADHO C[C@@H]1CCc2c(F)cccc2[C@H]1NCc1ccc(C[NH3+])cc1 ZINC000578868243 335682594 /nfs/dbraw/zinc/68/25/94/335682594.db2.gz VPSITFKVFXNRQW-YJYMSZOUSA-N 1 3 298.405 3.698 20 0 CHADHO C[C@@H](NCc1ccc(C[NH3+])cc1)c1ccc2c(c1)CCCC2 ZINC000581608392 336111702 /nfs/dbraw/zinc/11/17/02/336111702.db2.gz BMRORANDYSEUDE-OAHLLOKOSA-N 1 3 294.442 3.875 20 0 CHADHO C[C@@H]([NH3+])C1CCN(Cc2c(Cl)oc3ccccc32)CC1 ZINC000347117558 534289331 /nfs/dbraw/zinc/28/93/31/534289331.db2.gz UUWZGKAOWQECHT-LLVKDONJSA-N 1 3 292.810 3.645 20 0 CHADHO CC(C)(C)N1CCC([NH2+][C@@H]2CCc3c2cccc3F)CC1 ZINC000211860153 518709650 /nfs/dbraw/zinc/70/96/50/518709650.db2.gz DOLCYLVLARCIGH-QGZVFWFLSA-N 1 3 290.426 3.666 20 0 CHADHO CCC[C@@H]([NH2+]CC(C)(C)CN1CCCC1)c1cccnc1 ZINC000276594626 520772593 /nfs/dbraw/zinc/77/25/93/520772593.db2.gz AMRCPDOFHYHNGP-QGZVFWFLSA-N 1 3 289.467 3.634 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2oc3ccccc3c2C)C1 ZINC000037644450 521711357 /nfs/dbraw/zinc/71/13/57/521711357.db2.gz PHFRVMKEHJVFJS-GJZGRUSLSA-N 1 3 286.419 3.734 20 0 CHADHO C[NH+](C)Cc1cccc(CNCc2cccc3[nH]ccc32)c1 ZINC000237072233 521922488 /nfs/dbraw/zinc/92/24/88/521922488.db2.gz RWFYLQFFEPLUQQ-UHFFFAOYSA-N 1 3 293.414 3.519 20 0 CHADHO CN(C)[C@H]1CCC[N@H+](Cc2cc3ccccc3s2)CC1 ZINC000277331907 522099020 /nfs/dbraw/zinc/09/90/20/522099020.db2.gz VQPBLSGCFOHOAZ-HNNXBMFYSA-N 1 3 288.460 3.817 20 0 CHADHO CN(C)[C@H]1CCC[N@@H+](Cc2cc3ccccc3s2)CC1 ZINC000277331907 522099027 /nfs/dbraw/zinc/09/90/27/522099027.db2.gz VQPBLSGCFOHOAZ-HNNXBMFYSA-N 1 3 288.460 3.817 20 0 CHADHO CC[C@H]1CCC[C@@H]([NH2+]C2CCN(c3ccncc3)CC2)C1 ZINC000068591792 523120032 /nfs/dbraw/zinc/12/00/32/523120032.db2.gz KUQATEJTLOYYMF-DOTOQJQBSA-N 1 3 287.451 3.609 20 0 CHADHO C[NH+](C)CCC1CCN(Cc2cccc(C(F)F)c2)CC1 ZINC000279514051 524051781 /nfs/dbraw/zinc/05/17/81/524051781.db2.gz RWRHFNMBQDKZPJ-UHFFFAOYSA-N 1 3 296.405 3.788 20 0 CHADHO Cc1ccsc1[C@@H](C)NC[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000125833523 525868606 /nfs/dbraw/zinc/86/86/06/525868606.db2.gz ROVLIPWLSNWMRH-CABCVRRESA-N 1 3 280.481 3.828 20 0 CHADHO Cc1ccsc1[C@@H](C)NC[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000125833523 525868613 /nfs/dbraw/zinc/86/86/13/525868613.db2.gz ROVLIPWLSNWMRH-CABCVRRESA-N 1 3 280.481 3.828 20 0 CHADHO Cc1ccsc1[C@@H](C)[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000125833523 525868618 /nfs/dbraw/zinc/86/86/18/525868618.db2.gz ROVLIPWLSNWMRH-CABCVRRESA-N 1 3 280.481 3.828 20 0 CHADHO Cc1ccsc1[C@H](C)NC1CC[NH+](C(C)C)CC1 ZINC000070981950 525887711 /nfs/dbraw/zinc/88/77/11/525887711.db2.gz FSCJGYRGNMCSPE-ZDUSSCGKSA-N 1 3 266.454 3.580 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]CC2CCN(c3ccncc3)CC2)o1 ZINC000089215686 525920819 /nfs/dbraw/zinc/92/08/19/525920819.db2.gz BLVXVDHSFKAMJH-HNNXBMFYSA-N 1 3 299.418 3.550 20 0 CHADHO CSc1ccc([C@@H](C)NC2CC[NH+](C3CC3)CC2)cc1 ZINC000037140885 526057750 /nfs/dbraw/zinc/05/77/50/526057750.db2.gz JANSIJRKINFAHQ-CYBMUJFWSA-N 1 3 290.476 3.686 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)N1CCC[C@H](C[NH3+])C1 ZINC000044527624 526070463 /nfs/dbraw/zinc/07/04/63/526070463.db2.gz BUYASQPRJLQELC-HUUCEWRRSA-N 1 3 268.404 3.572 20 0 CHADHO CSc1ccc([C@H](C)NC2CC[NH+](C3CC3)CC2)cc1 ZINC000037140884 526071873 /nfs/dbraw/zinc/07/18/73/526071873.db2.gz JANSIJRKINFAHQ-ZDUSSCGKSA-N 1 3 290.476 3.686 20 0 CHADHO c1cc(CNCc2cccc(C[NH+]3CCCCCC3)c2)c[nH]1 ZINC000086252264 526429311 /nfs/dbraw/zinc/42/93/11/526429311.db2.gz HKOHXLGUVYDMTR-UHFFFAOYSA-N 1 3 297.446 3.681 20 0 CHADHO Cc1nc(C)c([C@H](C)[NH2+]C[C@@H](C)CN2CCCCC2)s1 ZINC000111361638 526753392 /nfs/dbraw/zinc/75/33/92/526753392.db2.gz AJPVFYHUDAIOTK-OLZOCXBDSA-N 1 3 295.496 3.533 20 0 CHADHO CN(Cc1cccc(Cl)c1Cl)C1CCC([NH3+])CC1 ZINC000091844622 1118835244 /nfs/dbraw/zinc/83/52/44/1118835244.db2.gz NSFKFYNBKQDDBY-UHFFFAOYSA-N 1 3 287.234 3.695 20 0 CHADHO CC(C)(C)CC[N@@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001202086548 1123173643 /nfs/dbraw/zinc/17/36/43/1123173643.db2.gz FDMYZCKIFNOCOM-INIZCTEOSA-N 1 3 266.473 3.763 20 0 CHADHO CC(C)(C)CC[N@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001202086548 1123173645 /nfs/dbraw/zinc/17/36/45/1123173645.db2.gz FDMYZCKIFNOCOM-INIZCTEOSA-N 1 3 266.473 3.763 20 0 CHADHO CCCCC[C@@H](C)[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000853240652 1123429442 /nfs/dbraw/zinc/42/94/42/1123429442.db2.gz QEEPQUVBPBXUOU-NVXWUHKLSA-N 1 3 266.473 3.667 20 0 CHADHO CC(C)[NH+](CCCN[C@H]1CCO[C@@H](C(C)(C)C)C1)C(C)C ZINC000872039467 1124663498 /nfs/dbraw/zinc/66/34/98/1124663498.db2.gz FQQPPWIXZLGXGP-DLBZAZTESA-N 1 3 298.515 3.679 20 0 CHADHO CCCCN1CCC([N@H+](C)Cc2cc(C)cs2)CC1 ZINC001137161405 1125296965 /nfs/dbraw/zinc/29/69/65/1125296965.db2.gz BIGIAGIQXPTEGN-UHFFFAOYSA-N 1 3 280.481 3.753 20 0 CHADHO CCCCN1CCC([N@@H+](C)Cc2cc(C)cs2)CC1 ZINC001137161405 1125296972 /nfs/dbraw/zinc/29/69/72/1125296972.db2.gz BIGIAGIQXPTEGN-UHFFFAOYSA-N 1 3 280.481 3.753 20 0 CHADHO CCCCN1CCC([NH2+]Cc2cccc(Cl)c2)CC1 ZINC000037150293 1132003076 /nfs/dbraw/zinc/00/30/76/1132003076.db2.gz LDPNKPXGZASEJM-UHFFFAOYSA-N 1 3 280.843 3.694 20 0 CHADHO CN1C(C)(C)CC([N@@H+]2CCC[C@@H](C(F)F)C2)CC1(C)C ZINC001171639761 1132080358 /nfs/dbraw/zinc/08/03/58/1132080358.db2.gz SKHNVLZILUHWHG-GFCCVEGCSA-N 1 3 288.426 3.615 20 0 CHADHO CN1C(C)(C)CC([N@H+]2CCC[C@@H](C(F)F)C2)CC1(C)C ZINC001171639761 1132080364 /nfs/dbraw/zinc/08/03/64/1132080364.db2.gz SKHNVLZILUHWHG-GFCCVEGCSA-N 1 3 288.426 3.615 20 0 CHADHO CC(C)N(Cc1ccc(Cl)s1)C1CC[NH+](C)CC1 ZINC001204447212 1133448684 /nfs/dbraw/zinc/44/86/84/1133448684.db2.gz GPWQBJRSRKPJOZ-UHFFFAOYSA-N 1 3 286.872 3.706 20 0 CHADHO CCCCCCN1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000134872158 1125568006 /nfs/dbraw/zinc/56/80/06/1125568006.db2.gz OKYYRLXRPXQXIA-NVXWUHKLSA-N 1 3 264.457 3.515 20 0 CHADHO CCCCCCN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134872158 1125568011 /nfs/dbraw/zinc/56/80/11/1125568011.db2.gz OKYYRLXRPXQXIA-NVXWUHKLSA-N 1 3 264.457 3.515 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](C)c2ccccc2C(C)(C)C)C1 ZINC000533638712 1125619916 /nfs/dbraw/zinc/61/99/16/1125619916.db2.gz MOPDLRMCLFBBSW-CVEARBPZSA-N 1 3 288.479 3.977 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](C)c2ccccc2C(C)(C)C)C1 ZINC000533638712 1125619918 /nfs/dbraw/zinc/61/99/18/1125619918.db2.gz MOPDLRMCLFBBSW-CVEARBPZSA-N 1 3 288.479 3.977 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](C)c2ccccc2C(C)(C)C)C1 ZINC000533638712 1125619920 /nfs/dbraw/zinc/61/99/20/1125619920.db2.gz MOPDLRMCLFBBSW-CVEARBPZSA-N 1 3 288.479 3.977 20 0 CHADHO C[NH+](C)CCOc1cccc(Nc2ccnc(C3CC3)c2)c1 ZINC001212806318 1125647998 /nfs/dbraw/zinc/64/79/98/1125647998.db2.gz XOJXQXMWJLVZTH-UHFFFAOYSA-N 1 3 297.402 3.643 20 0 CHADHO Cc1ccc([C@H](C)NCCCC[N@@H+]2CCCC[C@H]2C)o1 ZINC000246976831 1125651671 /nfs/dbraw/zinc/65/16/71/1125651671.db2.gz JKMCDQOPGSZGCJ-ZBFHGGJFSA-N 1 3 278.440 3.893 20 0 CHADHO Cc1ccc([C@H](C)NCCCC[N@H+]2CCCC[C@H]2C)o1 ZINC000246976831 1125651675 /nfs/dbraw/zinc/65/16/75/1125651675.db2.gz JKMCDQOPGSZGCJ-ZBFHGGJFSA-N 1 3 278.440 3.893 20 0 CHADHO CCC1(N2CCC2)CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000886707622 1125712148 /nfs/dbraw/zinc/71/21/48/1125712148.db2.gz MQMCCTRDBSCZGC-MRXNPFEDSA-N 1 3 272.436 3.698 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C[C@@]1(C)CC[NH2+]C1 ZINC000261769220 1125743212 /nfs/dbraw/zinc/74/32/12/1125743212.db2.gz MLWKRTOIMZOASO-VBQJREDUSA-N 1 3 294.870 3.763 20 0 CHADHO Cc1ccccc1C1CC(N(C[C@H]2CCC[NH2+]C2)C2CC2)C1 ZINC000261809255 1125744715 /nfs/dbraw/zinc/74/47/15/1125744715.db2.gz HNFFOPNXVZSQCU-MUYFXNHWSA-N 1 3 298.474 3.705 20 0 CHADHO Cc1ccccc1C1CC([N@H+](C[C@H]2CCCNC2)C2CC2)C1 ZINC000261809255 1125744718 /nfs/dbraw/zinc/74/47/18/1125744718.db2.gz HNFFOPNXVZSQCU-MUYFXNHWSA-N 1 3 298.474 3.705 20 0 CHADHO Cc1ccccc1C1CC([N@@H+](C[C@H]2CCCNC2)C2CC2)C1 ZINC000261809255 1125744725 /nfs/dbraw/zinc/74/47/25/1125744725.db2.gz HNFFOPNXVZSQCU-MUYFXNHWSA-N 1 3 298.474 3.705 20 0 CHADHO CCSc1ccc([C@H](C)[NH2+]C[C@H]2CCN(CC)C2)cc1 ZINC000533785290 1125781954 /nfs/dbraw/zinc/78/19/54/1125781954.db2.gz RBHPTSYPZMIXRX-LSDHHAIUSA-N 1 3 292.492 3.791 20 0 CHADHO CC[NH+]1CCC(N(C)[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC001169266385 1129712070 /nfs/dbraw/zinc/71/20/70/1129712070.db2.gz WGXQESVVLDRUNB-ZDUSSCGKSA-N 1 3 280.843 3.817 20 0 CHADHO Cc1ccc2cc(CN3CCCC34CC[NH+](C)CC4)[nH]c2c1 ZINC000668027180 1126754036 /nfs/dbraw/zinc/75/40/36/1126754036.db2.gz FESRKKWJEFRYFC-UHFFFAOYSA-N 1 3 297.446 3.537 20 0 CHADHO CCc1ccc([C@@H](C)[NH2+][C@H](CCN(C)C)C(C)(C)C)o1 ZINC000483158467 1126770802 /nfs/dbraw/zinc/77/08/02/1126770802.db2.gz UQGDJDWUOSDTHO-CZUORRHYSA-N 1 3 280.456 3.859 20 0 CHADHO COc1cccc([C@@H](C)N[C@@H](CC[NH+](C)C)C(C)(C)C)c1 ZINC000483183760 1126772407 /nfs/dbraw/zinc/77/24/07/1126772407.db2.gz JXQZXJBQVYHOSJ-PBHICJAKSA-N 1 3 292.467 3.712 20 0 CHADHO CCC[C@H](C)[C@H](CC)[NH2+][C@H]1CCC[C@H](N(C)C)C1 ZINC000484466305 1126817193 /nfs/dbraw/zinc/81/71/93/1126817193.db2.gz JXCZSTYEQBCOCH-VGWMRTNUSA-N 1 3 254.462 3.664 20 0 CHADHO Cc1cc([C@H](C)[NH2+][C@H]2CCC[C@H](N(C)C)C2)cc(C)c1F ZINC000484473176 1126820096 /nfs/dbraw/zinc/82/00/96/1126820096.db2.gz LVXRCOBJDATHQG-XIRDDKMYSA-N 1 3 292.442 3.966 20 0 CHADHO Cc1cc(C)cc([C@H](C)[NH2+][C@@H]2CCC[C@H](N(C)C)C2)c1 ZINC000484480875 1126820687 /nfs/dbraw/zinc/82/06/87/1126820687.db2.gz ANTGERDCBCNOAS-JQHSSLGASA-N 1 3 274.452 3.827 20 0 CHADHO CC(C)[NH+]1CCC(NC2(c3ccccc3)CCC2)CC1 ZINC000183745881 1126891585 /nfs/dbraw/zinc/89/15/85/1126891585.db2.gz OSGUKPWHHRBGMV-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO COc1c(C)cc([C@H](C)[NH2+]C[C@H](C)CN(C)C)cc1Cl ZINC000813876939 1130793227 /nfs/dbraw/zinc/79/32/27/1130793227.db2.gz DXOLMEJUTIIABP-AAEUAGOBSA-N 1 3 298.858 3.505 20 0 CHADHO C[C@H]([NH2+]C1CCN(CC2CCCC2)CC1)[C@@H]1CC1(C)C ZINC000486989568 1127014817 /nfs/dbraw/zinc/01/48/17/1127014817.db2.gz UKBQPKWOUZGXMX-YOEHRIQHSA-N 1 3 278.484 3.665 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1)[C@@H]1CC1(C)C ZINC000487555987 1127034539 /nfs/dbraw/zinc/03/45/39/1127034539.db2.gz UGHZOXAMOCWCRO-IVSAIRAKSA-N 1 3 278.484 3.664 20 0 CHADHO Cc1ccccc1[C@H](C)NC1CC[NH+](C2CCC2)CC1 ZINC000269063131 1127034944 /nfs/dbraw/zinc/03/49/44/1127034944.db2.gz YCTJZFYBXSYOCC-HNNXBMFYSA-N 1 3 272.436 3.663 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](N[C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC000629556767 1127107000 /nfs/dbraw/zinc/10/70/00/1127107000.db2.gz YKNNWWRISCUIDQ-IJEWVQPXSA-N 1 3 278.827 3.577 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@@H]2N[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000349806005 1127162147 /nfs/dbraw/zinc/16/21/47/1127162147.db2.gz XINAOCNJDDSVBN-LNLFQRSKSA-N 1 3 298.474 3.897 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@@H]2N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000349806005 1127162149 /nfs/dbraw/zinc/16/21/49/1127162149.db2.gz XINAOCNJDDSVBN-LNLFQRSKSA-N 1 3 298.474 3.897 20 0 CHADHO CC(C)[N@H+](C)CC1CCN([C@@H](C)c2ccccc2F)CC1 ZINC000590786143 1127273332 /nfs/dbraw/zinc/27/33/32/1127273332.db2.gz CIYMIKDGOKPVDH-HNNXBMFYSA-N 1 3 292.442 3.939 20 0 CHADHO CC(C)[N@@H+](C)CC1CCN([C@@H](C)c2ccccc2F)CC1 ZINC000590786143 1127273333 /nfs/dbraw/zinc/27/33/33/1127273333.db2.gz CIYMIKDGOKPVDH-HNNXBMFYSA-N 1 3 292.442 3.939 20 0 CHADHO CCSC1(C[NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000594986909 1127443592 /nfs/dbraw/zinc/44/35/92/1127443592.db2.gz MTYWBRDGBBBUHD-UHFFFAOYSA-N 1 3 296.524 3.659 20 0 CHADHO C[C@H](N[C@H](CC[NH+](C)C)C(C)(C)C)c1ccc(F)cc1 ZINC000604773719 1127715066 /nfs/dbraw/zinc/71/50/66/1127715066.db2.gz ZXWNNJHXHQEWCV-XJKSGUPXSA-N 1 3 280.431 3.843 20 0 CHADHO Cc1cccc(C)c1CN(C)C1CC[NH+](C(C)C)CC1 ZINC000606432077 1127761885 /nfs/dbraw/zinc/76/18/85/1127761885.db2.gz LYZWQVYPKJFNCR-UHFFFAOYSA-N 1 3 274.452 3.608 20 0 CHADHO Cc1cccc(C)c1CN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000606447707 1127763414 /nfs/dbraw/zinc/76/34/14/1127763414.db2.gz SPSUBEUIZGOSMS-SFHVURJKSA-N 1 3 286.463 3.754 20 0 CHADHO Cc1cccc(C)c1CN1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000608499821 1127872145 /nfs/dbraw/zinc/87/21/45/1127872145.db2.gz SSQQYLFHOUJOEO-SFHVURJKSA-N 1 3 286.463 3.611 20 0 CHADHO CCN1CC[C@H]([N@H+](C)C/C=C/c2ccc(F)cc2)C[C@H]1C ZINC000539819062 1127942956 /nfs/dbraw/zinc/94/29/56/1127942956.db2.gz JPFMOYZMCRFMRG-IJVDXJMESA-N 1 3 290.426 3.644 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)C/C=C/c2ccc(F)cc2)C[C@H]1C ZINC000539819062 1127942960 /nfs/dbraw/zinc/94/29/60/1127942960.db2.gz JPFMOYZMCRFMRG-IJVDXJMESA-N 1 3 290.426 3.644 20 0 CHADHO Cc1ccccc1[C@H](C)[NH2+]CC[C@H](C)N1CCCCC1 ZINC000544374509 1127970735 /nfs/dbraw/zinc/97/07/35/1127970735.db2.gz RVEZLEBRXLLYEY-IRXDYDNUSA-N 1 3 274.452 3.910 20 0 CHADHO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1CCCN1CCCCC1 ZINC000469996161 1128061047 /nfs/dbraw/zinc/06/10/47/1128061047.db2.gz JRXVJEORPORFEY-CYBMUJFWSA-N 1 3 292.389 3.525 20 0 CHADHO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1CCCN1CCCCC1 ZINC000469996161 1128061053 /nfs/dbraw/zinc/06/10/53/1128061053.db2.gz JRXVJEORPORFEY-CYBMUJFWSA-N 1 3 292.389 3.525 20 0 CHADHO C[C@H]([NH3+])[C@H](NC1CCC2(CC2(F)F)CC1)c1ccccc1 ZINC000925710525 1128137738 /nfs/dbraw/zinc/13/77/38/1128137738.db2.gz XIGZQTGCOMGNCO-IYOFFGIQSA-N 1 3 294.389 3.633 20 0 CHADHO CCC[C@H](C[NH2+]C[C@H]1CCN(C(C)C)C1)c1ccccc1 ZINC000561612780 1128341377 /nfs/dbraw/zinc/34/13/77/1128341377.db2.gz QNCPCJPSLXSWOE-IEBWSBKVSA-N 1 3 288.479 3.890 20 0 CHADHO C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1csc(Cl)c1 ZINC000322703570 1128348721 /nfs/dbraw/zinc/34/87/21/1128348721.db2.gz MKZWQUIURIHEDD-SMHCIBLRSA-N 1 3 284.856 3.677 20 0 CHADHO c1ccc([C@H]2CCCC[C@H]2[NH2+]CCCN2CCCC2)cc1 ZINC000037229537 1128424519 /nfs/dbraw/zinc/42/45/19/1128424519.db2.gz MNJOKIXBDMNIIM-RTBURBONSA-N 1 3 286.463 3.788 20 0 CHADHO C[C@H](CN[C@H](C)c1ccc2c(c1)CCC2)C[NH+]1CCCC1 ZINC000062078272 1128437143 /nfs/dbraw/zinc/43/71/43/1128437143.db2.gz QWDHFTIDIJGWAA-HZPDHXFCSA-N 1 3 286.463 3.558 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]C2[C@H](C)CCC[C@H]2C)C1 ZINC000125893386 1128455298 /nfs/dbraw/zinc/45/52/98/1128455298.db2.gz DSBLMZVARJDDFT-OAGGEKHMSA-N 1 3 266.473 3.521 20 0 CHADHO Cc1cccc([C@@H](C)[NH2+]C[C@@H]2CCCN(C(C)C)C2)c1 ZINC000125982813 1128459466 /nfs/dbraw/zinc/45/94/66/1128459466.db2.gz MASLQLBBWFPUHC-SJORKVTESA-N 1 3 274.452 3.766 20 0 CHADHO C(C[NH2+]C1CCN(C2CCCCC2)CC1)CC1CC1 ZINC000563951745 1128487173 /nfs/dbraw/zinc/48/71/73/1128487173.db2.gz AZTUPVTUHIXAOJ-UHFFFAOYSA-N 1 3 264.457 3.563 20 0 CHADHO CCCCC[C@@H](C)[NH+]1C(C)(C)CC(N)CC1(C)C ZINC001257501676 1128511770 /nfs/dbraw/zinc/51/17/70/1128511770.db2.gz KSHHMVWNJVOTIZ-CYBMUJFWSA-N 1 3 254.462 3.936 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](N[C@H](c2ccc(F)c(Cl)c2)C2CC2)C1 ZINC000566481472 1128544966 /nfs/dbraw/zinc/54/49/66/1128544966.db2.gz DDEWODXUURBRSY-WWGRRREGSA-N 1 3 296.817 3.790 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC23CCCC3)C1 ZINC000556104424 1128545800 /nfs/dbraw/zinc/54/58/00/1128545800.db2.gz WIKLUMJBJSWMEM-ARFHVFGLSA-N 1 3 264.457 3.562 20 0 CHADHO CC(C)[C@@H](CN(C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1 ZINC000567864807 1128573241 /nfs/dbraw/zinc/57/32/41/1128573241.db2.gz RSPUYPZKNOZNOQ-ZZJWQFMZSA-N 1 3 286.463 3.641 20 0 CHADHO Cc1cc(C)cc([C@@H](C)NC[C@@H](C)C[NH+]2CCCC2)c1 ZINC000130352461 1128580749 /nfs/dbraw/zinc/58/07/49/1128580749.db2.gz UECFWOAQKVBHDI-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO Fc1ccc(CNCCCCC[NH+]2CCCC2)c(Cl)c1 ZINC000572063889 1128641492 /nfs/dbraw/zinc/64/14/92/1128641492.db2.gz WDYPXMHJQFPMLG-UHFFFAOYSA-N 1 3 298.833 3.835 20 0 CHADHO C[C@H](N[C@@H](c1cccc(F)c1)C(C)(C)C)[C@H]1CCC[NH2+]C1 ZINC000515828812 1128684126 /nfs/dbraw/zinc/68/41/26/1128684126.db2.gz YDROVNURPBVTEA-QRTARXTBSA-N 1 3 292.442 3.891 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[NH2+]CC[C@H]1CCCN1C ZINC001258056465 1128714048 /nfs/dbraw/zinc/71/40/48/1128714048.db2.gz PKZDFKPVILAWFX-HRCADAONSA-N 1 3 254.462 3.521 20 0 CHADHO CCC[C@H]([NH2+][C@H]1CCNC2(CCC2)C1)C1CCCC1 ZINC000643547243 1117797864 /nfs/dbraw/zinc/79/78/64/1117797864.db2.gz BVJZOTOAJZBYES-HOTGVXAUSA-N 1 3 264.457 3.610 20 0 CHADHO Cc1ccccc1C[C@@H]([NH2+][C@@H]1CCNC2(CCC2)C1)C1CC1 ZINC000643547475 1117797980 /nfs/dbraw/zinc/79/79/80/1117797980.db2.gz FXSMSMJTWLXTRS-RTBURBONSA-N 1 3 298.474 3.580 20 0 CHADHO C1CC2(C1)C[C@@H]([NH2+][C@H]1CCCC13CCCCC3)CCN2 ZINC000643548696 1117799581 /nfs/dbraw/zinc/79/95/81/1117799581.db2.gz TYGBRWYIVLCMOY-HOTGVXAUSA-N 1 3 276.468 3.754 20 0 CHADHO C[N@@H+]1CC[C@H](N[C@@H]2CCCc3ccccc32)CC1(C)C ZINC000623336394 1117834249 /nfs/dbraw/zinc/83/42/49/1117834249.db2.gz MIFLLFKFLWGURT-DOTOQJQBSA-N 1 3 272.436 3.526 20 0 CHADHO C[N@H+]1CC[C@H](N[C@@H]2CCCc3ccccc32)CC1(C)C ZINC000623336394 1117834255 /nfs/dbraw/zinc/83/42/55/1117834255.db2.gz MIFLLFKFLWGURT-DOTOQJQBSA-N 1 3 272.436 3.526 20 0 CHADHO CC[C@H](N[C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(OC)cc1 ZINC000623339770 1117838784 /nfs/dbraw/zinc/83/87/84/1117838784.db2.gz JNDPLNFGKHLEAB-WBVHZDCISA-N 1 3 290.451 3.609 20 0 CHADHO CC[C@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(OC)cc1 ZINC000623339770 1117838789 /nfs/dbraw/zinc/83/87/89/1117838789.db2.gz JNDPLNFGKHLEAB-WBVHZDCISA-N 1 3 290.451 3.609 20 0 CHADHO Cc1ccc([C@H](C)N[C@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000623363271 1117841964 /nfs/dbraw/zinc/84/19/64/1117841964.db2.gz KOYBVPWLEPDAHB-HOCLYGCPSA-N 1 3 260.425 3.518 20 0 CHADHO Cc1ccc([C@H](C)N[C@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000623363271 1117841973 /nfs/dbraw/zinc/84/19/73/1117841973.db2.gz KOYBVPWLEPDAHB-HOCLYGCPSA-N 1 3 260.425 3.518 20 0 CHADHO Cc1ccc([C@H](C)N[C@@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000623363270 1117842062 /nfs/dbraw/zinc/84/20/62/1117842062.db2.gz KOYBVPWLEPDAHB-GOEBONIOSA-N 1 3 260.425 3.518 20 0 CHADHO Cc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000623363270 1117842067 /nfs/dbraw/zinc/84/20/67/1117842067.db2.gz KOYBVPWLEPDAHB-GOEBONIOSA-N 1 3 260.425 3.518 20 0 CHADHO Cc1cccc([C@H](C)N[C@@H]2CC[N@H+](C)C(C)(C)C2)c1C ZINC000623420817 1117853826 /nfs/dbraw/zinc/85/38/26/1117853826.db2.gz PGELICKWPCGAII-JKSUJKDBSA-N 1 3 274.452 3.827 20 0 CHADHO Cc1cccc([C@H](C)N[C@@H]2CC[N@@H+](C)C(C)(C)C2)c1C ZINC000623420817 1117853830 /nfs/dbraw/zinc/85/38/30/1117853830.db2.gz PGELICKWPCGAII-JKSUJKDBSA-N 1 3 274.452 3.827 20 0 CHADHO C[N@@H+]1CC[C@H](N[C@H](CC2CC2)c2ccccc2)CC1(C)C ZINC000623431734 1117855422 /nfs/dbraw/zinc/85/54/22/1117855422.db2.gz OJMAKBIYVSJLLZ-ZWKOTPCHSA-N 1 3 286.463 3.990 20 0 CHADHO C[N@H+]1CC[C@H](N[C@H](CC2CC2)c2ccccc2)CC1(C)C ZINC000623431734 1117855428 /nfs/dbraw/zinc/85/54/28/1117855428.db2.gz OJMAKBIYVSJLLZ-ZWKOTPCHSA-N 1 3 286.463 3.990 20 0 CHADHO CC[NH+](CC)C1CCN(C[C@H]2CCC(C)=C[C@H]2C)CC1 ZINC001208179447 1117857295 /nfs/dbraw/zinc/85/72/95/1117857295.db2.gz YHYSMMTUJWSMLF-IAGOWNOFSA-N 1 3 278.484 3.785 20 0 CHADHO Cc1ccc2oc(C[NH2+][C@H]3CCN(C)C(C)(C)C3)cc2c1 ZINC000623569595 1117874185 /nfs/dbraw/zinc/87/41/85/1117874185.db2.gz NNOPYSXZTFRQQU-HNNXBMFYSA-N 1 3 286.419 3.704 20 0 CHADHO CC[C@H](C)[C@@H](C)[NH2+]C1CCN(CC2CCCC2)CC1 ZINC000178158123 1117887510 /nfs/dbraw/zinc/88/75/10/1117887510.db2.gz JQGWNVLSNWUCAF-LSDHHAIUSA-N 1 3 266.473 3.665 20 0 CHADHO CCN(Cc1ccc(Cl)cc1)C[C@@H]1CCC[N@H+](C)C1 ZINC001208613866 1117889887 /nfs/dbraw/zinc/88/98/87/1117889887.db2.gz BOKUGSXIHLMLFE-OAHLLOKOSA-N 1 3 280.843 3.504 20 0 CHADHO CCN(Cc1ccc(Cl)cc1)C[C@@H]1CCC[N@@H+](C)C1 ZINC001208613866 1117889891 /nfs/dbraw/zinc/88/98/91/1117889891.db2.gz BOKUGSXIHLMLFE-OAHLLOKOSA-N 1 3 280.843 3.504 20 0 CHADHO C[C@H](c1cccc2ccccc21)[N@H+](C)CC(C)(C)N ZINC000662293579 1117891911 /nfs/dbraw/zinc/89/19/11/1117891911.db2.gz UTGXWQLFBPPXNP-CYBMUJFWSA-N 1 3 256.393 3.570 20 0 CHADHO C[C@H](c1cccc2ccccc21)[N@@H+](C)CC(C)(C)N ZINC000662293579 1117891916 /nfs/dbraw/zinc/89/19/16/1117891916.db2.gz UTGXWQLFBPPXNP-CYBMUJFWSA-N 1 3 256.393 3.570 20 0 CHADHO C([NH2+]C1CCN(C2CCCCC2)CC1)[C@H]1CCCC12CC2 ZINC000623825873 1117942663 /nfs/dbraw/zinc/94/26/63/1117942663.db2.gz MUBNBVOGWPBQRX-MRXNPFEDSA-N 1 3 290.495 3.953 20 0 CHADHO Cc1ccc(C2CC([NH2+]C[C@H]3CCCCN(C)C3)C2)cc1 ZINC000624122002 1117986185 /nfs/dbraw/zinc/98/61/85/1117986185.db2.gz HPWVTQFERJNYBS-IPJUCJBFSA-N 1 3 286.463 3.563 20 0 CHADHO C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCCN(C)C2)c2ccccc21 ZINC000624123333 1117987045 /nfs/dbraw/zinc/98/70/45/1117987045.db2.gz JYONPNPOVWKHCG-VKJFTORMSA-N 1 3 272.436 3.556 20 0 CHADHO CC[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccsc1 ZINC000624123555 1117987303 /nfs/dbraw/zinc/98/73/03/1117987303.db2.gz NZNWQVHZNACVSP-HIFRSBDPSA-N 1 3 266.454 3.521 20 0 CHADHO CCC[C@H](NCC[C@H]1CCC[N@@H+]1C)c1ccccc1 ZINC000181788219 1118007751 /nfs/dbraw/zinc/00/77/51/1118007751.db2.gz FJUFIMFUAAPLOV-SJORKVTESA-N 1 3 260.425 3.602 20 0 CHADHO CCC[C@H](NCC[C@H]1CCC[N@H+]1C)c1ccccc1 ZINC000181788219 1118007756 /nfs/dbraw/zinc/00/77/56/1118007756.db2.gz FJUFIMFUAAPLOV-SJORKVTESA-N 1 3 260.425 3.602 20 0 CHADHO CCC[C@H]([NH2+]CC[C@H]1CCCN1C)c1ccccc1 ZINC000181788219 1118007761 /nfs/dbraw/zinc/00/77/61/1118007761.db2.gz FJUFIMFUAAPLOV-SJORKVTESA-N 1 3 260.425 3.602 20 0 CHADHO CCSc1ccc([C@@H](C)[NH2+]CC[C@H]2CCCN2C)cc1 ZINC000182137905 1118015008 /nfs/dbraw/zinc/01/50/08/1118015008.db2.gz XTBNXEHWLCNQKA-GDBMZVCRSA-N 1 3 292.492 3.934 20 0 CHADHO CCCC[C@H](CC)CN1CCC([NH2+]C(C)C)CC1 ZINC000183637486 1118046853 /nfs/dbraw/zinc/04/68/53/1118046853.db2.gz PEIISTNHNJYNRH-HNNXBMFYSA-N 1 3 254.462 3.665 20 0 CHADHO C(C1CCCC1)N1CCC([NH2+]C2CCCCCC2)CC1 ZINC000236581864 1118108674 /nfs/dbraw/zinc/10/86/74/1118108674.db2.gz NYODNXMEQVAVPD-UHFFFAOYSA-N 1 3 278.484 3.953 20 0 CHADHO c1ccc2c(c1)C[C@H]2C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000121589339 1118215855 /nfs/dbraw/zinc/21/58/55/1118215855.db2.gz SPJBQVQBAJLNCE-KRWDZBQOSA-N 1 3 298.474 3.713 20 0 CHADHO C[C@@H]1C[C@H](C)CN(CCC[NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)C1 ZINC001648814908 1118222889 /nfs/dbraw/zinc/22/28/89/1118222889.db2.gz UIWRRQCFBNPTRT-IJTOGUNISA-N 1 3 278.484 3.523 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1ccc(Cl)s1 ZINC000037649003 1118278363 /nfs/dbraw/zinc/27/83/63/1118278363.db2.gz QAWVEPSWFQTTAG-WDEREUQCSA-N 1 3 284.856 3.536 20 0 CHADHO C[C@H](C[NH2+][C@H](C)c1ccc(C(F)(F)F)cc1)CN(C)C ZINC000312656399 1118347153 /nfs/dbraw/zinc/34/71/53/1118347153.db2.gz GHAKUCGFFILWKB-VXGBXAGGSA-N 1 3 288.357 3.554 20 0 CHADHO CC1CCN(CCC[NH2+]C2C[C@@H](C)C[C@H](C)C2)CC1 ZINC000084463104 1118378029 /nfs/dbraw/zinc/37/80/29/1118378029.db2.gz YOIHECASAMFGLL-HOTGVXAUSA-N 1 3 266.473 3.523 20 0 CHADHO CN1CCCC[C@H]1CC[N@@H+]1CCC=C(c2ccccc2)C1 ZINC000556506952 1118384130 /nfs/dbraw/zinc/38/41/30/1118384130.db2.gz YLIXCEPOYIVGTL-IBGZPJMESA-N 1 3 284.447 3.650 20 0 CHADHO CN1CCCC[C@H]1CC[N@H+]1CCC=C(c2ccccc2)C1 ZINC000556506952 1118384132 /nfs/dbraw/zinc/38/41/32/1118384132.db2.gz YLIXCEPOYIVGTL-IBGZPJMESA-N 1 3 284.447 3.650 20 0 CHADHO C[C@H]([NH2+][C@@H](CN)C1CC1)c1cc2c(ccc3ccccc23)o1 ZINC000580301815 1118414386 /nfs/dbraw/zinc/41/43/86/1118414386.db2.gz NGHWEBONKDLTKB-SJCJKPOMSA-N 1 3 294.398 3.974 20 0 CHADHO CC[C@H]1CC[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000562878214 1118442394 /nfs/dbraw/zinc/44/23/94/1118442394.db2.gz DYHSLDMJJLTQLC-YOEHRIQHSA-N 1 3 264.457 3.562 20 0 CHADHO CC[C@@H]1CC[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000562878212 1118442437 /nfs/dbraw/zinc/44/24/37/1118442437.db2.gz DYHSLDMJJLTQLC-RHSMWYFYSA-N 1 3 264.457 3.562 20 0 CHADHO CC[C@@H]1C[C@H]1CN1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC001167425615 1118485858 /nfs/dbraw/zinc/48/58/58/1118485858.db2.gz RQKFMOSXCYDLIM-XDNAFOTISA-N 1 3 278.484 3.619 20 0 CHADHO CC[C@@H]1C[C@H]1CN1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC001167425615 1118485859 /nfs/dbraw/zinc/48/58/59/1118485859.db2.gz RQKFMOSXCYDLIM-XDNAFOTISA-N 1 3 278.484 3.619 20 0 CHADHO CCN(C)C[C@@H]1CC[N@H+](CCC2CCCCCC2)C1 ZINC000580839338 1118512987 /nfs/dbraw/zinc/51/29/87/1118512987.db2.gz PXOYMNQNGCREIG-KRWDZBQOSA-N 1 3 266.473 3.621 20 0 CHADHO CCN(C)C[C@@H]1CC[N@@H+](CCC2CCCCCC2)C1 ZINC000580839338 1118512990 /nfs/dbraw/zinc/51/29/90/1118512990.db2.gz PXOYMNQNGCREIG-KRWDZBQOSA-N 1 3 266.473 3.621 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@H](C)CCC(C)(C)C)C1 ZINC000306041022 1118583725 /nfs/dbraw/zinc/58/37/25/1118583725.db2.gz NGRJOWRHOPDJFB-HUUCEWRRSA-N 1 3 254.462 3.521 20 0 CHADHO C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1ccc(Cl)c(F)c1 ZINC000322342863 1118601429 /nfs/dbraw/zinc/60/14/29/1118601429.db2.gz CMNUBZBPLYLCBZ-NDNKKMJESA-N 1 3 296.817 3.755 20 0 CHADHO C[C@H]1C[C@@H](C[NH3+])CN1Cc1cccc(C2CCCC2)c1 ZINC000656786770 1118659195 /nfs/dbraw/zinc/65/91/95/1118659195.db2.gz QHHCQELRTRFOSH-HOCLYGCPSA-N 1 3 272.436 3.513 20 0 CHADHO CCc1cccc2cc(C[NH2+]C[C@H]3CCN(C4CC4)C3)oc21 ZINC000657307894 1118979631 /nfs/dbraw/zinc/97/96/31/1118979631.db2.gz UEKWCLCIUQXFMA-CQSZACIVSA-N 1 3 298.430 3.569 20 0 CHADHO C[C@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccc2ccccc2c1 ZINC000044535105 1119056062 /nfs/dbraw/zinc/05/60/62/1119056062.db2.gz GVFPGJWSLLOYAZ-HOTGVXAUSA-N 1 3 282.431 3.832 20 0 CHADHO C[C@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccc2ccccc2c1 ZINC000044535105 1119056064 /nfs/dbraw/zinc/05/60/64/1119056064.db2.gz GVFPGJWSLLOYAZ-HOTGVXAUSA-N 1 3 282.431 3.832 20 0 CHADHO CCN(Cc1ccc(C[NH+](C)C)cc1)[C@@H](C)c1ccccn1 ZINC000626062747 1119136691 /nfs/dbraw/zinc/13/66/91/1119136691.db2.gz FEHMMZAGDWJGMW-INIZCTEOSA-N 1 3 297.446 3.726 20 0 CHADHO C([NH2+][C@@H]1CCCC[C@@H]1C1CC1)[C@@H]1CCCN(CC2CC2)C1 ZINC000663465112 1119145646 /nfs/dbraw/zinc/14/56/46/1119145646.db2.gz IBISMPHMZSYELW-QXAKKESOSA-N 1 3 290.495 3.667 20 0 CHADHO C[C@@H](NCc1cccc(C[NH+](C)C)c1)c1cccs1 ZINC000123638117 1119299313 /nfs/dbraw/zinc/29/93/13/1119299313.db2.gz WHLFAZKIDGUQNG-CYBMUJFWSA-N 1 3 274.433 3.661 20 0 CHADHO CC1CCN(CCC[NH2+]C[C@H]2C[C@H]2c2ccccc2)CC1 ZINC000343085049 1119304894 /nfs/dbraw/zinc/30/48/94/1119304894.db2.gz AIIJYEKFZHHCBG-MOPGFXCFSA-N 1 3 286.463 3.502 20 0 CHADHO C[C@@H]1C[C@H]1C[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000583294976 1119337411 /nfs/dbraw/zinc/33/74/11/1119337411.db2.gz JAUAIWDOENWBFN-QRQLOZEOSA-N 1 3 286.463 3.534 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@H](C)c1ccc(Cl)cc1 ZINC000650759243 1119417550 /nfs/dbraw/zinc/41/75/50/1119417550.db2.gz HHGDDFQSTZPXIR-CYBMUJFWSA-N 1 3 288.822 3.910 20 0 CHADHO CC[C@H](Cc1ccccc1)[NH2+]CCCN1CCCC[C@H]1C ZINC000252895710 1119424127 /nfs/dbraw/zinc/42/41/27/1119424127.db2.gz ZJRXEIQSZDNZAH-IEBWSBKVSA-N 1 3 288.479 3.862 20 0 CHADHO CC(C)[C@@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1cccnc1 ZINC000091372557 1119556281 /nfs/dbraw/zinc/55/62/81/1119556281.db2.gz CZRMERLWWYIDPL-QGZVFWFLSA-N 1 3 289.467 3.631 20 0 CHADHO CC(C)CCC[C@@H](C)[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000685455217 1119610910 /nfs/dbraw/zinc/61/09/10/1119610910.db2.gz KXMFLCVIAMZXSL-HZPDHXFCSA-N 1 3 254.462 3.521 20 0 CHADHO CCCc1ccc(C[N@@H+]2CCC[C@H]3CN(C)CC[C@@H]32)cc1 ZINC000685470719 1119612499 /nfs/dbraw/zinc/61/24/99/1119612499.db2.gz LBZSUMNTSXDGKY-OALUTQOASA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1ccc(C[N@H+]2CCC[C@H]3CN(C)CC[C@@H]32)cc1 ZINC000685470719 1119612500 /nfs/dbraw/zinc/61/25/00/1119612500.db2.gz LBZSUMNTSXDGKY-OALUTQOASA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1ccc(CN2CCC[C@H]3C[N@H+](C)CC[C@@H]32)cc1 ZINC000685470719 1119612504 /nfs/dbraw/zinc/61/25/04/1119612504.db2.gz LBZSUMNTSXDGKY-OALUTQOASA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1ccc(CN2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)cc1 ZINC000685470719 1119612507 /nfs/dbraw/zinc/61/25/07/1119612507.db2.gz LBZSUMNTSXDGKY-OALUTQOASA-N 1 3 286.463 3.555 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H]2C[C@H](C)CC(C)(C)C2)C1 ZINC000708768916 1119809360 /nfs/dbraw/zinc/80/93/60/1119809360.db2.gz YNFSTVGYGWQPQL-XHSDSOJGSA-N 1 3 266.473 3.523 20 0 CHADHO CC[C@H]([NH2+]C1CCN(C2CCCCC2)CC1)[C@H]1C[C@H]1C ZINC000414092829 1119894482 /nfs/dbraw/zinc/89/44/82/1119894482.db2.gz FJFUOKZEURGFMQ-JLSDUUJJSA-N 1 3 278.484 3.808 20 0 CHADHO CC[C@H]([NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1)[C@@H]1C[C@@H]1C ZINC000414102892 1119899649 /nfs/dbraw/zinc/89/96/49/1119899649.db2.gz DEVQZGYMPSXXEN-GRLWTPEZSA-N 1 3 278.484 3.664 20 0 CHADHO C[C@@H](NCC[C@H]1CCC[N@H+](C)C1)c1ccc(F)cc1Cl ZINC000414188340 1119931282 /nfs/dbraw/zinc/93/12/82/1119931282.db2.gz QOTKGYLAJVPRKP-CHWSQXEVSA-N 1 3 298.833 3.862 20 0 CHADHO C[C@@H](NCC[C@H]1CCC[N@@H+](C)C1)c1ccc(F)cc1Cl ZINC000414188340 1119931284 /nfs/dbraw/zinc/93/12/84/1119931284.db2.gz QOTKGYLAJVPRKP-CHWSQXEVSA-N 1 3 298.833 3.862 20 0 CHADHO CN1CCCC[C@@H](C[NH2+][C@H]2CC(C)(C)Cc3occc32)C1 ZINC000624120786 1120065568 /nfs/dbraw/zinc/06/55/68/1120065568.db2.gz GYXBOYCBWQVEIS-HOCLYGCPSA-N 1 3 290.451 3.615 20 0 CHADHO Cc1oc2ccccc2c1C[NH2+]C[C@H]1CCCCN(C)C1 ZINC000623657237 1120065510 /nfs/dbraw/zinc/06/55/10/1120065510.db2.gz LWOLUEXMMMXCQY-OAHLLOKOSA-N 1 3 286.419 3.563 20 0 CHADHO CN1CCCC[C@@H](C[NH2+][C@H]2CCCc3ccc(F)cc32)C1 ZINC000624121833 1120101435 /nfs/dbraw/zinc/10/14/35/1120101435.db2.gz DOZLAFFFIPFFIS-KSSFIOAISA-N 1 3 290.426 3.525 20 0 CHADHO C[NH+](C)CCC1CCN(Cc2ccccc2Cl)CC1 ZINC000056524173 1120128495 /nfs/dbraw/zinc/12/84/95/1120128495.db2.gz YYFTXTQYOHRYLA-UHFFFAOYSA-N 1 3 280.843 3.504 20 0 CHADHO C[C@H](CN(C)CC[C@@H]1CCCC[N@@H+]1C)c1ccccc1 ZINC000472666151 1120138307 /nfs/dbraw/zinc/13/83/07/1120138307.db2.gz LAEHAJZGBHVBBQ-AEFFLSMTSA-N 1 3 274.452 3.596 20 0 CHADHO C[C@H](CN(C)CC[C@@H]1CCCC[N@H+]1C)c1ccccc1 ZINC000472666151 1120138309 /nfs/dbraw/zinc/13/83/09/1120138309.db2.gz LAEHAJZGBHVBBQ-AEFFLSMTSA-N 1 3 274.452 3.596 20 0 CHADHO C[C@H](C[NH2+]Cc1ccc(-c2ccccc2)cc1)CN(C)C ZINC000314445615 1120207031 /nfs/dbraw/zinc/20/70/31/1120207031.db2.gz XSGWXJUPHOFHFZ-MRXNPFEDSA-N 1 3 282.431 3.641 20 0 CHADHO CCCCc1ccc(CN(CCC)C[C@@H]2CC[NH2+]C2)s1 ZINC001236833923 1128902301 /nfs/dbraw/zinc/90/23/01/1128902301.db2.gz DIUQUVUKKDRYFP-OAHLLOKOSA-N 1 3 294.508 3.912 20 0 CHADHO CC(C)C[C@H](C)CN1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000499545764 1120310897 /nfs/dbraw/zinc/31/08/97/1120310897.db2.gz CYIYZYMMHNFTBY-BQFCYCMXSA-N 1 3 278.484 3.617 20 0 CHADHO CC(C)C[C@H](C)CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000499545764 1120310901 /nfs/dbraw/zinc/31/09/01/1120310901.db2.gz CYIYZYMMHNFTBY-BQFCYCMXSA-N 1 3 278.484 3.617 20 0 CHADHO CCCCCC[NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000185725267 1120382508 /nfs/dbraw/zinc/38/25/08/1120382508.db2.gz UOFUTKNBNHUFID-HOTGVXAUSA-N 1 3 266.473 3.809 20 0 CHADHO CC1(C)[C@@H](c2ccccc2)[C@@H]1N[C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000629515986 1128913903 /nfs/dbraw/zinc/91/39/03/1128913903.db2.gz YSARZAAVXOXKTO-LFDJNIOPSA-N 1 3 298.474 3.689 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1)CN(C)C ZINC000425939160 1120475556 /nfs/dbraw/zinc/47/55/56/1120475556.db2.gz ZDEKKAIQEXHKBA-KBHBFKLGSA-N 1 3 294.405 3.531 20 0 CHADHO CS[C@@H](C[NH2+]C1CCN(C(C)(C)C)CC1)C(C)(C)C ZINC000543411497 1120515947 /nfs/dbraw/zinc/51/59/47/1120515947.db2.gz PEIRWEDUUDKEDP-AWEZNQCLSA-N 1 3 286.529 3.617 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]CC[C@@H](C)N2CCCCC2)cc1 ZINC000543418546 1120519508 /nfs/dbraw/zinc/51/95/08/1120519508.db2.gz WRKFXTJPSUWBPI-IAGOWNOFSA-N 1 3 274.452 3.910 20 0 CHADHO CN1[C@@H]2CC[C@H]1CC([NH2+]Cc1ccc3ccccc3c1)C2 ZINC000192743836 1120554661 /nfs/dbraw/zinc/55/46/61/1120554661.db2.gz BCCYNVDEIDOFME-YQQQUEKLSA-N 1 3 280.415 3.555 20 0 CHADHO c1ccc([C@@H]2C[C@H]2C[NH2+][C@@H]2CCNC[C@H]2C2CCCC2)cc1 ZINC000925677162 1120565638 /nfs/dbraw/zinc/56/56/38/1120565638.db2.gz OOIRIOUELURISR-LWYYNNOASA-N 1 3 298.474 3.548 20 0 CHADHO CC[C@@H]1CCC[C@@H]([NH2+]CCCN(C)C(C)C)CC1 ZINC000226334583 1120602370 /nfs/dbraw/zinc/60/23/70/1120602370.db2.gz ZQDCZGQTJCTVIL-HZPDHXFCSA-N 1 3 254.462 3.665 20 0 CHADHO CC(C)C[C@@H]1CCC[C@H]([NH2+]CCCN(C)C(C)C)C1 ZINC000226334894 1120608475 /nfs/dbraw/zinc/60/84/75/1120608475.db2.gz PBGOESCDZTYCDD-IRXDYDNUSA-N 1 3 268.489 3.911 20 0 CHADHO CC(C)C[C@@H]1CCC[C@@H]([NH2+]CCCN(C)C(C)C)C1 ZINC000226334887 1120611531 /nfs/dbraw/zinc/61/15/31/1120611531.db2.gz PBGOESCDZTYCDD-DLBZAZTESA-N 1 3 268.489 3.911 20 0 CHADHO C1CNC[C@@]2(C1)CCC[N@@H+](C1CCCCCCC1)C2 ZINC000228081404 1120764284 /nfs/dbraw/zinc/76/42/84/1120764284.db2.gz WWCHVYUQXPNNAZ-QGZVFWFLSA-N 1 3 264.457 3.565 20 0 CHADHO C1CNC[C@@]2(C1)CCC[N@H+](C1CCCCCCC1)C2 ZINC000228081404 1120764289 /nfs/dbraw/zinc/76/42/89/1120764289.db2.gz WWCHVYUQXPNNAZ-QGZVFWFLSA-N 1 3 264.457 3.565 20 0 CHADHO CC(C)C1CCC([N@@H+]2CCC[C@@]3(CCCNC3)C2)CC1 ZINC000228086230 1120774932 /nfs/dbraw/zinc/77/49/32/1120774932.db2.gz GVLBIYPMGACVEC-DAWZGUTISA-N 1 3 278.484 3.667 20 0 CHADHO CC(C)C1CCC([N@H+]2CCC[C@@]3(CCCNC3)C2)CC1 ZINC000228086230 1120774933 /nfs/dbraw/zinc/77/49/33/1120774933.db2.gz GVLBIYPMGACVEC-DAWZGUTISA-N 1 3 278.484 3.667 20 0 CHADHO CC(C)C[C@@H](NC[C@H]1CCC[N@H+](C)C1)c1ccc(F)cc1 ZINC000652151428 1120791848 /nfs/dbraw/zinc/79/18/48/1120791848.db2.gz SLWSAVXHLGMNOW-CRAIPNDOSA-N 1 3 292.442 3.844 20 0 CHADHO CC(C)C[C@@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccc(F)cc1 ZINC000652151428 1120791850 /nfs/dbraw/zinc/79/18/50/1120791850.db2.gz SLWSAVXHLGMNOW-CRAIPNDOSA-N 1 3 292.442 3.844 20 0 CHADHO CCSc1ccc([C@H](C)NCCC(C)(C)[NH3+])cc1 ZINC000925741744 1120858697 /nfs/dbraw/zinc/85/86/97/1120858697.db2.gz MAMGXNALTROWQW-LBPRGKRZSA-N 1 3 266.454 3.577 20 0 CHADHO C[C@@H](N)[C@@H]1CCC[N@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000662245807 1120910739 /nfs/dbraw/zinc/91/07/39/1120910739.db2.gz OZDIRMUXZNMJSC-PSBWJHGTSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@@H](N)[C@@H]1CCC[N@@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000662245807 1120910741 /nfs/dbraw/zinc/91/07/41/1120910741.db2.gz OZDIRMUXZNMJSC-PSBWJHGTSA-N 1 3 286.463 3.630 20 0 CHADHO CC(C)c1cccc(C[NH2+]C2CC(N3CCCCC3)C2)c1 ZINC000663327752 1120934699 /nfs/dbraw/zinc/93/46/99/1120934699.db2.gz PFRXLWGDSQYCSK-UHFFFAOYSA-N 1 3 286.463 3.917 20 0 CHADHO CC(C)C[C@@H]([NH2+]C[C@@H](C)CN(C)C)c1ccccc1 ZINC000311870684 1120970886 /nfs/dbraw/zinc/97/08/86/1120970886.db2.gz WUTRMHJNBODUHT-NVXWUHKLSA-N 1 3 262.441 3.561 20 0 CHADHO CC(C)C[C@@H](NC[C@@H](C)C[NH+](C)C)c1ccccc1 ZINC000311870684 1120970889 /nfs/dbraw/zinc/97/08/89/1120970889.db2.gz WUTRMHJNBODUHT-NVXWUHKLSA-N 1 3 262.441 3.561 20 0 CHADHO C([NH2+][C@@H]1CCCC12CCCC2)[C@H]1CCCN(CC2CC2)C1 ZINC000663465865 1120980985 /nfs/dbraw/zinc/98/09/85/1120980985.db2.gz LZOXZLRPPWCMRC-QZTJIDSGSA-N 1 3 290.495 3.811 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCN(CC2CC2)C1)C1CCCCC1 ZINC000663466950 1120983149 /nfs/dbraw/zinc/98/31/49/1120983149.db2.gz BWKCXDSWMIXZNA-DOTOQJQBSA-N 1 3 278.484 3.667 20 0 CHADHO C[C@@H](CC1CCCC1)[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663470224 1120985212 /nfs/dbraw/zinc/98/52/12/1120985212.db2.gz TTXJHVYICVPVLQ-YJBOKZPZSA-N 1 3 278.484 3.667 20 0 CHADHO C[C@H](N[C@H]1CC[N@H+](CC2CC2)C1)c1cccc2ccccc21 ZINC000674048571 1121059828 /nfs/dbraw/zinc/05/98/28/1121059828.db2.gz XMBFBNNWPUIUAK-YJBOKZPZSA-N 1 3 294.442 3.975 20 0 CHADHO C[C@H](N[C@H]1CC[N@@H+](CC2CC2)C1)c1cccc2ccccc21 ZINC000674048571 1121059837 /nfs/dbraw/zinc/05/98/37/1121059837.db2.gz XMBFBNNWPUIUAK-YJBOKZPZSA-N 1 3 294.442 3.975 20 0 CHADHO c1ccc2c(c1)nccc2NC1CC[NH+](CC2CC2)CC1 ZINC000171854875 1121132479 /nfs/dbraw/zinc/13/24/79/1121132479.db2.gz DBKSYUYGIWXYKI-UHFFFAOYSA-N 1 3 281.403 3.521 20 0 CHADHO CCC[C@H](C[N@@H+]1CCC[C@H](N(C)C)CC1)c1ccccc1 ZINC000432796714 1121360190 /nfs/dbraw/zinc/36/01/90/1121360190.db2.gz IMYPQQCDXKRZSV-MOPGFXCFSA-N 1 3 288.479 3.986 20 0 CHADHO CCC[C@H](C[N@H+]1CCC[C@H](N(C)C)CC1)c1ccccc1 ZINC000432796714 1121360197 /nfs/dbraw/zinc/36/01/97/1121360197.db2.gz IMYPQQCDXKRZSV-MOPGFXCFSA-N 1 3 288.479 3.986 20 0 CHADHO CC1(C[NH2+][C@@H]2CCC[C@@H]3CN(Cc4ccccc4)C[C@H]32)CC1 ZINC000512632102 1121499683 /nfs/dbraw/zinc/49/96/83/1121499683.db2.gz WZFPPCMYKDZNHK-GUDVDZBRSA-N 1 3 298.474 3.677 20 0 CHADHO C[C@@H]1C[C@@H]1C[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000512642953 1121505279 /nfs/dbraw/zinc/50/52/79/1121505279.db2.gz UNTLLEZRMNUHEZ-MTEHYEEQSA-N 1 3 298.474 3.533 20 0 CHADHO CCCC[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000512669171 1121520182 /nfs/dbraw/zinc/52/01/82/1121520182.db2.gz YZLWFGIGWQXOHV-IPMKNSEASA-N 1 3 286.463 3.677 20 0 CHADHO Cc1ccc([C@H](NCC2=CC[N@H+](C)CC2)C2CCCC2)o1 ZINC000543626729 1121534214 /nfs/dbraw/zinc/53/42/14/1121534214.db2.gz ISUDBDAKNKVJSR-GOSISDBHSA-N 1 3 288.435 3.671 20 0 CHADHO Cc1ccc([C@H](NCC2=CC[N@@H+](C)CC2)C2CCCC2)o1 ZINC000543626729 1121534217 /nfs/dbraw/zinc/53/42/17/1121534217.db2.gz ISUDBDAKNKVJSR-GOSISDBHSA-N 1 3 288.435 3.671 20 0 CHADHO Cc1cc(Nc2ccnc(C3CCC3)c2)cc(C)[nH+]1 ZINC001176054159 1121541966 /nfs/dbraw/zinc/54/19/66/1121541966.db2.gz RPQDTRIAJHDPJI-UHFFFAOYSA-N 1 3 253.349 3.526 20 0 CHADHO CCC1(N2CCC2)CC[NH+](CCC2CCCC2)CC1 ZINC001176235209 1121582647 /nfs/dbraw/zinc/58/26/47/1121582647.db2.gz QARVBWCBOTZOBB-UHFFFAOYSA-N 1 3 264.457 3.517 20 0 CHADHO Cc1cc(Nc2ccc(C[NH+](C)C)cc2)c2ccccc2n1 ZINC001176286525 1121588124 /nfs/dbraw/zinc/58/81/24/1121588124.db2.gz FRWFLKHREQPJFB-UHFFFAOYSA-N 1 3 291.398 3.770 20 0 CHADHO CC[NH+]1CCC(NC/C(C)=C\c2ccc(Cl)cc2)CC1 ZINC000513008973 1121662860 /nfs/dbraw/zinc/66/28/60/1121662860.db2.gz MVRNRHYVGIESOR-OWBHPGMISA-N 1 3 292.854 3.817 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N[C@@H](C)c1nc(C)sc1C ZINC000020089035 1121691324 /nfs/dbraw/zinc/69/13/24/1121691324.db2.gz WFNXXNMFJGEFFG-OLZOCXBDSA-N 1 3 297.512 3.921 20 0 CHADHO CN(C)CC(C)(C)C[NH2+]Cc1cccc(OC(C)(C)C)c1 ZINC001177093421 1121712465 /nfs/dbraw/zinc/71/24/65/1121712465.db2.gz QYCZANXHSQQEDI-UHFFFAOYSA-N 1 3 292.467 3.541 20 0 CHADHO CSc1ccc(CNCCCC[NH+]2CCC(C)CC2)o1 ZINC001177294472 1121720658 /nfs/dbraw/zinc/72/06/58/1121720658.db2.gz LJOQCWRXWCOQRZ-UHFFFAOYSA-N 1 3 296.480 3.603 20 0 CHADHO CCCC1CCC(C[NH2+]C[C@@H](C)CN2CCCC2)CC1 ZINC001177328932 1121723816 /nfs/dbraw/zinc/72/38/16/1121723816.db2.gz WAGCMNAOLWSVMC-WWDZGPRUSA-N 1 3 280.500 3.914 20 0 CHADHO Fc1cc(CN[C@H]2CCC[N@@H+]3CCCC[C@@H]23)ccc1Cl ZINC001179044728 1121841934 /nfs/dbraw/zinc/84/19/34/1121841934.db2.gz OWKXJWNFYQPKMS-HOTGVXAUSA-N 1 3 296.817 3.586 20 0 CHADHO Fc1cc(CN[C@H]2CCC[N@H+]3CCCC[C@@H]23)ccc1Cl ZINC001179044728 1121841945 /nfs/dbraw/zinc/84/19/45/1121841945.db2.gz OWKXJWNFYQPKMS-HOTGVXAUSA-N 1 3 296.817 3.586 20 0 CHADHO CC(C)(CCN[C@@H]1C[C@@H]([NH3+])c2ccccc21)C1CC1 ZINC000262128310 1129014107 /nfs/dbraw/zinc/01/41/07/1129014107.db2.gz CVIJAVPBHPCWIH-HZPDHXFCSA-N 1 3 258.409 3.547 20 0 CHADHO C[C@H]1C[C@H]([NH2+]C[C@@H]2CCCN(CC3CC3)C2)C[C@@H](C)C1 ZINC001179266725 1121866089 /nfs/dbraw/zinc/86/60/89/1121866089.db2.gz WRHQOZFDLLEYHY-CIRFHOKZSA-N 1 3 278.484 3.523 20 0 CHADHO [NH3+]CCCN[C@@H](c1cccc(Cl)c1)C1CCCC1 ZINC000420412114 1122005920 /nfs/dbraw/zinc/00/59/20/1122005920.db2.gz SDAQBYJURPJIMA-OAHLLOKOSA-N 1 3 266.816 3.510 20 0 CHADHO C[NH+]1CCC(NCc2cccc(-c3ccccc3)c2)CC1 ZINC000237169950 1122076564 /nfs/dbraw/zinc/07/65/64/1122076564.db2.gz SMHCXIWRMQVOPJ-UHFFFAOYSA-N 1 3 280.415 3.537 20 0 CHADHO CC[C@@H]1C[C@@]1([NH2+]CC[C@H]1CCCN1C)c1cccc(C)c1 ZINC000502479159 1122091758 /nfs/dbraw/zinc/09/17/58/1122091758.db2.gz DAPWMWPWFMNSPR-QRQLOZEOSA-N 1 3 286.463 3.694 20 0 CHADHO c1cc(C[NH2+]C2CCN(CC3CC3)CC2)cc(C2CC2)c1 ZINC000421332531 1122094926 /nfs/dbraw/zinc/09/49/26/1122094926.db2.gz MERKWHXMBXZJSQ-UHFFFAOYSA-N 1 3 284.447 3.528 20 0 CHADHO C[C@@H](CN(C)C)[C@H]1CCCC[N@@H+]1Cc1cc2ccccc2[nH]1 ZINC001183065553 1122204864 /nfs/dbraw/zinc/20/48/64/1122204864.db2.gz LXRYGCQTCXCVQC-HNAYVOBHSA-N 1 3 299.462 3.720 20 0 CHADHO C[C@@H](CN(C)C)[C@H]1CCCC[N@H+]1Cc1cc2ccccc2[nH]1 ZINC001183065553 1122204866 /nfs/dbraw/zinc/20/48/66/1122204866.db2.gz LXRYGCQTCXCVQC-HNAYVOBHSA-N 1 3 299.462 3.720 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@H](C)[C@H]1CC2CCC1CC2 ZINC001184419351 1122275612 /nfs/dbraw/zinc/27/56/12/1122275612.db2.gz ZUMOFLXZDQXTGS-HDOWINSPSA-N 1 3 280.500 3.911 20 0 CHADHO CCN(CC)CC[C@@H](C)[NH2+]C1CC(c2ccc(F)cc2)C1 ZINC001184418414 1122275859 /nfs/dbraw/zinc/27/58/59/1122275859.db2.gz OEODUPVESZQSBD-MXWWQKGMSA-N 1 3 292.442 3.782 20 0 CHADHO C[C@H](Cc1ccccc1F)[NH2+]CC[C@H](C)N1CCCCC1 ZINC000437994819 1122670909 /nfs/dbraw/zinc/67/09/09/1122670909.db2.gz QFNQDKZMTHKNRD-CVEARBPZSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@H](Cc1ccccc1F)NCC[C@H](C)[NH+]1CCCCC1 ZINC000437994819 1122670910 /nfs/dbraw/zinc/67/09/10/1122670910.db2.gz QFNQDKZMTHKNRD-CVEARBPZSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)c1ccc(-c2ccncc2)cc1)CN(C)C ZINC000425941786 1122671724 /nfs/dbraw/zinc/67/17/24/1122671724.db2.gz DYYXLUIVZUCHLA-HOTGVXAUSA-N 1 3 297.446 3.597 20 0 CHADHO CCN(CC)CCC[N@H+](CC)[C@@H]1CCCC[C@@H]1C ZINC001193412577 1122690609 /nfs/dbraw/zinc/69/06/09/1122690609.db2.gz FOUQSSRCAPHSRU-JKSUJKDBSA-N 1 3 254.462 3.619 20 0 CHADHO CCN(CC)CCC[N@@H+](CC)[C@@H]1CCCC[C@@H]1C ZINC001193412577 1122690610 /nfs/dbraw/zinc/69/06/10/1122690610.db2.gz FOUQSSRCAPHSRU-JKSUJKDBSA-N 1 3 254.462 3.619 20 0 CHADHO Cc1cc(F)cc(CN2CC[C@@H](C)[C@H](C[NH3+])CC2)c1Cl ZINC001205654553 1122753415 /nfs/dbraw/zinc/75/34/15/1122753415.db2.gz XFADOIHNWFZTNI-YPMHNXCESA-N 1 3 298.833 3.594 20 0 CHADHO C[C@H]1CCC[C@H](N2CCC([NH2+]C3CC(C)(C)C3)CC2)C1 ZINC000578524558 1122796346 /nfs/dbraw/zinc/79/63/46/1122796346.db2.gz JJMMPQXHEJQOSY-YOEHRIQHSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCCCC1)c1cc2ccccc2[nH]1 ZINC000775622761 1122827847 /nfs/dbraw/zinc/82/78/47/1122827847.db2.gz HNWOWIURRXNUAX-OAHLLOKOSA-N 1 3 285.435 3.695 20 0 CHADHO C[C@H]([NH2+]CCCN1CCC(C)CC1)c1cc2ccccc2[nH]1 ZINC000775623095 1122828177 /nfs/dbraw/zinc/82/81/77/1122828177.db2.gz MBTSISTXFBCRKF-INIZCTEOSA-N 1 3 299.462 3.941 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H](C)c2cc3ccccc3[nH]2)C1 ZINC000775626775 1122830176 /nfs/dbraw/zinc/83/01/76/1122830176.db2.gz JNDOUINVPDDDOB-HZPDHXFCSA-N 1 3 299.462 3.939 20 0 CHADHO C[C@@H]1C[N@H+](CC2CCC3(CC3)CC2)CCN1c1ccncc1 ZINC001197378403 1122955848 /nfs/dbraw/zinc/95/58/48/1122955848.db2.gz YJBJFNKEBDXBIK-MRXNPFEDSA-N 1 3 299.462 3.563 20 0 CHADHO C[C@@H]1C[N@@H+](CC2CCC3(CC3)CC2)CCN1c1ccncc1 ZINC001197378403 1122955852 /nfs/dbraw/zinc/95/58/52/1122955852.db2.gz YJBJFNKEBDXBIK-MRXNPFEDSA-N 1 3 299.462 3.563 20 0 CHADHO CCN(CC)CCC[N@@H+]1C[C@H](c2ccccc2)CC1(C)C ZINC001198287983 1122985566 /nfs/dbraw/zinc/98/55/66/1122985566.db2.gz CXTAVSONKWXDQK-GOSISDBHSA-N 1 3 288.479 3.986 20 0 CHADHO CCN(CC)CCC[N@H+]1C[C@H](c2ccccc2)CC1(C)C ZINC001198287983 1122985569 /nfs/dbraw/zinc/98/55/69/1122985569.db2.gz CXTAVSONKWXDQK-GOSISDBHSA-N 1 3 288.479 3.986 20 0 CHADHO c1cc(C[NH2+]C[C@@H]2CCN(C3CC3)C2)cc(C2CCCC2)c1 ZINC001199198795 1123023161 /nfs/dbraw/zinc/02/31/61/1123023161.db2.gz TWKKOROFPBIWEF-KRWDZBQOSA-N 1 3 298.474 3.918 20 0 CHADHO CCCCN1CCC([NH2+]Cc2ccc3c(c2)CCC3)CC1 ZINC001199784008 1123041739 /nfs/dbraw/zinc/04/17/39/1123041739.db2.gz NRZQSKZUGUPUTL-UHFFFAOYSA-N 1 3 286.463 3.529 20 0 CHADHO CC/C=C\CCCCC[N@@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001205901693 1123060596 /nfs/dbraw/zinc/06/05/96/1123060596.db2.gz FDVBPJFTJWYEEN-UDLYIEAKSA-N 1 3 252.446 3.572 20 0 CHADHO CC/C=C\CCCCC[N@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001205901693 1123060599 /nfs/dbraw/zinc/06/05/99/1123060599.db2.gz FDVBPJFTJWYEEN-UDLYIEAKSA-N 1 3 252.446 3.572 20 0 CHADHO CC[C@@H]1CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C1 ZINC001167994340 1123103767 /nfs/dbraw/zinc/10/37/67/1123103767.db2.gz BUWCDLUNMVOBMY-NAZJXLNTSA-N 1 3 276.468 3.514 20 0 CHADHO CC[C@@H]1CCC[N@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C1 ZINC001167994340 1123103768 /nfs/dbraw/zinc/10/37/68/1123103768.db2.gz BUWCDLUNMVOBMY-NAZJXLNTSA-N 1 3 276.468 3.514 20 0 CHADHO CCCN1C[C@@H]2C[NH+](C[C@@H](C)CCC=C(C)C)C[C@H]2C1 ZINC001201496862 1123110672 /nfs/dbraw/zinc/11/06/72/1123110672.db2.gz RTZCVKFNVUUWGM-RCCFBDPRSA-N 1 3 278.484 3.643 20 0 CHADHO CCN(Cc1ccccc1)C1CC[NH+](CC(C)C)CC1 ZINC001201476483 1123114809 /nfs/dbraw/zinc/11/48/09/1123114809.db2.gz DXEMWHJRGWCRCP-UHFFFAOYSA-N 1 3 274.452 3.629 20 0 CHADHO CCCC1CC[NH+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001167996158 1123116484 /nfs/dbraw/zinc/11/64/84/1123116484.db2.gz XWIICDUVGKPYTI-DFNIBXOVSA-N 1 3 290.495 3.904 20 0 CHADHO CCCCC[N@@H+]1CCCC[C@@H]1C[C@@H]1CCCN1C ZINC001201737468 1123143250 /nfs/dbraw/zinc/14/32/50/1123143250.db2.gz OTYSMZFYSRUQHN-JKSUJKDBSA-N 1 3 252.446 3.515 20 0 CHADHO CCCCC[N@H+]1CCCC[C@@H]1C[C@@H]1CCCN1C ZINC001201737468 1123143251 /nfs/dbraw/zinc/14/32/51/1123143251.db2.gz OTYSMZFYSRUQHN-JKSUJKDBSA-N 1 3 252.446 3.515 20 0 CHADHO CCCCC[N@@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001201734518 1123149663 /nfs/dbraw/zinc/14/96/63/1123149663.db2.gz DZDZWIHAKVYQRH-INIZCTEOSA-N 1 3 252.446 3.517 20 0 CHADHO CCCCC[N@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001201734518 1123149664 /nfs/dbraw/zinc/14/96/64/1123149664.db2.gz DZDZWIHAKVYQRH-INIZCTEOSA-N 1 3 252.446 3.517 20 0 CHADHO CCCC1(CN[C@@H]2C[C@H]([NH3+])c3ccccc32)CCC1 ZINC000391797044 1123215337 /nfs/dbraw/zinc/21/53/37/1123215337.db2.gz DGLCEVJMXBFKGS-JKSUJKDBSA-N 1 3 258.409 3.691 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]CC1(N)CCCC1 ZINC000665247275 1123260306 /nfs/dbraw/zinc/26/03/06/1123260306.db2.gz ZCCWCYXUVYLPOH-KRWDZBQOSA-N 1 3 297.446 3.715 20 0 CHADHO CC(C)C[C@H]([NH2+]CC1(N)CCCC1)c1cccs1 ZINC000665248362 1123262086 /nfs/dbraw/zinc/26/20/86/1123262086.db2.gz VQWAALFEIXQTOF-ZDUSSCGKSA-N 1 3 266.454 3.696 20 0 CHADHO [NH3+][C@H]1C[C@@H](NC2CCC(C(F)F)CC2)c2ccccc21 ZINC000335615196 1123385237 /nfs/dbraw/zinc/38/52/37/1123385237.db2.gz QPCSOXCBXUXPIC-RLNQVHQUSA-N 1 3 280.362 3.545 20 0 CHADHO c1ccc([C@@H]2CC[C@@H](C[N@@H+]3CC[C@]4(C3)CCCNC4)C2)cc1 ZINC000852748418 1123415260 /nfs/dbraw/zinc/41/52/60/1123415260.db2.gz VDBVCKLLYXYBRE-MISYRCLQSA-N 1 3 298.474 3.646 20 0 CHADHO c1ccc([C@@H]2CC[C@@H](C[N@H+]3CC[C@]4(C3)CCCNC4)C2)cc1 ZINC000852748418 1123415265 /nfs/dbraw/zinc/41/52/65/1123415265.db2.gz VDBVCKLLYXYBRE-MISYRCLQSA-N 1 3 298.474 3.646 20 0 CHADHO Cc1ccc2cc(C[NH2+]C3C[C@H]4CCC[C@@H](C3)N4C)[nH]c2c1 ZINC000143677628 1123438889 /nfs/dbraw/zinc/43/88/89/1123438889.db2.gz RFVQQSPGHPGTRD-ZNXRZULTSA-N 1 3 297.446 3.581 20 0 CHADHO Cc1ccc2cc(CNC3C[C@H]4CCC[C@@H](C3)[N@H+]4C)[nH]c2c1 ZINC000143677628 1123438890 /nfs/dbraw/zinc/43/88/90/1123438890.db2.gz RFVQQSPGHPGTRD-ZNXRZULTSA-N 1 3 297.446 3.581 20 0 CHADHO Cc1ccc2cc(CNC3C[C@H]4CCC[C@@H](C3)[N@@H+]4C)[nH]c2c1 ZINC000143677628 1123438892 /nfs/dbraw/zinc/43/88/92/1123438892.db2.gz RFVQQSPGHPGTRD-ZNXRZULTSA-N 1 3 297.446 3.581 20 0 CHADHO CC[C@H](C[NH2+]C[C@@H]1CCCN(CC)C1)c1ccccc1 ZINC001648959938 1123439469 /nfs/dbraw/zinc/43/94/69/1123439469.db2.gz GEEIIJLOEOLHQE-DLBZAZTESA-N 1 3 274.452 3.502 20 0 CHADHO CC(C)[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1ccccc1F ZINC000895346930 1123463216 /nfs/dbraw/zinc/46/32/16/1123463216.db2.gz OQWYQXVDAAGYQS-MUSFGAPCSA-N 1 3 290.426 3.738 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H](C)CCC(C)(C)C)C1 ZINC000582196465 1123469365 /nfs/dbraw/zinc/46/93/65/1123469365.db2.gz AGADJROJZMAWJA-LSDHHAIUSA-N 1 3 254.462 3.523 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H]2CCC[C@@H](C(C)C)C2)C1 ZINC000474628598 1123561585 /nfs/dbraw/zinc/56/15/85/1123561585.db2.gz LNTTWJVJZXVJFU-ZACQAIPSSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)[C@@H]([NH3+])CCN(C)Cc1cccc(-c2ccncc2)c1 ZINC000346686665 1123708916 /nfs/dbraw/zinc/70/89/16/1123708916.db2.gz SASRBXAZFRGZDX-IBGZPJMESA-N 1 3 297.446 3.554 20 0 CHADHO CC1(C)CCCC[C@H]1C[N@@H+]1CC[C@H](CN2CCCC2)C1 ZINC001307483650 1123726479 /nfs/dbraw/zinc/72/64/79/1123726479.db2.gz SGUTXZKRALZLPQ-SJORKVTESA-N 1 3 278.484 3.621 20 0 CHADHO CC1(C)CCCC[C@H]1C[N@H+]1CC[C@H](CN2CCCC2)C1 ZINC001307483650 1123726483 /nfs/dbraw/zinc/72/64/83/1123726483.db2.gz SGUTXZKRALZLPQ-SJORKVTESA-N 1 3 278.484 3.621 20 0 CHADHO CCc1ccc([C@H](C)NC2CC[NH+](C(C)C)CC2)s1 ZINC000042290399 1123783399 /nfs/dbraw/zinc/78/33/99/1123783399.db2.gz KHWWLYYQSXTRRC-ZDUSSCGKSA-N 1 3 280.481 3.834 20 0 CHADHO CN1CCC2(CCC[N@@H+]2CC2CCCCCC2)CC1 ZINC000475123591 1123797405 /nfs/dbraw/zinc/79/74/05/1123797405.db2.gz YCXPJRLCEZQTTI-UHFFFAOYSA-N 1 3 264.457 3.517 20 0 CHADHO CN1CCC2(CCC[N@H+]2CC2CCCCCC2)CC1 ZINC000475123591 1123797408 /nfs/dbraw/zinc/79/74/08/1123797408.db2.gz YCXPJRLCEZQTTI-UHFFFAOYSA-N 1 3 264.457 3.517 20 0 CHADHO CCN(CC)CCC[NH2+]CC[C@H](C)c1ccccc1 ZINC000043532775 1123819783 /nfs/dbraw/zinc/81/97/83/1123819783.db2.gz STDDFEWSAOYYJY-INIZCTEOSA-N 1 3 262.441 3.502 20 0 CHADHO CN(C)[C@@H]1CCC[N@H+](Cc2cccc3ccccc32)CC1 ZINC000429549916 1123822799 /nfs/dbraw/zinc/82/27/99/1123822799.db2.gz QDZKIUNUSASGIK-GOSISDBHSA-N 1 3 282.431 3.756 20 0 CHADHO CN(C)[C@@H]1CCC[N@@H+](Cc2cccc3ccccc32)CC1 ZINC000429549916 1123822801 /nfs/dbraw/zinc/82/28/01/1123822801.db2.gz QDZKIUNUSASGIK-GOSISDBHSA-N 1 3 282.431 3.756 20 0 CHADHO C[NH+](C)[C@@H]1CCCN(Cc2cccc3ccccc32)CC1 ZINC000429549916 1123822807 /nfs/dbraw/zinc/82/28/07/1123822807.db2.gz QDZKIUNUSASGIK-GOSISDBHSA-N 1 3 282.431 3.756 20 0 CHADHO CCCCCCN1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000119041852 1123826246 /nfs/dbraw/zinc/82/62/46/1123826246.db2.gz HHHOJFIWEIGBFJ-MRXNPFEDSA-N 1 3 252.446 3.517 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)c1cccc(F)c1 ZINC000446939155 1124128678 /nfs/dbraw/zinc/12/86/78/1124128678.db2.gz ZPWKLGLBUJZAPI-IKGGRYGDSA-N 1 3 278.415 3.739 20 0 CHADHO CC(C)[C@@H]1C[C@H](NC[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc21 ZINC000447536965 1124485004 /nfs/dbraw/zinc/48/50/04/1124485004.db2.gz ROSSZUNULRCPHG-XPGWFJOJSA-N 1 3 298.474 3.945 20 0 CHADHO CC(C)[C@@H]1C[C@H](NC[C@H]2CC[N@H+](C3CC3)C2)c2ccccc21 ZINC000447536965 1124485010 /nfs/dbraw/zinc/48/50/10/1124485010.db2.gz ROSSZUNULRCPHG-XPGWFJOJSA-N 1 3 298.474 3.945 20 0 CHADHO C[C@H]1C[C@H](C)N1CC(C)(C)C[N@H+](C)Cc1ccccc1 ZINC000526989445 1124539475 /nfs/dbraw/zinc/53/94/75/1124539475.db2.gz CIKSWLLRZOEPBY-HOTGVXAUSA-N 1 3 274.452 3.627 20 0 CHADHO C[C@H]1C[C@H](C)N1CC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC000526989445 1124539480 /nfs/dbraw/zinc/53/94/80/1124539480.db2.gz CIKSWLLRZOEPBY-HOTGVXAUSA-N 1 3 274.452 3.627 20 0 CHADHO C[C@H](Cc1coc2ccccc12)N[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000449091056 1124648620 /nfs/dbraw/zinc/64/86/20/1124648620.db2.gz OZTVGBVUVSAXRB-PVAVHDDUSA-N 1 3 298.430 3.580 20 0 CHADHO C[C@H](Cc1coc2ccccc12)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000449091056 1124648623 /nfs/dbraw/zinc/64/86/23/1124648623.db2.gz OZTVGBVUVSAXRB-PVAVHDDUSA-N 1 3 298.430 3.580 20 0 CHADHO CC(C)[NH+](CCCN[C@@H]1CCO[C@H](C(C)(C)C)C1)C(C)C ZINC000872039470 1124663458 /nfs/dbraw/zinc/66/34/58/1124663458.db2.gz FQQPPWIXZLGXGP-SJORKVTESA-N 1 3 298.515 3.679 20 0 CHADHO CCC1CCC(C2CCC([NH2+]CC3CNC3)CC2)CC1 ZINC001246092866 1131303169 /nfs/dbraw/zinc/30/31/69/1131303169.db2.gz QFOXSSFCUYVWFA-UHFFFAOYSA-N 1 3 278.484 3.571 20 0 CHADHO CSC(C)(C)CC[NH2+][C@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000877188799 1125018238 /nfs/dbraw/zinc/01/82/38/1125018238.db2.gz HIWLLFQYFDOOBP-CABCVRRESA-N 1 3 298.540 3.761 20 0 CHADHO CCCc1ccc2nccc(N3CC[C@H](C[NH+](C)C)C3)c2c1 ZINC000450432527 1125023161 /nfs/dbraw/zinc/02/31/61/1125023161.db2.gz HGBAYEUGQMBWPP-MRXNPFEDSA-N 1 3 297.446 3.575 20 0 CHADHO C(=C\c1ccccc1)\CCN1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000450437941 1125025679 /nfs/dbraw/zinc/02/56/79/1125025679.db2.gz LQNHEUVIEPBHOJ-ITJCZCKWSA-N 1 3 298.474 3.898 20 0 CHADHO C1=C(CC[N@@H+]2CC[C@@H](CN3CCCCC3)C2)CCCC1 ZINC000450440039 1125026788 /nfs/dbraw/zinc/02/67/88/1125026788.db2.gz OPEMZWATEGTHSG-SFHVURJKSA-N 1 3 276.468 3.685 20 0 CHADHO C1=C(CC[N@H+]2CC[C@@H](CN3CCCCC3)C2)CCCC1 ZINC000450440039 1125026795 /nfs/dbraw/zinc/02/67/95/1125026795.db2.gz OPEMZWATEGTHSG-SFHVURJKSA-N 1 3 276.468 3.685 20 0 CHADHO C1=C(CCN2CC[C@@H](C[NH+]3CCCCC3)C2)CCCC1 ZINC000450440039 1125026800 /nfs/dbraw/zinc/02/68/00/1125026800.db2.gz OPEMZWATEGTHSG-SFHVURJKSA-N 1 3 276.468 3.685 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN(CC/C=C\c2ccccc2)C1 ZINC000450463265 1125028531 /nfs/dbraw/zinc/02/85/31/1125028531.db2.gz NMFGZFIUFNKKET-KOTDBNOLSA-N 1 3 286.463 3.754 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN(CC/C=C\c2ccccc2)C1 ZINC000450463265 1125028536 /nfs/dbraw/zinc/02/85/36/1125028536.db2.gz NMFGZFIUFNKKET-KOTDBNOLSA-N 1 3 286.463 3.754 20 0 CHADHO CCC[C@H](C)CC[C@@H](C)NC[C@]1(C(F)(F)F)CC[NH2+]C1 ZINC001246111197 1131329609 /nfs/dbraw/zinc/32/96/09/1131329609.db2.gz KQZCKGNZIAUBPO-MJBXVCDLSA-N 1 3 294.405 3.723 20 0 CHADHO C[C@H](NCC1=CCCCC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000450728901 1125094886 /nfs/dbraw/zinc/09/48/86/1125094886.db2.gz QKDNWOSFOFTASX-DOTOQJQBSA-N 1 3 276.468 3.729 20 0 CHADHO C[C@H](NCC1=CCCCC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000450728901 1125094895 /nfs/dbraw/zinc/09/48/95/1125094895.db2.gz QKDNWOSFOFTASX-DOTOQJQBSA-N 1 3 276.468 3.729 20 0 CHADHO C[C@H]([NH2+]CC1=CCCCC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000450728901 1125094904 /nfs/dbraw/zinc/09/49/04/1125094904.db2.gz QKDNWOSFOFTASX-DOTOQJQBSA-N 1 3 276.468 3.729 20 0 CHADHO CCCCCC[C@H](CC)NC[C@@]1(C(F)(F)F)CC[NH2+]C1 ZINC001246115966 1131340333 /nfs/dbraw/zinc/34/03/33/1131340333.db2.gz UCDCFHARFLVPNW-UONOGXRCSA-N 1 3 294.405 3.867 20 0 CHADHO C[NH+](C)[C@@H]1CCC[C@@H](N[C@@H](CC2CC2)c2ccccc2)C1 ZINC000532248074 1125243152 /nfs/dbraw/zinc/24/31/52/1125243152.db2.gz DDUROECHIDYVCX-QRVBRYPASA-N 1 3 286.463 3.990 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@@H](CC2CC2)c2ccccc2)C1 ZINC000532248074 1125243157 /nfs/dbraw/zinc/24/31/57/1125243157.db2.gz DDUROECHIDYVCX-QRVBRYPASA-N 1 3 286.463 3.990 20 0 CHADHO CC[C@@H]1CN([C@@H](C)c2ccc(C(C)C)cc2)CC[C@@H]1[NH3+] ZINC000122369634 1125350825 /nfs/dbraw/zinc/35/08/25/1125350825.db2.gz WQNYHCPRIPLOBK-DAYGRLMNSA-N 1 3 274.452 3.930 20 0 CHADHO Cc1cccc(CC[C@H](C)[NH2+]C[C@@H]2CCN(C(C)C)C2)c1 ZINC000040623592 1125389172 /nfs/dbraw/zinc/38/91/72/1125389172.db2.gz UJQWKOAPZJAMAY-HKUYNNGSSA-N 1 3 288.479 3.636 20 0 CHADHO C[N@@H+]1CCC[C@H]2CN(Cc3ccc4ccccc4c3)CC[C@@H]21 ZINC000532536500 1125409240 /nfs/dbraw/zinc/40/92/40/1125409240.db2.gz OAGMSUNIGKRZAT-PMACEKPBSA-N 1 3 294.442 3.756 20 0 CHADHO C[N@H+]1CCC[C@H]2CN(Cc3ccc4ccccc4c3)CC[C@@H]21 ZINC000532536500 1125409241 /nfs/dbraw/zinc/40/92/41/1125409241.db2.gz OAGMSUNIGKRZAT-PMACEKPBSA-N 1 3 294.442 3.756 20 0 CHADHO CN1CCC[C@H]2C[N@H+](Cc3ccc4ccccc4c3)CC[C@@H]21 ZINC000532536500 1125409243 /nfs/dbraw/zinc/40/92/43/1125409243.db2.gz OAGMSUNIGKRZAT-PMACEKPBSA-N 1 3 294.442 3.756 20 0 CHADHO CN1CCC[C@H]2C[N@@H+](Cc3ccc4ccccc4c3)CC[C@@H]21 ZINC000532536500 1125409245 /nfs/dbraw/zinc/40/92/45/1125409245.db2.gz OAGMSUNIGKRZAT-PMACEKPBSA-N 1 3 294.442 3.756 20 0 CHADHO CC(C)[C@H](NC[C@@H]1CCC[NH2+]C1)c1ccc(Cl)cc1 ZINC000132077402 1125414113 /nfs/dbraw/zinc/41/41/13/1125414113.db2.gz SBPONZIDDBFZRP-CJNGLKHVSA-N 1 3 280.843 3.626 20 0 CHADHO Cc1ccc(CN2CCC([C@H]3CCC[NH2+]3)CC2)c(Cl)c1 ZINC000235998897 1125440757 /nfs/dbraw/zinc/44/07/57/1125440757.db2.gz AEBHWHTZKUQADI-QGZVFWFLSA-N 1 3 292.854 3.612 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H]2CCCc3sccc32)C1 ZINC000125907974 1125452691 /nfs/dbraw/zinc/45/26/91/1125452691.db2.gz XAQJGFMVIOQQDU-GDBMZVCRSA-N 1 3 292.492 3.836 20 0 CHADHO C[C@H](NCc1cccc(-c2ccccc2)c1)[C@H]1CCC[NH2+]C1 ZINC000414855684 1129196072 /nfs/dbraw/zinc/19/60/72/1129196072.db2.gz NGVIPEZCUNMNCO-JXFKEZNVSA-N 1 3 294.442 3.831 20 0 CHADHO CN(C)[C@H]1CCC[N@H+](C[C@@]2(C)C[C@@H]2c2ccccc2)CC1 ZINC000639105126 1129281672 /nfs/dbraw/zinc/28/16/72/1129281672.db2.gz RVTPNWVAASDKRA-IPMKNSEASA-N 1 3 286.463 3.596 20 0 CHADHO CN(C)[C@H]1CCC[N@@H+](C[C@@]2(C)C[C@@H]2c2ccccc2)CC1 ZINC000639105126 1129281675 /nfs/dbraw/zinc/28/16/75/1129281675.db2.gz RVTPNWVAASDKRA-IPMKNSEASA-N 1 3 286.463 3.596 20 0 CHADHO CCCCC[C@H](CC)[NH+]1CCC(N(C)C2CC2)CC1 ZINC001258443668 1129362590 /nfs/dbraw/zinc/36/25/90/1129362590.db2.gz NWLUYZLGSPIHQC-HNNXBMFYSA-N 1 3 266.473 3.904 20 0 CHADHO CC[N@@H+](Cc1ccoc1)C[C@H]1CCN(Cc2ccccc2)C1 ZINC000093818825 1129428076 /nfs/dbraw/zinc/42/80/76/1129428076.db2.gz XDJLMFIUSAHLPJ-GOSISDBHSA-N 1 3 298.430 3.624 20 0 CHADHO CC[N@H+](Cc1ccoc1)C[C@H]1CCN(Cc2ccccc2)C1 ZINC000093818825 1129428079 /nfs/dbraw/zinc/42/80/79/1129428079.db2.gz XDJLMFIUSAHLPJ-GOSISDBHSA-N 1 3 298.430 3.624 20 0 CHADHO C[C@H](N)C[NH2+][C@@H](C)c1ccc(-c2c(F)cccc2F)cc1 ZINC000643527636 1129444339 /nfs/dbraw/zinc/44/43/39/1129444339.db2.gz PWDLDQSWPWKBDT-RYUDHWBXSA-N 1 3 290.357 3.630 20 0 CHADHO C[C@H](N[C@H]1CCC[NH2+]CC1)c1cccc(-c2ccncc2)c1 ZINC000643522916 1129444860 /nfs/dbraw/zinc/44/48/60/1129444860.db2.gz USJOTOGRSXIGNI-KXBFYZLASA-N 1 3 295.430 3.541 20 0 CHADHO CC1(C)CC[C@@H]([NH+]2C(C)(C)CC(N)CC2(C)C)C1 ZINC001258595442 1129450910 /nfs/dbraw/zinc/45/09/10/1129450910.db2.gz WGBRBJKGNUWTPR-CYBMUJFWSA-N 1 3 252.446 3.545 20 0 CHADHO Cc1cccc(C2(NC3CC[NH+](C(C)C)CC3)CCC2)c1 ZINC000647331519 1129569676 /nfs/dbraw/zinc/56/96/76/1129569676.db2.gz COUFUDSPPZBOKH-UHFFFAOYSA-N 1 3 286.463 3.837 20 0 CHADHO C[C@H](NC[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)c1ccccc1 ZINC000647343627 1129571987 /nfs/dbraw/zinc/57/19/87/1129571987.db2.gz YCAAOFWMTYAZLA-DBVUQKKJSA-N 1 3 294.442 3.683 20 0 CHADHO C[C@H](NC[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1ccccc1 ZINC000647343627 1129571989 /nfs/dbraw/zinc/57/19/89/1129571989.db2.gz YCAAOFWMTYAZLA-DBVUQKKJSA-N 1 3 294.442 3.683 20 0 CHADHO C[C@H](NCCCC1CC[NH2+]CC1)c1c(F)cccc1Cl ZINC000647992145 1129590808 /nfs/dbraw/zinc/59/08/08/1129590808.db2.gz JVTPVJDGUPNZHT-LBPRGKRZSA-N 1 3 298.833 3.910 20 0 CHADHO CN1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1(c3ccc(Cl)cc3)CC1)C2 ZINC001169082385 1129698615 /nfs/dbraw/zinc/69/86/15/1129698615.db2.gz ZBTFUENNEDDIII-MUJYYYPQSA-N 1 3 290.838 3.544 20 0 CHADHO CC(C)C[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC001169090661 1129699974 /nfs/dbraw/zinc/69/99/74/1129699974.db2.gz KEBYDGAQFKFIGX-RDGPPVDQSA-N 1 3 286.463 3.989 20 0 CHADHO CC(C)C[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC001169090661 1129699975 /nfs/dbraw/zinc/69/99/75/1129699975.db2.gz KEBYDGAQFKFIGX-RDGPPVDQSA-N 1 3 286.463 3.989 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@H](N[C@H]1CCCCc3ccccc31)C2 ZINC001169122762 1129700210 /nfs/dbraw/zinc/70/02/10/1129700210.db2.gz CZSXDYNMWXVQAT-BMFAXAFESA-N 1 3 284.447 3.669 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](N[C@H]1CCCCc3ccccc31)C2 ZINC001169122762 1129700213 /nfs/dbraw/zinc/70/02/13/1129700213.db2.gz CZSXDYNMWXVQAT-BMFAXAFESA-N 1 3 284.447 3.669 20 0 CHADHO CC[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(C)cc1C ZINC001169116628 1129700529 /nfs/dbraw/zinc/70/05/29/1129700529.db2.gz RKKSCCFZEYIVLR-VXIBKDFQSA-N 1 3 286.463 3.969 20 0 CHADHO CC[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(C)cc1C ZINC001169116628 1129700530 /nfs/dbraw/zinc/70/05/30/1129700530.db2.gz RKKSCCFZEYIVLR-VXIBKDFQSA-N 1 3 286.463 3.969 20 0 CHADHO Cc1ccc2c(c1)[C@@H](N[C@H]1C[C@H]3CC[C@@H](C1)[N@H+]3C)CCC2 ZINC001169124371 1129701749 /nfs/dbraw/zinc/70/17/49/1129701749.db2.gz QNLAMVSBSRTBSE-ZMMAXQRCSA-N 1 3 284.447 3.587 20 0 CHADHO Cc1ccc2c(c1)[C@@H](N[C@H]1C[C@H]3CC[C@@H](C1)[N@@H+]3C)CCC2 ZINC001169124371 1129701752 /nfs/dbraw/zinc/70/17/52/1129701752.db2.gz QNLAMVSBSRTBSE-ZMMAXQRCSA-N 1 3 284.447 3.587 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](N1CCC[C@H]1c1ccc(F)cc1)C2 ZINC001169127002 1129701863 /nfs/dbraw/zinc/70/18/63/1129701863.db2.gz ZHSIOQAQXRBFQM-MLHJIOFPSA-N 1 3 288.410 3.588 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](N1CCC[C@H]1c1ccc(F)cc1)C2 ZINC001169127002 1129701865 /nfs/dbraw/zinc/70/18/65/1129701865.db2.gz ZHSIOQAQXRBFQM-MLHJIOFPSA-N 1 3 288.410 3.588 20 0 CHADHO C[C@@H]1CCC[C@H](N2CCC([NH2+]C3CC4(CCC4)C3)CC2)C1 ZINC000652051708 1129756061 /nfs/dbraw/zinc/75/60/61/1129756061.db2.gz NSYPWXLJWLJFDA-QAPCUYQASA-N 1 3 290.495 3.952 20 0 CHADHO CC(C)(CCN1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1)C1CC1 ZINC000653586881 1129786728 /nfs/dbraw/zinc/78/67/28/1129786728.db2.gz GJUZOXTZXFLALH-QAPCUYQASA-N 1 3 290.495 3.761 20 0 CHADHO CC(C)(CCN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)C1CC1 ZINC000653586881 1129786730 /nfs/dbraw/zinc/78/67/30/1129786730.db2.gz GJUZOXTZXFLALH-QAPCUYQASA-N 1 3 290.495 3.761 20 0 CHADHO CCC[C@@H](N[C@@H](CC[NH+](C)C)c1cccnc1)C1CCC1 ZINC000903376232 1130168283 /nfs/dbraw/zinc/16/82/83/1130168283.db2.gz BUTILFIIIAPDOY-MSOLQXFVSA-N 1 3 289.467 3.633 20 0 CHADHO CC[NH+](CC)CCCN[C@@H](C)Cc1ccccc1Cl ZINC001170247780 1130472645 /nfs/dbraw/zinc/47/26/45/1130472645.db2.gz YQEMQYHMDWPCSE-AWEZNQCLSA-N 1 3 282.859 3.593 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H](C)Cc1ccccc1Cl ZINC001170247780 1130472647 /nfs/dbraw/zinc/47/26/47/1130472647.db2.gz YQEMQYHMDWPCSE-AWEZNQCLSA-N 1 3 282.859 3.593 20 0 CHADHO CC/C=C\CCCCCCN1CCC[C@]2(CC[NH2+]C2)C1 ZINC001234995108 1130701303 /nfs/dbraw/zinc/70/13/03/1130701303.db2.gz XNQOZFBDJORYGM-DDKKJVIOSA-N 1 3 278.484 3.979 20 0 CHADHO c1ccc2cc(C[N@@H+]3CCCC34CCNCC4)ccc2c1 ZINC001235141349 1130715101 /nfs/dbraw/zinc/71/51/01/1130715101.db2.gz RQVRENNYONJBQJ-UHFFFAOYSA-N 1 3 280.415 3.558 20 0 CHADHO c1ccc2cc(C[N@H+]3CCCC34CCNCC4)ccc2c1 ZINC001235141349 1130715106 /nfs/dbraw/zinc/71/51/06/1130715106.db2.gz RQVRENNYONJBQJ-UHFFFAOYSA-N 1 3 280.415 3.558 20 0 CHADHO CCCCCCN1CC[C@@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001235350237 1130735806 /nfs/dbraw/zinc/73/58/06/1130735806.db2.gz XXSANXIAKTVOAP-RTBURBONSA-N 1 3 286.463 3.646 20 0 CHADHO Cc1cccc(C)c1-c1cccc(CN(C)CCC[NH3+])c1 ZINC001235435605 1130743304 /nfs/dbraw/zinc/74/33/04/1130743304.db2.gz SINUSHNJGTVCIC-UHFFFAOYSA-N 1 3 282.431 3.751 20 0 CHADHO [NH3+]C[C@@H]1CCCN(Cc2cccc(-c3ccc(F)cc3)c2)C1 ZINC001235673142 1130764904 /nfs/dbraw/zinc/76/49/04/1130764904.db2.gz LUBZAOPLCOAGJK-INIZCTEOSA-N 1 3 298.405 3.663 20 0 CHADHO [NH3+]C[C@@H]1CCCN(Cc2ccc3oc4ccccc4c3c2)C1 ZINC001235672402 1130765032 /nfs/dbraw/zinc/76/50/32/1130765032.db2.gz CLMVCFGKADIBDV-HNNXBMFYSA-N 1 3 294.398 3.757 20 0 CHADHO [NH3+]C[C@H]1CCCN(Cc2ccc(-c3cccs3)cc2)C1 ZINC001235673751 1130765846 /nfs/dbraw/zinc/76/58/46/1130765846.db2.gz CZJSRJWLMYDBQF-OAHLLOKOSA-N 1 3 286.444 3.586 20 0 CHADHO Cc1cccc(Cl)c1CN1CCC([C@H]2CCC[NH2+]2)CC1 ZINC001235883215 1130792944 /nfs/dbraw/zinc/79/29/44/1130792944.db2.gz AQXOEDWAJLIXLU-QGZVFWFLSA-N 1 3 292.854 3.612 20 0 CHADHO COc1c(C)cc([C@H](C)[NH2+]C[C@@H](C)CN(C)C)cc1Cl ZINC000813876942 1130793012 /nfs/dbraw/zinc/79/30/12/1130793012.db2.gz DXOLMEJUTIIABP-YPMHNXCESA-N 1 3 298.858 3.505 20 0 CHADHO CCCCCOc1ccc(CN2CCC[C@H]2CC[NH3+])cc1 ZINC001235925283 1130806388 /nfs/dbraw/zinc/80/63/88/1130806388.db2.gz PKKFTVMGRVSAJI-KRWDZBQOSA-N 1 3 290.451 3.569 20 0 CHADHO Cc1cccc(-c2ccc(C[N@@H+](CCN)C(C)C)cc2)c1 ZINC001235947296 1130813194 /nfs/dbraw/zinc/81/31/94/1130813194.db2.gz IYKPZFHREDRVIX-UHFFFAOYSA-N 1 3 282.431 3.831 20 0 CHADHO Cc1cccc(-c2ccc(C[N@H+](CCN)C(C)C)cc2)c1 ZINC001235947296 1130813203 /nfs/dbraw/zinc/81/32/03/1130813203.db2.gz IYKPZFHREDRVIX-UHFFFAOYSA-N 1 3 282.431 3.831 20 0 CHADHO [NH3+][C@@H]1[C@@H]2CC[C@H]1CN(Cc1cccc(-c3ccccc3)c1)C2 ZINC001235959195 1130816653 /nfs/dbraw/zinc/81/66/53/1130816653.db2.gz HMTYPBKUEXFGKK-ACDBMABISA-N 1 3 292.426 3.523 20 0 CHADHO C[C@@H](CN)C[N@H+](Cc1ccccc1)[C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170731503 1130836936 /nfs/dbraw/zinc/83/69/36/1130836936.db2.gz RAXJLVXHJIHRDK-OWLYRPNTSA-N 1 3 286.463 3.518 20 0 CHADHO C[C@@H](CN)C[N@@H+](Cc1ccccc1)[C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170731503 1130836943 /nfs/dbraw/zinc/83/69/43/1130836943.db2.gz RAXJLVXHJIHRDK-OWLYRPNTSA-N 1 3 286.463 3.518 20 0 CHADHO C[NH2+]C[C@H]1CCN(Cc2ccccc2-c2ccccc2C)C1 ZINC001236065714 1130846128 /nfs/dbraw/zinc/84/61/28/1130846128.db2.gz CRKREEGLQRMHNC-QGZVFWFLSA-N 1 3 294.442 3.703 20 0 CHADHO Cc1c(C[N@@H+]2CCCN[C@@H](C)C2)cccc1-c1ccccc1 ZINC001236101651 1130861846 /nfs/dbraw/zinc/86/18/46/1130861846.db2.gz YLNSRRHXHGWMLG-INIZCTEOSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1c(C[N@H+]2CCCN[C@@H](C)C2)cccc1-c1ccccc1 ZINC001236101651 1130861851 /nfs/dbraw/zinc/86/18/51/1130861851.db2.gz YLNSRRHXHGWMLG-INIZCTEOSA-N 1 3 294.442 3.846 20 0 CHADHO CCC[N@H+](Cc1c(C)cccc1CC)C1CCNCC1 ZINC001236183985 1130880895 /nfs/dbraw/zinc/88/08/95/1130880895.db2.gz DMTGDDPHBMQQHQ-UHFFFAOYSA-N 1 3 274.452 3.521 20 0 CHADHO CCC[N@@H+](Cc1c(C)cccc1CC)C1CCNCC1 ZINC001236183985 1130880899 /nfs/dbraw/zinc/88/08/99/1130880899.db2.gz DMTGDDPHBMQQHQ-UHFFFAOYSA-N 1 3 274.452 3.521 20 0 CHADHO CCCCc1ccc(C[N@H+](CCC)C2CCNCC2)cc1 ZINC001236182542 1130881717 /nfs/dbraw/zinc/88/17/17/1130881717.db2.gz QOPIVMOEBLJDFA-UHFFFAOYSA-N 1 3 288.479 3.993 20 0 CHADHO CCCCc1ccc(C[N@@H+](CCC)C2CCNCC2)cc1 ZINC001236182542 1130881724 /nfs/dbraw/zinc/88/17/24/1130881724.db2.gz QOPIVMOEBLJDFA-UHFFFAOYSA-N 1 3 288.479 3.993 20 0 CHADHO CCCCc1ccc(CN(CCC)C2CC[NH2+]CC2)cc1 ZINC001236182542 1130881728 /nfs/dbraw/zinc/88/17/28/1130881728.db2.gz QOPIVMOEBLJDFA-UHFFFAOYSA-N 1 3 288.479 3.993 20 0 CHADHO CCC[N@H+](Cc1cccc2c1CCCC2)C1CCNCC1 ZINC001236184115 1130881968 /nfs/dbraw/zinc/88/19/68/1130881968.db2.gz FHXUIZRSAUGXJD-UHFFFAOYSA-N 1 3 286.463 3.529 20 0 CHADHO CCC[N@@H+](Cc1cccc2c1CCCC2)C1CCNCC1 ZINC001236184115 1130881974 /nfs/dbraw/zinc/88/19/74/1130881974.db2.gz FHXUIZRSAUGXJD-UHFFFAOYSA-N 1 3 286.463 3.529 20 0 CHADHO CCC[N@H+](Cc1cccc(C(C)(C)C)c1)C1CCNCC1 ZINC001236182259 1130882289 /nfs/dbraw/zinc/88/22/89/1130882289.db2.gz IPAXLDOFDAHLQX-UHFFFAOYSA-N 1 3 288.479 3.948 20 0 CHADHO CCC[N@@H+](Cc1cccc(C(C)(C)C)c1)C1CCNCC1 ZINC001236182259 1130882299 /nfs/dbraw/zinc/88/22/99/1130882299.db2.gz IPAXLDOFDAHLQX-UHFFFAOYSA-N 1 3 288.479 3.948 20 0 CHADHO CCCN(Cc1cccc(C(C)(C)C)c1)C1CC[NH2+]CC1 ZINC001236182259 1130882308 /nfs/dbraw/zinc/88/23/08/1130882308.db2.gz IPAXLDOFDAHLQX-UHFFFAOYSA-N 1 3 288.479 3.948 20 0 CHADHO CC(C)=CCC[C@H](C)CN(C)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236210537 1130888501 /nfs/dbraw/zinc/88/85/01/1130888501.db2.gz DFZMOYAUJVVPTF-JYJNAYRXSA-N 1 3 252.446 3.571 20 0 CHADHO C[N@H+](Cc1ccc(C2CCC2)cc1)[C@@H]1CCCC[C@H]1N ZINC001236217002 1130892017 /nfs/dbraw/zinc/89/20/17/1130892017.db2.gz MKBMSPILPZBVRQ-QZTJIDSGSA-N 1 3 272.436 3.656 20 0 CHADHO C[N@@H+](Cc1ccc(C2CCC2)cc1)[C@@H]1CCCC[C@H]1N ZINC001236217002 1130892022 /nfs/dbraw/zinc/89/20/22/1130892022.db2.gz MKBMSPILPZBVRQ-QZTJIDSGSA-N 1 3 272.436 3.656 20 0 CHADHO C[N@H+](Cc1ccc(C2CCC2)cc1)[C@H]1CCCC[C@H]1N ZINC001236217001 1130893086 /nfs/dbraw/zinc/89/30/86/1130893086.db2.gz MKBMSPILPZBVRQ-MSOLQXFVSA-N 1 3 272.436 3.656 20 0 CHADHO C[N@@H+](Cc1ccc(C2CCC2)cc1)[C@H]1CCCC[C@H]1N ZINC001236217001 1130893091 /nfs/dbraw/zinc/89/30/91/1130893091.db2.gz MKBMSPILPZBVRQ-MSOLQXFVSA-N 1 3 272.436 3.656 20 0 CHADHO C(C[N@H+](C[C@H]1CCCNC1)C1CCCC1)C1CCCC1 ZINC001236373219 1130923770 /nfs/dbraw/zinc/92/37/70/1130923770.db2.gz UZCDXFUAWUBVFA-KRWDZBQOSA-N 1 3 278.484 3.811 20 0 CHADHO C(C[N@@H+](C[C@H]1CCCNC1)C1CCCC1)C1CCCC1 ZINC001236373219 1130923776 /nfs/dbraw/zinc/92/37/76/1130923776.db2.gz UZCDXFUAWUBVFA-KRWDZBQOSA-N 1 3 278.484 3.811 20 0 CHADHO CC(C)(C)CCN(Cc1cccc(F)c1)C1CC[NH2+]CC1 ZINC001236401601 1130928986 /nfs/dbraw/zinc/92/89/86/1130928986.db2.gz POTQLUWPWPVGHN-UHFFFAOYSA-N 1 3 292.442 3.816 20 0 CHADHO C[C@H]1[C@@H](N)CCC[N@@H+]1Cc1ccccc1-c1ccccc1 ZINC001236422471 1130937590 /nfs/dbraw/zinc/93/75/90/1130937590.db2.gz WOIPWIVIHYAPOF-KXBFYZLASA-N 1 3 280.415 3.665 20 0 CHADHO C[C@H]1[C@@H](N)CCC[N@H+]1Cc1ccccc1-c1ccccc1 ZINC001236422471 1130937592 /nfs/dbraw/zinc/93/75/92/1130937592.db2.gz WOIPWIVIHYAPOF-KXBFYZLASA-N 1 3 280.415 3.665 20 0 CHADHO CC(C)(C)C[N@H+](Cc1ccc(Cl)cc1)C1CCNCC1 ZINC001236452326 1130945038 /nfs/dbraw/zinc/94/50/38/1130945038.db2.gz DGWFXBOVGIUZBH-UHFFFAOYSA-N 1 3 294.870 3.940 20 0 CHADHO CC(C)(C)C[N@@H+](Cc1ccc(Cl)cc1)C1CCNCC1 ZINC001236452326 1130945042 /nfs/dbraw/zinc/94/50/42/1130945042.db2.gz DGWFXBOVGIUZBH-UHFFFAOYSA-N 1 3 294.870 3.940 20 0 CHADHO CC(C)(C)CN(Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001236452326 1130945044 /nfs/dbraw/zinc/94/50/44/1130945044.db2.gz DGWFXBOVGIUZBH-UHFFFAOYSA-N 1 3 294.870 3.940 20 0 CHADHO CC(C)C[N@H+](Cc1cccc2ccoc21)[C@@H]1CCCNC1 ZINC001236476566 1130950559 /nfs/dbraw/zinc/95/05/59/1130950559.db2.gz ZCYNZLOPXZUVMX-QGZVFWFLSA-N 1 3 286.419 3.643 20 0 CHADHO CC(C)C[N@@H+](Cc1cccc2ccoc21)[C@@H]1CCCNC1 ZINC001236476566 1130950561 /nfs/dbraw/zinc/95/05/61/1130950561.db2.gz ZCYNZLOPXZUVMX-QGZVFWFLSA-N 1 3 286.419 3.643 20 0 CHADHO Cc1cc(F)ccc1[C@@H](C)[NH2+]CCCN1CCCCC1 ZINC000815554465 1130998134 /nfs/dbraw/zinc/99/81/34/1130998134.db2.gz ACIWWIZTWABLOO-OAHLLOKOSA-N 1 3 278.415 3.661 20 0 CHADHO CCCN(Cc1cc(C)c(Cl)c(C)c1)C[C@H]1CC[NH2+]C1 ZINC001236843706 1131021423 /nfs/dbraw/zinc/02/14/23/1131021423.db2.gz PVXGYBQSCQJQPO-HNNXBMFYSA-N 1 3 294.870 3.778 20 0 CHADHO C[C@H](N)C[N@H+](C)Cc1ccccc1-c1ccc(Cl)cc1 ZINC001236903544 1131031787 /nfs/dbraw/zinc/03/17/87/1131031787.db2.gz FHKPCPJUOWBXJJ-ZDUSSCGKSA-N 1 3 288.822 3.786 20 0 CHADHO C[C@H](N)C[N@@H+](C)Cc1ccccc1-c1ccc(Cl)cc1 ZINC001236903544 1131031791 /nfs/dbraw/zinc/03/17/91/1131031791.db2.gz FHKPCPJUOWBXJJ-ZDUSSCGKSA-N 1 3 288.822 3.786 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](CN2C[C@@H]([NH3+])C[C@H]2C)CC1 ZINC001237203388 1131070492 /nfs/dbraw/zinc/07/04/92/1131070492.db2.gz FLYKBZCLOQLOFM-NXHRZFHOSA-N 1 3 276.468 3.881 20 0 CHADHO c1ccc2c(c1)C[N@@H+](CCC1CCCC1)C21CCNCC1 ZINC001237300413 1131079232 /nfs/dbraw/zinc/07/92/32/1131079232.db2.gz LDKWHSHISMITNS-UHFFFAOYSA-N 1 3 284.447 3.661 20 0 CHADHO c1ccc2c(c1)C[N@H+](CCC1CCCC1)C21CCNCC1 ZINC001237300413 1131079238 /nfs/dbraw/zinc/07/92/38/1131079238.db2.gz LDKWHSHISMITNS-UHFFFAOYSA-N 1 3 284.447 3.661 20 0 CHADHO c1ccc(C2(CN3CC[C@H]4[NH2+]CCC[C@H]4C3)CCCC2)cc1 ZINC001237381238 1131091740 /nfs/dbraw/zinc/09/17/40/1131091740.db2.gz IIISACWTQMMXLP-PKOBYXMFSA-N 1 3 298.474 3.572 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CC1CCCCCCC1 ZINC000817889131 1131185534 /nfs/dbraw/zinc/18/55/34/1131185534.db2.gz MPUBZNFFRLEBDQ-CQSZACIVSA-N 1 3 289.467 3.860 20 0 CHADHO CCCCCC[C@@H](C)[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000817893199 1131186896 /nfs/dbraw/zinc/18/68/96/1131186896.db2.gz QMIAJQPGTGWKTR-ZIAGYGMSSA-N 1 3 277.456 3.858 20 0 CHADHO C[C@H](N[C@@H]1CCC[NH2+]CC1)c1csc2ccccc12 ZINC000817899419 1131186955 /nfs/dbraw/zinc/18/69/55/1131186955.db2.gz OJDSCKPEOMYWAJ-QWHCGFSZSA-N 1 3 274.433 3.694 20 0 CHADHO C[C@H](NCc1ccc(CC[NH3+])cc1)c1cc2ccccc2o1 ZINC000817947093 1131188935 /nfs/dbraw/zinc/18/89/35/1131188935.db2.gz JXEHHVLHSMQXPI-AWEZNQCLSA-N 1 3 294.398 3.785 20 0 CHADHO [NH3+]CCc1ccc(CN[C@H]2CCSc3ccccc32)cc1 ZINC000817946969 1131189113 /nfs/dbraw/zinc/18/91/13/1131189113.db2.gz IXOZAOJZLFPPMF-KRWDZBQOSA-N 1 3 298.455 3.515 20 0 CHADHO COc1c(C)cc([C@H](C)N[C@@H]2CCC[C@H]([NH3+])C2)cc1Cl ZINC000817970353 1131193917 /nfs/dbraw/zinc/19/39/17/1131193917.db2.gz RZSNGJAEPQYWCU-FPMFFAJLSA-N 1 3 296.842 3.578 20 0 CHADHO CCN(CC)CCC[NH2+][C@H]1CCc2cccc(Cl)c2C1 ZINC001170890899 1131204294 /nfs/dbraw/zinc/20/42/94/1131204294.db2.gz XUXFKZXQNSVJFG-HNNXBMFYSA-N 1 3 294.870 3.519 20 0 CHADHO CC[C@H](NCC[C@H](C)[NH2+]C)c1cccc2ccccc21 ZINC001118122011 1131211230 /nfs/dbraw/zinc/21/12/30/1131211230.db2.gz MSIXNNQEYLZDOZ-KSSFIOAISA-N 1 3 270.420 3.879 20 0 CHADHO CC(C)C1CCC([NH2+][C@@H]2CCN[C@@H](C(C)(C)C)C2)CC1 ZINC001246335623 1131474062 /nfs/dbraw/zinc/47/40/62/1131474062.db2.gz LEMHADSARFSRRZ-BHUNQDJPSA-N 1 3 280.500 3.958 20 0 CHADHO Clc1ccc(C2(NC3CCCCC3)CC[NH2+]CC2)cc1 ZINC001246338507 1131477486 /nfs/dbraw/zinc/47/74/86/1131477486.db2.gz YOIKXZTXDPTNTF-UHFFFAOYSA-N 1 3 292.854 3.841 20 0 CHADHO CCC(C)(C)C1CCC([NH2+][C@]2(CC)CCNC2)CC1 ZINC001246457150 1131505689 /nfs/dbraw/zinc/50/56/89/1131505689.db2.gz CQLZWPXEDTYGQE-VMBOVVBDSA-N 1 3 266.473 3.713 20 0 CHADHO CCCCC(CCCC)[N@@H+]1CCC[C@@H](CN)[C@H]1C ZINC001246567276 1131635279 /nfs/dbraw/zinc/63/52/79/1131635279.db2.gz WXGKGZGIHYSACY-CABCVRRESA-N 1 3 254.462 3.795 20 0 CHADHO CCCCC(CCCC)[N@H+]1CCC[C@@H](CN)[C@H]1C ZINC001246567276 1131635282 /nfs/dbraw/zinc/63/52/82/1131635282.db2.gz WXGKGZGIHYSACY-CABCVRRESA-N 1 3 254.462 3.795 20 0 CHADHO CCCC[C@@H]1C[C@@H]([N@@H+]2CCC[C@@](C)(F)CC2)CCN1 ZINC001246570886 1131645601 /nfs/dbraw/zinc/64/56/01/1131645601.db2.gz TZGZRIRJORJPKR-OWCLPIDISA-N 1 3 270.436 3.511 20 0 CHADHO CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@@](C)(F)CC2)CCN1 ZINC001246570886 1131645603 /nfs/dbraw/zinc/64/56/03/1131645603.db2.gz TZGZRIRJORJPKR-OWCLPIDISA-N 1 3 270.436 3.511 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@@H+]2CCC[C@@H](C)[C@@H](C)C2)CCN1 ZINC001246577091 1131662792 /nfs/dbraw/zinc/66/27/92/1131662792.db2.gz VEKADWLTWPZCNZ-YYIAUSFCSA-N 1 3 266.473 3.665 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@@H](C)[C@@H](C)C2)CCN1 ZINC001246577091 1131662795 /nfs/dbraw/zinc/66/27/95/1131662795.db2.gz VEKADWLTWPZCNZ-YYIAUSFCSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)(C)C1CCC([N@@H+]2CC[C@@]3(C2)CCCCN3)CC1 ZINC001246628937 1131734916 /nfs/dbraw/zinc/73/49/16/1131734916.db2.gz YWAKHRTVAJVNQT-LEOMRAHMSA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)(C)C1CCC([N@H+]2CC[C@@]3(C2)CCCCN3)CC1 ZINC001246628937 1131734921 /nfs/dbraw/zinc/73/49/21/1131734921.db2.gz YWAKHRTVAJVNQT-LEOMRAHMSA-N 1 3 278.484 3.809 20 0 CHADHO CCCCC1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)N3)CC1 ZINC001246682145 1131778717 /nfs/dbraw/zinc/77/87/17/1131778717.db2.gz SSSGWEUYJLXNPV-BJWYYQGGSA-N 1 3 264.457 3.562 20 0 CHADHO C[C@H]([NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)C1(C)CC1 ZINC000716639061 1132028629 /nfs/dbraw/zinc/02/86/29/1132028629.db2.gz RNDOBBAHCMLEFS-KANFNMMFSA-N 1 3 298.474 3.818 20 0 CHADHO C[C@@H]([NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)C1CCC1 ZINC000716634465 1132029176 /nfs/dbraw/zinc/02/91/76/1132029176.db2.gz BDVIMWUFTWKQQP-LQJIQPLVSA-N 1 3 298.474 3.818 20 0 CHADHO CN1C(C)(C)CC([NH+]2CC3(C2)CCCC3)CC1(C)C ZINC001171632226 1132062752 /nfs/dbraw/zinc/06/27/52/1132062752.db2.gz XKKKBCAOMSMCTP-UHFFFAOYSA-N 1 3 264.457 3.514 20 0 CHADHO C[NH+]1C(C)(C)CC(N2CC3(C2)CCCC3)CC1(C)C ZINC001171632226 1132062758 /nfs/dbraw/zinc/06/27/58/1132062758.db2.gz XKKKBCAOMSMCTP-UHFFFAOYSA-N 1 3 264.457 3.514 20 0 CHADHO CN1C(C)(C)CC([NH2+]CC2CCCCC2)CC1(C)C ZINC001171617840 1132064705 /nfs/dbraw/zinc/06/47/05/1132064705.db2.gz SHGWKEBGOMYJKT-UHFFFAOYSA-N 1 3 266.473 3.808 20 0 CHADHO C[NH+]1C(C)(C)CC(N[C@H]2C[C@H]2c2ccccc2)CC1(C)C ZINC001171620676 1132064744 /nfs/dbraw/zinc/06/47/44/1132064744.db2.gz DBNJSORHMCQKGG-IRXDYDNUSA-N 1 3 286.463 3.784 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@H]2C[C@H]2c2ccccc2)CC1(C)C ZINC001171620676 1132064749 /nfs/dbraw/zinc/06/47/49/1132064749.db2.gz DBNJSORHMCQKGG-IRXDYDNUSA-N 1 3 286.463 3.784 20 0 CHADHO C[C@@H]1CCCC[C@@H]1[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001171617530 1132064876 /nfs/dbraw/zinc/06/48/76/1132064876.db2.gz MXIHFMCLJKSYAT-HIFRSBDPSA-N 1 3 266.473 3.806 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@H]2CCC(C)(C)C2)CC1(C)C ZINC001171625092 1132067644 /nfs/dbraw/zinc/06/76/44/1132067644.db2.gz BLXKOMABJVTKQO-ZDUSSCGKSA-N 1 3 266.473 3.806 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccc(Cl)s1)C2 ZINC001172101619 1132123590 /nfs/dbraw/zinc/12/35/90/1132123590.db2.gz GGMLSWMQDUZZEF-CNDDSTCGSA-N 1 3 284.856 3.506 20 0 CHADHO C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H](NCc1ccccc1C1CC1)C2 ZINC001172102610 1132127737 /nfs/dbraw/zinc/12/77/37/1132127737.db2.gz NKEZSZVVCALOTA-BCDXTJNWSA-N 1 3 284.447 3.669 20 0 CHADHO C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H](NCc1ccccc1C1CC1)C2 ZINC001172102610 1132127739 /nfs/dbraw/zinc/12/77/39/1132127739.db2.gz NKEZSZVVCALOTA-BCDXTJNWSA-N 1 3 284.447 3.669 20 0 CHADHO C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](NCc1ccc3ccccc3c1)C2 ZINC001172107851 1132129211 /nfs/dbraw/zinc/12/92/11/1132129211.db2.gz KQJUZRAAKUFPEW-OWZKRDHZSA-N 1 3 294.442 3.945 20 0 CHADHO C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H](NCc1ccc3ccccc3c1)C2 ZINC001172107851 1132129217 /nfs/dbraw/zinc/12/92/17/1132129217.db2.gz KQJUZRAAKUFPEW-OWZKRDHZSA-N 1 3 294.442 3.945 20 0 CHADHO Cc1ccc(F)cc1[C@H](C)N[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172115614 1132133690 /nfs/dbraw/zinc/13/36/90/1132133690.db2.gz TZSARIAFJBTWLV-LLLHUVSDSA-N 1 3 290.426 3.800 20 0 CHADHO Cc1ccc(F)cc1[C@H](C)N[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172115614 1132133694 /nfs/dbraw/zinc/13/36/94/1132133694.db2.gz TZSARIAFJBTWLV-LLLHUVSDSA-N 1 3 290.426 3.800 20 0 CHADHO CC[NH+](CC)C1CCN([C@@H]2CC[C@H](C)[C@H](C)C2)CC1 ZINC001172374353 1132168564 /nfs/dbraw/zinc/16/85/64/1132168564.db2.gz QATCPFBCUMKHSI-ZMSDIMECSA-N 1 3 266.473 3.617 20 0 CHADHO CCN(CC)C1CC[NH+]([C@@H]2CC[C@H](C)[C@H](C)C2)CC1 ZINC001172374353 1132168568 /nfs/dbraw/zinc/16/85/68/1132168568.db2.gz QATCPFBCUMKHSI-ZMSDIMECSA-N 1 3 266.473 3.617 20 0 CHADHO CCC(CC)N1CCC([NH2+][C@H](C)CCO[C@H](C)CC)CC1 ZINC001172332348 1132172911 /nfs/dbraw/zinc/17/29/11/1132172911.db2.gz DNLAHDSAYQZDBZ-HZPDHXFCSA-N 1 3 298.515 3.823 20 0 CHADHO CC[C@H](C)OCC[C@H](C)N1CCC([NH3+])(CC2CCC2)CC1 ZINC001172335869 1132175077 /nfs/dbraw/zinc/17/50/77/1132175077.db2.gz LBSVCCUDHVHEAN-HOTGVXAUSA-N 1 3 296.499 3.564 20 0 CHADHO CC(C)OCC[C@H](C)[N@@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001172450804 1132237546 /nfs/dbraw/zinc/23/75/46/1132237546.db2.gz KQQHUNVGTGSNGO-ZWKOTPCHSA-N 1 3 296.499 3.530 20 0 CHADHO CC(C)OCC[C@H](C)[N@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001172450804 1132237551 /nfs/dbraw/zinc/23/75/51/1132237551.db2.gz KQQHUNVGTGSNGO-ZWKOTPCHSA-N 1 3 296.499 3.530 20 0 CHADHO CN1CC2(C1)CC[NH+]([C@@H]1CCC[C@@H](c3ccccc3)C1)CC2 ZINC001172550207 1132261680 /nfs/dbraw/zinc/26/16/80/1132261680.db2.gz VCJNCWIWGUQBFN-RTBURBONSA-N 1 3 298.474 3.740 20 0 CHADHO CCCN1C[C@@H]2C[NH+]([C@@H]3CC[C@@H](c4ccccc4)C3)C[C@H]2C1 ZINC001172570829 1132272926 /nfs/dbraw/zinc/27/29/26/1132272926.db2.gz XTHOEDAACKOKHX-UAFMIMERSA-N 1 3 298.474 3.596 20 0 CHADHO CCCC[N@H+](C)CCCN[C@H]1Cc2ccc(Cl)cc2C1 ZINC001172708477 1132309086 /nfs/dbraw/zinc/30/90/86/1132309086.db2.gz GZASJWKEDMJSFZ-KRWDZBQOSA-N 1 3 294.870 3.519 20 0 CHADHO CCCC[N@@H+](C)CCCN[C@H]1Cc2ccc(Cl)cc2C1 ZINC001172708477 1132309089 /nfs/dbraw/zinc/30/90/89/1132309089.db2.gz GZASJWKEDMJSFZ-KRWDZBQOSA-N 1 3 294.870 3.519 20 0 CHADHO CCCCN(C)CCC[NH2+][C@H]1Cc2ccc(Cl)cc2C1 ZINC001172708477 1132309093 /nfs/dbraw/zinc/30/90/93/1132309093.db2.gz GZASJWKEDMJSFZ-KRWDZBQOSA-N 1 3 294.870 3.519 20 0 CHADHO CC(C)[N@H+](Cc1cc2cnccc2[nH]1)Cc1ccccc1 ZINC001232010861 1132410120 /nfs/dbraw/zinc/41/01/20/1132410120.db2.gz FLDOGENUKOYWBU-UHFFFAOYSA-N 1 3 279.387 3.974 20 0 CHADHO CC(C)[N@@H+](Cc1cc2cnccc2[nH]1)Cc1ccccc1 ZINC001232010861 1132410124 /nfs/dbraw/zinc/41/01/24/1132410124.db2.gz FLDOGENUKOYWBU-UHFFFAOYSA-N 1 3 279.387 3.974 20 0 CHADHO CCc1ccc(C[C@H](C)N(C)CCC[NH+]2CCCC2)cc1 ZINC001173244552 1132417495 /nfs/dbraw/zinc/41/74/95/1132417495.db2.gz XIYKLGISWXICJS-KRWDZBQOSA-N 1 3 288.479 3.598 20 0 CHADHO CC[C@H]1CCC[N@H+](Cc2cc(F)cc(CN(C)C)c2)C1 ZINC001232146667 1132427613 /nfs/dbraw/zinc/42/76/13/1132427613.db2.gz XROZRVAECPQCEB-AWEZNQCLSA-N 1 3 278.415 3.509 20 0 CHADHO CC[C@H]1CCC[N@@H+](Cc2cc(F)cc(CN(C)C)c2)C1 ZINC001232146667 1132427619 /nfs/dbraw/zinc/42/76/19/1132427619.db2.gz XROZRVAECPQCEB-AWEZNQCLSA-N 1 3 278.415 3.509 20 0 CHADHO C[C@@H]1c2c(F)cccc2CCN1CCCCCCC[NH3+] ZINC000842472680 1132433053 /nfs/dbraw/zinc/43/30/53/1132433053.db2.gz HTNPCJKCCQURDU-CQSZACIVSA-N 1 3 278.415 3.654 20 0 CHADHO C[C@H]1c2c(F)cccc2CCN1CCCCCCC[NH3+] ZINC000842472678 1132433248 /nfs/dbraw/zinc/43/32/48/1132433248.db2.gz HTNPCJKCCQURDU-AWEZNQCLSA-N 1 3 278.415 3.654 20 0 CHADHO CC[C@@H]1CC[C@H]([NH+]2CCC(N3CCCCC3)CC2)C1 ZINC001173272910 1132437802 /nfs/dbraw/zinc/43/78/02/1132437802.db2.gz LDZOIASLTWYLQO-WBVHZDCISA-N 1 3 264.457 3.515 20 0 CHADHO CC[C@@H]1CC[C@H](N2CCC([NH+]3CCCCC3)CC2)C1 ZINC001173272910 1132437805 /nfs/dbraw/zinc/43/78/05/1132437805.db2.gz LDZOIASLTWYLQO-WBVHZDCISA-N 1 3 264.457 3.515 20 0 CHADHO CC[C@@H]1CC[C@@H]([N@@H+](Cc2ccccc2)C[C@H](C)CN)C1 ZINC001173272850 1132437976 /nfs/dbraw/zinc/43/79/76/1132437976.db2.gz LNLCIFRWRUKATM-JFIYKMOQSA-N 1 3 274.452 3.662 20 0 CHADHO CC[C@@H]1CC[C@@H]([N@H+](Cc2ccccc2)C[C@H](C)CN)C1 ZINC001173272850 1132437978 /nfs/dbraw/zinc/43/79/78/1132437978.db2.gz LNLCIFRWRUKATM-JFIYKMOQSA-N 1 3 274.452 3.662 20 0 CHADHO CCOc1ccc2ccccc2c1C[N@@H+]1[C@@H](C)CC[C@H]1CN ZINC001205068113 1133522854 /nfs/dbraw/zinc/52/28/54/1133522854.db2.gz BMQYQPCXKFHMBK-HOCLYGCPSA-N 1 3 298.430 3.550 20 0 CHADHO CCOc1ccc2ccccc2c1C[N@H+]1[C@@H](C)CC[C@H]1CN ZINC001205068113 1133522860 /nfs/dbraw/zinc/52/28/60/1133522860.db2.gz BMQYQPCXKFHMBK-HOCLYGCPSA-N 1 3 298.430 3.550 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1C[NH+]1CCC(N2CCCCC2)CC1 ZINC001205192985 1133544305 /nfs/dbraw/zinc/54/43/05/1133544305.db2.gz GRXNAYUIMDAAJE-PKOBYXMFSA-N 1 3 290.495 3.929 20 0 CHADHO CCCCOc1ccc(CN2CCC[C@@](C)([NH3+])CC2)cc1 ZINC001205266428 1133552947 /nfs/dbraw/zinc/55/29/47/1133552947.db2.gz ULDSVAKNTDBWIB-GOSISDBHSA-N 1 3 290.451 3.569 20 0 CHADHO Cc1ccc(-c2ccc(CN3CCC[C@](C)([NH3+])CC3)cc2)o1 ZINC001205281797 1133554370 /nfs/dbraw/zinc/55/43/70/1133554370.db2.gz YIMKZTPHYNHYFX-IBGZPJMESA-N 1 3 298.430 3.958 20 0 CHADHO C[C@]1([NH3+])CCCN(Cc2ccc(C3CCC3)cc2)CC1 ZINC001205289530 1133554523 /nfs/dbraw/zinc/55/45/23/1133554523.db2.gz YQGQJMHZHODXDY-SFHVURJKSA-N 1 3 272.436 3.657 20 0 CHADHO Cc1ccc2ccccc2c1C[N@H+]1CC[C@@H](C)[C@H](CN)C1 ZINC001205305953 1133558036 /nfs/dbraw/zinc/55/80/36/1133558036.db2.gz USISBSITRAFKHO-RHSMWYFYSA-N 1 3 282.431 3.565 20 0 CHADHO Cc1ccc2ccccc2c1C[N@@H+]1CC[C@@H](C)[C@H](CN)C1 ZINC001205305953 1133558041 /nfs/dbraw/zinc/55/80/41/1133558041.db2.gz USISBSITRAFKHO-RHSMWYFYSA-N 1 3 282.431 3.565 20 0 CHADHO Cc1c(Cl)ccc(CN2CC[C@@H](C)[C@H](C[NH3+])CC2)c1F ZINC001205651732 1133600367 /nfs/dbraw/zinc/60/03/67/1133600367.db2.gz IREUYLWGJYZCIL-YPMHNXCESA-N 1 3 298.833 3.594 20 0 CHADHO C[C@@H]1[C@H](C[NH3+])CCCN1Cc1ccc(F)c2ccccc12 ZINC001205903009 1133628098 /nfs/dbraw/zinc/62/80/98/1133628098.db2.gz MSGAWBXZRIQQNL-KGLIPLIRSA-N 1 3 286.394 3.538 20 0 CHADHO CCCCc1ccc(CN2CCC[C@@H](C[NH3+])[C@H]2C)s1 ZINC001205901008 1133628615 /nfs/dbraw/zinc/62/86/15/1133628615.db2.gz AMGLBUKCEKCVGL-KGLIPLIRSA-N 1 3 280.481 3.650 20 0 CHADHO C[C@H]1[C@H](C[NH3+])CCCN1Cc1cccc2c(F)cccc12 ZINC001205914488 1133630463 /nfs/dbraw/zinc/63/04/63/1133630463.db2.gz MMHVVNJVTHOLCH-KBPBESRZSA-N 1 3 286.394 3.538 20 0 CHADHO Cc1c(C[N@@H+]2CCCC[C@H](N)C2)cccc1-c1ccccc1 ZINC001205939609 1133632615 /nfs/dbraw/zinc/63/26/15/1133632615.db2.gz SLBGCWGCUVEMOY-IBGZPJMESA-N 1 3 294.442 3.975 20 0 CHADHO Cc1c(C[N@H+]2CCCC[C@H](N)C2)cccc1-c1ccccc1 ZINC001205939609 1133632616 /nfs/dbraw/zinc/63/26/16/1133632616.db2.gz SLBGCWGCUVEMOY-IBGZPJMESA-N 1 3 294.442 3.975 20 0 CHADHO Cc1ccc(F)c(CN2CCC[C@H](C[NH3+])[C@@H](C)C2)c1Cl ZINC001205992091 1133638941 /nfs/dbraw/zinc/63/89/41/1133638941.db2.gz DKHSBJHTCABDMH-QWHCGFSZSA-N 1 3 298.833 3.594 20 0 CHADHO CC(C)[N@H+](CCCc1cccc(F)c1)[C@@H]1CCCNCC1 ZINC001206584369 1133722211 /nfs/dbraw/zinc/72/22/11/1133722211.db2.gz YSFDVUAFLHNADB-GOSISDBHSA-N 1 3 292.442 3.611 20 0 CHADHO CC(C)[N@@H+](CCCc1cccc(F)c1)[C@@H]1CCCNCC1 ZINC001206584369 1133722214 /nfs/dbraw/zinc/72/22/14/1133722214.db2.gz YSFDVUAFLHNADB-GOSISDBHSA-N 1 3 292.442 3.611 20 0 CHADHO CC/C=C\CCC[N@H+](C(C)C)[C@H]1CCCNCC1 ZINC001206580497 1133722497 /nfs/dbraw/zinc/72/24/97/1133722497.db2.gz DACYALWUTPIKKF-KJPDOMRESA-N 1 3 252.446 3.585 20 0 CHADHO CC/C=C\CCC[N@@H+](C(C)C)[C@H]1CCCNCC1 ZINC001206580497 1133722501 /nfs/dbraw/zinc/72/25/01/1133722501.db2.gz DACYALWUTPIKKF-KJPDOMRESA-N 1 3 252.446 3.585 20 0 CHADHO C[C@@H](CC[N@@H+]1CCCC[C@@H](CN)C1)CC(C)(C)C ZINC001206606453 1133726320 /nfs/dbraw/zinc/72/63/20/1133726320.db2.gz NOXNNASPNSHQMX-GJZGRUSLSA-N 1 3 254.462 3.510 20 0 CHADHO C[C@@H](CC[N@H+]1CCCC[C@@H](CN)C1)CC(C)(C)C ZINC001206606453 1133726322 /nfs/dbraw/zinc/72/63/22/1133726322.db2.gz NOXNNASPNSHQMX-GJZGRUSLSA-N 1 3 254.462 3.510 20 0 CHADHO CC/C=C\CCCCC[N@@H+]1CCCC[C@H](CN)C1 ZINC001206606557 1133726411 /nfs/dbraw/zinc/72/64/11/1133726411.db2.gz PGBZSSLSALYBKQ-MJSXRHKHSA-N 1 3 252.446 3.574 20 0 CHADHO CC/C=C\CCCCC[N@H+]1CCCC[C@H](CN)C1 ZINC001206606557 1133726413 /nfs/dbraw/zinc/72/64/13/1133726413.db2.gz PGBZSSLSALYBKQ-MJSXRHKHSA-N 1 3 252.446 3.574 20 0 CHADHO C[C@@H]1CC[C@H](CN)C[N@@H+]1C[C@@H]1C[C@@H]1c1ccc(Cl)cc1 ZINC001206761157 1133743174 /nfs/dbraw/zinc/74/31/74/1133743174.db2.gz VDYWENKSBOMRBF-LNCBFAARSA-N 1 3 292.854 3.503 20 0 CHADHO C[C@@H]1CC[C@H](CN)C[N@H+]1C[C@@H]1C[C@@H]1c1ccc(Cl)cc1 ZINC001206761157 1133743177 /nfs/dbraw/zinc/74/31/77/1133743177.db2.gz VDYWENKSBOMRBF-LNCBFAARSA-N 1 3 292.854 3.503 20 0 CHADHO CC/C=C\CCCCC[N@@H+]1C[C@H](CN)CC[C@@H]1C ZINC001206761318 1133743323 /nfs/dbraw/zinc/74/33/23/1133743323.db2.gz WTBZLPRLEXPXDY-UDLYIEAKSA-N 1 3 252.446 3.572 20 0 CHADHO CC/C=C\CCCCC[N@H+]1C[C@H](CN)CC[C@@H]1C ZINC001206761318 1133743328 /nfs/dbraw/zinc/74/33/28/1133743328.db2.gz WTBZLPRLEXPXDY-UDLYIEAKSA-N 1 3 252.446 3.572 20 0 CHADHO Cc1ccc2ccccc2c1C[N@H+]1C[C@@H](CN)CC[C@H]1C ZINC001206770180 1133745307 /nfs/dbraw/zinc/74/53/07/1133745307.db2.gz RWFSEBMDSUIROU-HZPDHXFCSA-N 1 3 282.431 3.707 20 0 CHADHO Cc1ccc2ccccc2c1C[N@@H+]1C[C@@H](CN)CC[C@H]1C ZINC001206770180 1133745313 /nfs/dbraw/zinc/74/53/13/1133745313.db2.gz RWFSEBMDSUIROU-HZPDHXFCSA-N 1 3 282.431 3.707 20 0 CHADHO C[C@H](CC[NH2+][C@@H]1CCC[C@@H]1c1ccc(Cl)cc1)N(C)C ZINC001206827735 1133752315 /nfs/dbraw/zinc/75/23/15/1133752315.db2.gz RFEREIJOZDQEIE-KBRIMQKVSA-N 1 3 294.870 3.906 20 0 CHADHO CC1=CC[C@H](CC[NH+]2CCN(c3ccncc3)CC2)C1(C)C ZINC001207267219 1133783689 /nfs/dbraw/zinc/78/36/89/1133783689.db2.gz BVFKLXVXGDZSSJ-QGZVFWFLSA-N 1 3 299.462 3.586 20 0 CHADHO CC1=CC[C@H](CCN2CCN(c3cc[nH+]cc3)CC2)C1(C)C ZINC001207267219 1133783694 /nfs/dbraw/zinc/78/36/94/1133783694.db2.gz BVFKLXVXGDZSSJ-QGZVFWFLSA-N 1 3 299.462 3.586 20 0 CHADHO CCCN1C[C@@H]2C[N@@H+](CC[C@@H]3CC=C(C)C3(C)C)C[C@@H]2C1 ZINC001207274619 1133784922 /nfs/dbraw/zinc/78/49/22/1133784922.db2.gz DDRNFSHSERVDMF-KSZLIROESA-N 1 3 290.495 3.643 20 0 CHADHO CCCN1C[C@@H]2C[N@H+](CC[C@@H]3CC=C(C)C3(C)C)C[C@@H]2C1 ZINC001207274619 1133784927 /nfs/dbraw/zinc/78/49/27/1133784927.db2.gz DDRNFSHSERVDMF-KSZLIROESA-N 1 3 290.495 3.643 20 0 CHADHO CC[N@H+](Cc1ccc(Cl)cc1)CC(C)(C)CN(C)C ZINC001207283255 1133787719 /nfs/dbraw/zinc/78/77/19/1133787719.db2.gz WEQZODJGVRARRH-UHFFFAOYSA-N 1 3 282.859 3.750 20 0 CHADHO CC[N@@H+](Cc1ccc(Cl)cc1)CC(C)(C)CN(C)C ZINC001207283255 1133787723 /nfs/dbraw/zinc/78/77/23/1133787723.db2.gz WEQZODJGVRARRH-UHFFFAOYSA-N 1 3 282.859 3.750 20 0 CHADHO CN(C)CC(C)(C)C[N@@H+](C)Cc1ccc2ccccc2c1 ZINC001207288464 1133788484 /nfs/dbraw/zinc/78/84/84/1133788484.db2.gz PLVJYLGJLXILLF-UHFFFAOYSA-N 1 3 284.447 3.859 20 0 CHADHO CN(C)CC(C)(C)C[N@H+](C)Cc1ccc2ccccc2c1 ZINC001207288464 1133788479 /nfs/dbraw/zinc/78/84/79/1133788479.db2.gz PLVJYLGJLXILLF-UHFFFAOYSA-N 1 3 284.447 3.859 20 0 CHADHO CC1=CCC[C@@H](C)[C@H]1CN1CCC([NH2+]C2CCC2)CC1 ZINC001207741753 1133843817 /nfs/dbraw/zinc/84/38/17/1133843817.db2.gz KIAXDVGNRSLJPQ-QAPCUYQASA-N 1 3 276.468 3.585 20 0 CHADHO CC/C=C\CCCCCN1CCN(c2cc[nH+]cc2)CC1 ZINC001208189058 1133901882 /nfs/dbraw/zinc/90/18/82/1133901882.db2.gz QNZTWQRMNSFITQ-ARJAWSKDSA-N 1 3 287.451 3.730 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1CCc1cccs1 ZINC001209227102 1133990855 /nfs/dbraw/zinc/99/08/55/1133990855.db2.gz JAVFVTDFBAFHNK-HOTGVXAUSA-N 1 3 292.492 3.629 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@H+]1CCc1cccs1 ZINC001209227102 1133990858 /nfs/dbraw/zinc/99/08/58/1133990858.db2.gz JAVFVTDFBAFHNK-HOTGVXAUSA-N 1 3 292.492 3.629 20 0 CHADHO Cc1nc2ccc(Nc3ccc(C[NH+](C)C)cc3)cc2[nH]1 ZINC001213073737 1134420740 /nfs/dbraw/zinc/42/07/40/1134420740.db2.gz VKGDCLPYOWVLEP-UHFFFAOYSA-N 1 3 280.375 3.677 20 0 CHADHO c1ccc(CCCCC[N@@H+]2CCC[C@@]23CCCNC3)cc1 ZINC001222237373 1135212373 /nfs/dbraw/zinc/21/23/73/1135212373.db2.gz HFXAPTURTQILEI-LJQANCHMSA-N 1 3 286.463 3.617 20 0 CHADHO c1ccc(CCCCC[N@H+]2CCC[C@@]23CCCNC3)cc1 ZINC001222237373 1135212378 /nfs/dbraw/zinc/21/23/78/1135212378.db2.gz HFXAPTURTQILEI-LJQANCHMSA-N 1 3 286.463 3.617 20 0 CHADHO CSc1ccc(CN2CCC[C@]23CCC[NH2+]CC3)cc1 ZINC001222307727 1135221982 /nfs/dbraw/zinc/22/19/82/1135221982.db2.gz ARXYWOIOSGKNED-KRWDZBQOSA-N 1 3 290.476 3.517 20 0 CHADHO c1ccc(-c2ccc(CN3CC[C@H]4C[NH2+]CC[C@H]43)cc2)cc1 ZINC001222620339 1135256445 /nfs/dbraw/zinc/25/64/45/1135256445.db2.gz NPGRESRHUXLWSK-VQTJNVASSA-N 1 3 292.426 3.537 20 0 CHADHO c1ccc(-c2ccc(C[N@@H+]3CC[C@H]4CNCC[C@H]43)cc2)cc1 ZINC001222620339 1135256449 /nfs/dbraw/zinc/25/64/49/1135256449.db2.gz NPGRESRHUXLWSK-VQTJNVASSA-N 1 3 292.426 3.537 20 0 CHADHO c1ccc(-c2ccc(C[N@H+]3CC[C@H]4CNCC[C@H]43)cc2)cc1 ZINC001222620339 1135256455 /nfs/dbraw/zinc/25/64/55/1135256455.db2.gz NPGRESRHUXLWSK-VQTJNVASSA-N 1 3 292.426 3.537 20 0 CHADHO c1csc(-c2ccccc2CN2CC[C@H]3C[NH2+]CC[C@H]32)c1 ZINC001222620734 1135256787 /nfs/dbraw/zinc/25/67/87/1135256787.db2.gz YPUVSNMOEHEWMH-WMLDXEAASA-N 1 3 298.455 3.599 20 0 CHADHO C[N@@H+]1CC[C@H](NCc2ccc(C3CC3)cc2)[C@@H]2CCC[C@H]21 ZINC000353688042 529806658 /nfs/dbraw/zinc/80/66/58/529806658.db2.gz NVAQHLLNIYEDMM-GBESFXJTSA-N 1 3 284.447 3.526 20 0 CHADHO C[N@H+]1CC[C@H](NCc2ccc(C3CC3)cc2)[C@@H]2CCC[C@H]21 ZINC000353688042 529806660 /nfs/dbraw/zinc/80/66/60/529806660.db2.gz NVAQHLLNIYEDMM-GBESFXJTSA-N 1 3 284.447 3.526 20 0 CHADHO C[N@@H+]1CC[C@H](N[C@@H]2CCCc3sccc32)[C@@H]2CCC[C@@H]21 ZINC000353668106 529807019 /nfs/dbraw/zinc/80/70/19/529807019.db2.gz FTDGOSHKNZVOQN-UKMLZYKCSA-N 1 3 290.476 3.588 20 0 CHADHO C[N@H+]1CC[C@H](N[C@@H]2CCCc3sccc32)[C@@H]2CCC[C@@H]21 ZINC000353668106 529807020 /nfs/dbraw/zinc/80/70/20/529807020.db2.gz FTDGOSHKNZVOQN-UKMLZYKCSA-N 1 3 290.476 3.588 20 0 CHADHO C[NH2+]CC1CCN(Cc2c(Cl)oc3ccccc32)CC1 ZINC000347095823 529958792 /nfs/dbraw/zinc/95/87/92/529958792.db2.gz IJUFUEKPQLSBJK-UHFFFAOYSA-N 1 3 292.810 3.518 20 0 CHADHO CC(C)C[C@@H](N[C@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000129023205 260380852 /nfs/dbraw/zinc/38/08/52/260380852.db2.gz ZAFQNNGSXZZUPO-DLBZAZTESA-N 1 3 260.425 3.506 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H](C)c1cc(C)ccc1C ZINC000019943115 262207712 /nfs/dbraw/zinc/20/77/12/262207712.db2.gz RLPGVGYKBYXQKN-INIZCTEOSA-N 1 3 262.441 3.686 20 0 CHADHO CC[C@@H](NCC(C)(C)C[NH+](C)C)c1cccc(C)c1 ZINC000311529316 262338149 /nfs/dbraw/zinc/33/81/49/262338149.db2.gz VRPVJZLHIBBOBB-MRXNPFEDSA-N 1 3 262.441 3.624 20 0 CHADHO CC(C)[NH+]1CCC(N[C@H]2CCCCc3ccccc32)CC1 ZINC000020189040 171055096 /nfs/dbraw/zinc/05/50/96/171055096.db2.gz GRWFZZOBLIJTLD-IBGZPJMESA-N 1 3 286.463 3.917 20 0 CHADHO CCC[C@@H](NC1CC[NH+](CCC)CC1)c1ccccc1 ZINC000020190016 171057076 /nfs/dbraw/zinc/05/70/76/171057076.db2.gz OHCLFWFFQURUGL-GOSISDBHSA-N 1 3 274.452 3.992 20 0 CHADHO CC(C)(C)C[C@H]([NH2+]C1CCNCC1)c1ccccc1 ZINC000038041345 174041819 /nfs/dbraw/zinc/04/18/19/174041819.db2.gz HUTHHYRRHKLLSM-INIZCTEOSA-N 1 3 260.425 3.506 20 0 CHADHO CCN(CC)CCC[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccccc1 ZINC000575198363 335080017 /nfs/dbraw/zinc/08/00/17/335080017.db2.gz GMVWEXQZDJYYHX-NJAFHUGGSA-N 1 3 274.452 3.500 20 0 CHADHO CC[C@@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(Cl)cc1 ZINC000037649142 260115103 /nfs/dbraw/zinc/11/51/03/260115103.db2.gz MBWCJTLJAHBZCI-CXAGYDPISA-N 1 3 292.854 3.865 20 0 CHADHO CC[C@@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1 ZINC000037649142 260115104 /nfs/dbraw/zinc/11/51/04/260115104.db2.gz MBWCJTLJAHBZCI-CXAGYDPISA-N 1 3 292.854 3.865 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCCC[C@@H]1c1ccccc1)CN(C)C ZINC000394246696 260193017 /nfs/dbraw/zinc/19/30/17/260193017.db2.gz SPAPFVUCEVFOLM-NXHRZFHOSA-N 1 3 274.452 3.500 20 0 CHADHO CC[C@H](NC[C@H](C)C[NH+]1CCCC1)c1cccc(C)c1 ZINC000312830821 260209492 /nfs/dbraw/zinc/20/94/92/260209492.db2.gz UPMFFSXHEQJOEL-WMZOPIPTSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@H]([NH2+]C[C@H](C)CN1CCCC1)c1cccc(C)c1 ZINC000312830821 260209493 /nfs/dbraw/zinc/20/94/93/260209493.db2.gz UPMFFSXHEQJOEL-WMZOPIPTSA-N 1 3 274.452 3.768 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)Cc1ccc(Cl)cc1)CN1CCCC1 ZINC000223033818 260260585 /nfs/dbraw/zinc/26/05/85/260260585.db2.gz AYTRKHLKUKLMEQ-GJZGRUSLSA-N 1 3 294.870 3.593 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1cccc2ccccc21 ZINC000093210331 260273189 /nfs/dbraw/zinc/27/31/89/260273189.db2.gz HDGPVFWLXOQYNH-CWRNSKLLSA-N 1 3 268.404 3.760 20 0 CHADHO CC1(C)CC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000518006364 260333938 /nfs/dbraw/zinc/33/39/38/260333938.db2.gz PUSSFLXDBOZKCW-INIZCTEOSA-N 1 3 278.484 3.952 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](CCCc2ccccc2C)C1 ZINC000084678261 260366295 /nfs/dbraw/zinc/36/62/95/260366295.db2.gz GENMNVRKYRKWNI-SFHVURJKSA-N 1 3 288.479 3.591 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](CCCc2ccccc2C)C1 ZINC000084678261 260366297 /nfs/dbraw/zinc/36/62/97/260366297.db2.gz GENMNVRKYRKWNI-SFHVURJKSA-N 1 3 288.479 3.591 20 0 CHADHO C[C@H]1C[C@@H]1C[NH2+]C1CCN(C(C)(C)CC(C)(C)C)CC1 ZINC000449078337 261151666 /nfs/dbraw/zinc/15/16/66/261151666.db2.gz LYNLQALNDWUPFH-LSDHHAIUSA-N 1 3 280.500 3.911 20 0 CHADHO C[C@H]1C[C@@H]1CNC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449078337 261151667 /nfs/dbraw/zinc/15/16/67/261151667.db2.gz LYNLQALNDWUPFH-LSDHHAIUSA-N 1 3 280.500 3.911 20 0 CHADHO Cc1cc2c(cc1C)[C@@H](NC1CC[NH+](C)CC1)CCS2 ZINC000186946985 262117325 /nfs/dbraw/zinc/11/73/25/262117325.db2.gz IWYACZKLVWNWLW-INIZCTEOSA-N 1 3 290.476 3.524 20 0 CHADHO CC(C)Oc1ccc([C@@H](C)[NH2+]CCCN2CCCC2)cc1 ZINC000020129091 262193498 /nfs/dbraw/zinc/19/34/98/262193498.db2.gz BXMWDKULBMPZJK-MRXNPFEDSA-N 1 3 290.451 3.610 20 0 CHADHO Cc1cccc(CNCCC[N@@H+](C)Cc2ccccc2)c1 ZINC000020013219 262225612 /nfs/dbraw/zinc/22/56/12/262225612.db2.gz UCQGBGKZCCPSGP-UHFFFAOYSA-N 1 3 282.431 3.607 20 0 CHADHO Cc1cccc(CNCCC[N@H+](C)Cc2ccccc2)c1 ZINC000020013219 262225614 /nfs/dbraw/zinc/22/56/14/262225614.db2.gz UCQGBGKZCCPSGP-UHFFFAOYSA-N 1 3 282.431 3.607 20 0 CHADHO C[C@H](C[NH2+]C[C@@H]1C[C@H]1c1ccccc1)CN1CCCCC1 ZINC000503031150 262236808 /nfs/dbraw/zinc/23/68/08/262236808.db2.gz CIOZUEFZNYRGBT-NEWSRXKRSA-N 1 3 286.463 3.502 20 0 CHADHO CCN(Cc1ccccc1Cl)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000414668652 263026400 /nfs/dbraw/zinc/02/64/00/263026400.db2.gz AMMVPPIAIXSFRL-KBPBESRZSA-N 1 3 280.843 3.550 20 0 CHADHO CC(C)Oc1cccc(CNCc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000414808884 263052578 /nfs/dbraw/zinc/05/25/78/263052578.db2.gz LEMMTYBDCMQSTF-HNNXBMFYSA-N 1 3 298.430 3.783 20 0 CHADHO CSc1ccc(CNCc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000414810445 263052836 /nfs/dbraw/zinc/05/28/36/263052836.db2.gz ODAIPBDSOCQWEW-CYBMUJFWSA-N 1 3 286.444 3.718 20 0 CHADHO CCC([NH3+])(CC)CN[C@@H]1CCC[C@@H]1c1ccc(F)cc1 ZINC000414813861 263053225 /nfs/dbraw/zinc/05/32/25/263053225.db2.gz URHDBDUTEDCLAO-HZPDHXFCSA-N 1 3 278.415 3.569 20 0 CHADHO NC[C@@H]1CCC[C@@H]1[NH2+]C1CCC(c2ccc(F)cc2)CC1 ZINC000414812588 263053437 /nfs/dbraw/zinc/05/34/37/263053437.db2.gz XMTZEOYXNWATKR-LSCKAKRGSA-N 1 3 290.426 3.569 20 0 CHADHO CCC[C@@H](CCc1ccccc1)NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414820576 263054736 /nfs/dbraw/zinc/05/47/36/263054736.db2.gz AGAGNMZTIGYMGH-HTUJPFKRSA-N 1 3 286.463 3.661 20 0 CHADHO CC(C)C[C@H](C[NH2+][C@@H](C)[C@@H]1CCCNC1)c1ccccc1 ZINC000414828038 263056059 /nfs/dbraw/zinc/05/60/59/263056059.db2.gz YTWMZKMZBIQMQA-QXAKKESOSA-N 1 3 288.479 3.794 20 0 CHADHO [NH3+]C1(CN[C@H]2CCC[C@@H]2c2ccc(F)cc2)CCCCC1 ZINC000414836750 263057280 /nfs/dbraw/zinc/05/72/80/263057280.db2.gz GGJDIHPUYGGBSG-SJORKVTESA-N 1 3 290.426 3.713 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+][C@H]1CCC[C@@H](N)C1 ZINC000414907077 263114148 /nfs/dbraw/zinc/11/41/48/263114148.db2.gz AIRVTLOSQNVHLR-KURKYZTESA-N 1 3 274.452 3.647 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H](N)C2)C[C@@H](c2ccccc2)C1 ZINC000414925133 263129732 /nfs/dbraw/zinc/12/97/32/263129732.db2.gz LAPAMEMQCHYMHW-NLNMYJFZSA-N 1 3 286.463 3.818 20 0 CHADHO C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3)s2)CCN1 ZINC000414941512 263150277 /nfs/dbraw/zinc/15/02/77/263150277.db2.gz CVPWTGOJVCGTFB-ZFWWWQNUSA-N 1 3 286.444 3.645 20 0 CHADHO CC(C)C[C@@H](C)[NH2+]C[C@@H]1CNCC[C@@H]1c1ccc(F)cc1 ZINC000414997645 263196301 /nfs/dbraw/zinc/19/63/01/263196301.db2.gz HQKCNKRYKOEVBJ-UWWQBHOKSA-N 1 3 292.442 3.543 20 0 CHADHO CCc1cccc(Cl)c1CN[C@@H](C)CCCC[NH3+] ZINC000415010820 263253339 /nfs/dbraw/zinc/25/33/39/263253339.db2.gz GULOLGATDTXARX-LBPRGKRZSA-N 1 3 268.832 3.510 20 0 CHADHO C[C@@H](CCCC[NH3+])NCc1ccc(Cl)cc1Cl ZINC000415013821 263254896 /nfs/dbraw/zinc/25/48/96/263254896.db2.gz LEERWCKOXRYXGQ-JTQLQIEISA-N 1 3 275.223 3.601 20 0 CHADHO CCOc1cccc(CN[C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000415044749 263257842 /nfs/dbraw/zinc/25/78/42/263257842.db2.gz BVEOEKFGZXBWNK-IBGZPJMESA-N 1 3 298.430 3.655 20 0 CHADHO Cc1ccc(CN[C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000415059043 263258644 /nfs/dbraw/zinc/25/86/44/263258644.db2.gz ULHXRPKSKJIODB-GOSISDBHSA-N 1 3 268.404 3.565 20 0 CHADHO Cc1ccc(F)c(CN[C@H](CCC[NH3+])c2ccccc2)c1 ZINC000415053987 263258889 /nfs/dbraw/zinc/25/88/89/263258889.db2.gz NEPWSVPXAOHRTK-GOSISDBHSA-N 1 3 286.394 3.704 20 0 CHADHO C[C@@H](CCNCC(C)(C)[NH3+])c1cccc(C(F)(F)F)c1 ZINC000415089166 263272499 /nfs/dbraw/zinc/27/24/99/263272499.db2.gz NCLUDPQVOMTYMK-NSHDSACASA-N 1 3 288.357 3.526 20 0 CHADHO C[C@@H]([NH2+]C[C@H](C)CN(C)C)C1CCC(C(F)(F)F)CC1 ZINC000425939163 263919906 /nfs/dbraw/zinc/91/99/06/263919906.db2.gz ZDEKKAIQEXHKBA-MRFVTOPCSA-N 1 3 294.405 3.531 20 0 CHADHO CC[NH+](CC)Cc1ccccc1CN[C@@H]1CC[C@@H]1SC ZINC000425359363 264140705 /nfs/dbraw/zinc/14/07/05/264140705.db2.gz PSTROJXOLSFHQS-SJORKVTESA-N 1 3 292.492 3.512 20 0 CHADHO Cc1ccc2cc([C@@H](C)[NH2+][C@@H](C)CCN(C)C)oc2c1 ZINC000425958311 264226615 /nfs/dbraw/zinc/22/66/15/264226615.db2.gz MLQKGBKIBIQABS-UONOGXRCSA-N 1 3 274.408 3.732 20 0 CHADHO CC(C)CC1(CN[C@@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC000391948180 265031986 /nfs/dbraw/zinc/03/19/86/265031986.db2.gz XUTQBFYVKDUDBU-JKSUJKDBSA-N 1 3 258.409 3.547 20 0 CHADHO Cc1ccc([C@H](C)NCc2ccc(C[NH+](C)C)cc2)cc1 ZINC000171129676 327646414 /nfs/dbraw/zinc/64/64/14/327646414.db2.gz YNUFAUWCJHEKQQ-INIZCTEOSA-N 1 3 282.431 3.907 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H]2CCc3c2cccc3Cl)C1 ZINC000531700579 328025811 /nfs/dbraw/zinc/02/58/11/328025811.db2.gz REXPJBNLASSRIO-GUYCJALGSA-N 1 3 292.854 3.649 20 0 CHADHO C[C@@H]1C[N@H+](CC2CCC(c3ccccc3)CC2)CC[C@@H]1N ZINC000414652040 328208434 /nfs/dbraw/zinc/20/84/34/328208434.db2.gz CYLLPXKSRWQUTH-JVDULTGUSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@@H]1C[N@@H+](CC2CCC(c3ccccc3)CC2)CC[C@@H]1N ZINC000414652040 328208435 /nfs/dbraw/zinc/20/84/35/328208435.db2.gz CYLLPXKSRWQUTH-JVDULTGUSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@@H]1CN(CC2CCC(c3ccccc3)CC2)CC[C@@H]1[NH3+] ZINC000414652040 328208436 /nfs/dbraw/zinc/20/84/36/328208436.db2.gz CYLLPXKSRWQUTH-JVDULTGUSA-N 1 3 286.463 3.630 20 0 CHADHO Cc1nc(C)c([C@@H](C)[NH2+]C[C@@H]2CCCN(C(C)C)C2)s1 ZINC000178750413 329200279 /nfs/dbraw/zinc/20/02/79/329200279.db2.gz ANDOYULKJARJPH-DOMZBBRYSA-N 1 3 295.496 3.531 20 0 CHADHO CC(C)C[C@@H]([NH3+])CN[C@H](C)CC(C)(C)c1ccccc1 ZINC000415080333 328302251 /nfs/dbraw/zinc/30/22/51/328302251.db2.gz IXLMMKMAISTDQN-NVXWUHKLSA-N 1 3 276.468 3.706 20 0 CHADHO Cc1cc(C)c([C@@H](C)N[C@@H](C)CC[NH+](C)C)cc1C ZINC000049553639 328371715 /nfs/dbraw/zinc/37/17/15/328371715.db2.gz LBHAEQABRORASY-JKSUJKDBSA-N 1 3 262.441 3.603 20 0 CHADHO Cc1ccsc1[C@@H](C)[NH2+]CCCN1CCCC[C@@H]1C ZINC000070089654 328381604 /nfs/dbraw/zinc/38/16/04/328381604.db2.gz KPOUILXTPVQOBA-LSDHHAIUSA-N 1 3 280.481 3.972 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCc3c2cccc3Cl)C1 ZINC000531995141 328387641 /nfs/dbraw/zinc/38/76/41/328387641.db2.gz APZTVSYVVXSZQS-PBFPGSCMSA-N 1 3 292.854 3.790 20 0 CHADHO CC[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1cccc(Cl)c1 ZINC000093211237 328510795 /nfs/dbraw/zinc/51/07/95/328510795.db2.gz DSONIKPJPQXKJH-KKUMJFAQSA-N 1 3 266.816 3.651 20 0 CHADHO C[C@H](c1ccccc1Cl)N1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000584172992 327057331 /nfs/dbraw/zinc/05/73/31/327057331.db2.gz OIFUVJASVIQRHJ-HIFRSBDPSA-N 1 3 292.854 3.723 20 0 CHADHO CCN(CC)CCC[N@@H+]1C[C@H](c2ccccc2)C[C@@H]1C ZINC000558724372 327117690 /nfs/dbraw/zinc/11/76/90/327117690.db2.gz CRDLEJZEGOULEJ-FUHWJXTLSA-N 1 3 274.452 3.596 20 0 CHADHO CC[NH+](CC)CCCN1C[C@H](c2ccccc2)C[C@@H]1C ZINC000558724372 327117688 /nfs/dbraw/zinc/11/76/88/327117688.db2.gz CRDLEJZEGOULEJ-FUHWJXTLSA-N 1 3 274.452 3.596 20 0 CHADHO CCN(CC)CCC[N@H+]1C[C@H](c2ccccc2)C[C@@H]1C ZINC000558724372 327117691 /nfs/dbraw/zinc/11/76/91/327117691.db2.gz CRDLEJZEGOULEJ-FUHWJXTLSA-N 1 3 274.452 3.596 20 0 CHADHO CCC[C@H]([NH2+][C@H]1CCN2CCC[C@@H]2C1)C1CCCC1 ZINC000313428950 327145886 /nfs/dbraw/zinc/14/58/86/327145886.db2.gz OSANKKKQJWFYAB-BBWFWOEESA-N 1 3 264.457 3.562 20 0 CHADHO c1cc(C2CCC2)ccc1C[NH2+]C1CCN(CC2CC2)CC1 ZINC000559242941 327149319 /nfs/dbraw/zinc/14/93/19/327149319.db2.gz FSTTZVRNAKOFPY-UHFFFAOYSA-N 1 3 298.474 3.918 20 0 CHADHO CC1(C)CCC(N[C@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC000132125783 327185458 /nfs/dbraw/zinc/18/54/58/327185458.db2.gz SYWKDEYDXSYBNV-HOTGVXAUSA-N 1 3 258.409 3.690 20 0 CHADHO CCCN1CCC([N@H+](C)C/C=C/c2ccc(F)cc2)CC1 ZINC000092165701 327187199 /nfs/dbraw/zinc/18/71/99/327187199.db2.gz LCSZDRQDTJEDNC-SNAWJCMRSA-N 1 3 290.426 3.645 20 0 CHADHO CCCN1CCC([N@@H+](C)C/C=C/c2ccc(F)cc2)CC1 ZINC000092165701 327187200 /nfs/dbraw/zinc/18/72/00/327187200.db2.gz LCSZDRQDTJEDNC-SNAWJCMRSA-N 1 3 290.426 3.645 20 0 CHADHO C[C@@H]1CCC[C@H](N2CCC([NH2+][C@H]3CCC3(C)C)CC2)C1 ZINC000554377874 327216826 /nfs/dbraw/zinc/21/68/26/327216826.db2.gz VQLGNIIXIFBRLE-PVAVHDDUSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)N1CC[C@@]2(CC[NH2+]C2)C1 ZINC000261807948 327353169 /nfs/dbraw/zinc/35/31/69/327353169.db2.gz ZKODUUBDZUYHMX-DNVCBOLYSA-N 1 3 280.415 3.586 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCCC[C@H]2c2ccccc2)C1 ZINC000566482123 327392900 /nfs/dbraw/zinc/39/29/00/327392900.db2.gz MMDGCUFEHJFTMF-YRXWBPOGSA-N 1 3 286.463 3.820 20 0 CHADHO C[C@H]1CCC[C@H](N2CCC([NH2+]C[C@@H]3C[C@H]3C3CC3)CC2)C1 ZINC000449741331 327427200 /nfs/dbraw/zinc/42/72/00/327427200.db2.gz JUNQYHFSODSQTB-CBVHJVASSA-N 1 3 290.495 3.665 20 0 CHADHO [NH3+][C@H]1CCC[C@H](NC2CC(F)(c3cccc(Cl)c3)C2)C1 ZINC000566926612 327502375 /nfs/dbraw/zinc/50/23/75/327502375.db2.gz OADYRVDIHBFZMC-FXQLRMTLSA-N 1 3 296.817 3.527 20 0 CHADHO CC[C@@H]([NH2+]CCCN(C)C(C)C)c1cccs1 ZINC000221915731 329215881 /nfs/dbraw/zinc/21/58/81/329215881.db2.gz BJABGPHJEQLHDK-CYBMUJFWSA-N 1 3 254.443 3.519 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000583131558 329319041 /nfs/dbraw/zinc/31/90/41/329319041.db2.gz SWQGEOYVNMMIDD-HXFGRODQSA-N 1 3 286.463 3.641 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)CN2CCCCC2)s1 ZINC000038041631 329354734 /nfs/dbraw/zinc/35/47/34/329354734.db2.gz YIRRRCYFSRXNMJ-UKRRQHHQSA-N 1 3 280.481 3.829 20 0 CHADHO Cc1ccc(CNCC2CC[NH+](C3CC3)CC2)c(Cl)c1 ZINC000583268863 329415477 /nfs/dbraw/zinc/41/54/77/329415477.db2.gz ODBLIOBRMQRIEX-UHFFFAOYSA-N 1 3 292.854 3.612 20 0 CHADHO CC(C)(C)[C@@H](NCCC[NH3+])c1cccc(C(F)(F)F)c1 ZINC000420419809 329764463 /nfs/dbraw/zinc/76/44/63/329764463.db2.gz XUCWUDUZTPISIA-ZDUSSCGKSA-N 1 3 288.357 3.731 20 0 CHADHO Cc1cc([C@H](C)N[C@@H]2CCCC[C@H]2C[NH3+])c(C)s1 ZINC000251069349 329924531 /nfs/dbraw/zinc/92/45/31/329924531.db2.gz HXVRHTCTBVFLOE-CORIIIEPSA-N 1 3 266.454 3.533 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N[C@H](C)c1ccncc1Cl ZINC000421805878 330081403 /nfs/dbraw/zinc/08/14/03/330081403.db2.gz YBDHBCLMFMUJQA-ZIAGYGMSSA-N 1 3 297.874 3.896 20 0 CHADHO CC[NH+]1CCC(CCN[C@H](C)c2ccncc2Cl)CC1 ZINC000421838210 330092505 /nfs/dbraw/zinc/09/25/05/330092505.db2.gz UXFIAMQRROKGHE-CYBMUJFWSA-N 1 3 295.858 3.508 20 0 CHADHO CC(C)(CC[NH3+])NCc1ccc(-c2ccc(F)cc2)s1 ZINC000422561206 330149332 /nfs/dbraw/zinc/14/93/32/330149332.db2.gz JTKKPSLLFLVGDY-UHFFFAOYSA-N 1 3 292.423 3.771 20 0 CHADHO C[C@@H](NCCCCCOC1CCCCC1)[C@H]1CCCC[NH2+]1 ZINC000422700584 330150786 /nfs/dbraw/zinc/15/07/86/330150786.db2.gz AHBVKHSPIZQRGH-SJLPKXTDSA-N 1 3 296.499 3.626 20 0 CHADHO Cc1ccc(CCN[C@H]2C[C@@H]([NH3+])c3ccccc32)c(C)c1 ZINC000422707617 330151123 /nfs/dbraw/zinc/15/11/23/330151123.db2.gz WSNYVOYWKGJWRI-MOPGFXCFSA-N 1 3 280.415 3.580 20 0 CHADHO c1ccc(C[C@H]2CCCC[C@H]2NC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000422712030 330151376 /nfs/dbraw/zinc/15/13/76/330151376.db2.gz NRQTWCVIAXYAKS-LXKKFAQKSA-N 1 3 298.474 3.661 20 0 CHADHO CC(C)(CN[C@H]1C[C@@H]([NH3+])c2ccccc21)c1ccc(F)cc1 ZINC000422711223 330151462 /nfs/dbraw/zinc/15/14/62/330151462.db2.gz MKUZLRBVZLKLIS-MSOLQXFVSA-N 1 3 298.405 3.838 20 0 CHADHO C[C@@H]1CCNCC[C@@H]1[NH2+]CC(C)(C)c1ccccc1Cl ZINC000422714020 330151799 /nfs/dbraw/zinc/15/17/99/330151799.db2.gz QONWDAYTDIXVCJ-CJNGLKHVSA-N 1 3 294.870 3.595 20 0 CHADHO C[C@@H]1CC[NH2+]CC[C@@H]1NCC(C)(C)c1ccccc1Cl ZINC000422714020 330151801 /nfs/dbraw/zinc/15/18/01/330151801.db2.gz QONWDAYTDIXVCJ-CJNGLKHVSA-N 1 3 294.870 3.595 20 0 CHADHO C[C@@H](N[C@@H]1CCC[NH2+]CC1)c1ccc2ccccc2c1 ZINC000422746647 330153164 /nfs/dbraw/zinc/15/31/64/330153164.db2.gz NZXLYESHWBGTIB-RDTXWAMCSA-N 1 3 268.404 3.633 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@H]1NCC1(c2cccc(Cl)c2)CC1 ZINC000422757998 330153509 /nfs/dbraw/zinc/15/35/09/330153509.db2.gz DMBVTDWNOAZGFY-HZPDHXFCSA-N 1 3 292.854 3.621 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](Cc1ccccc1)c1ccccc1 ZINC000422768248 330154187 /nfs/dbraw/zinc/15/41/87/330154187.db2.gz RVWUEJXOOJXINE-FCEWJHQRSA-N 1 3 282.431 3.686 20 0 CHADHO Cc1cccc([C@@H](C)C[NH2+][C@@H](C)c2ccc(CN)nc2C)c1 ZINC000422792037 330155335 /nfs/dbraw/zinc/15/53/35/330155335.db2.gz WSBCXYSKWFKIJM-GJZGRUSLSA-N 1 3 297.446 3.611 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@H](c1ccccc1)C1CC1 ZINC000422808800 330155871 /nfs/dbraw/zinc/15/58/71/330155871.db2.gz QWPWPGQXBUWEIG-AUUYWEPGSA-N 1 3 295.430 3.651 20 0 CHADHO [NH3+][C@H]1C[C@H](NCC2(c3ccccc3)CCC2)c2ccccc21 ZINC000422803602 330155973 /nfs/dbraw/zinc/15/59/73/330155973.db2.gz CZHXWVCZLOVPCB-OALUTQOASA-N 1 3 292.426 3.843 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H]1CCC(C)(C)C[C@H]1C ZINC000422816454 330156163 /nfs/dbraw/zinc/15/61/63/330156163.db2.gz FGWXVQDHICBMEX-HACGYAERSA-N 1 3 289.467 3.714 20 0 CHADHO c1ccc(C2(CN[C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)CC2)cc1 ZINC000422814829 330156172 /nfs/dbraw/zinc/15/61/72/330156172.db2.gz WFAZWHDBOXHPQF-GBESFXJTSA-N 1 3 298.474 3.619 20 0 CHADHO CC[C@H](N[C@@H](C)C[C@@H](C)[NH3+])c1ccc(Cl)cc1 ZINC000422824834 330156464 /nfs/dbraw/zinc/15/64/64/330156464.db2.gz OPQOMZZRUYBRDD-SUNKGSAMSA-N 1 3 254.805 3.507 20 0 CHADHO C[C@H](N[C@H](c1cccc(F)c1)C(C)(C)C)[C@H]1CC[NH2+]C1 ZINC000422837558 330157155 /nfs/dbraw/zinc/15/71/55/330157155.db2.gz MBQFXXYZUNEZJS-DUVNUKRYSA-N 1 3 278.415 3.501 20 0 CHADHO CC(C)(C)[C@@H](N[C@@H]1CCC[NH2+]CC1)c1cccc(F)c1 ZINC000422839812 330157219 /nfs/dbraw/zinc/15/72/19/330157219.db2.gz RKXOJWPLCSAYNA-CVEARBPZSA-N 1 3 278.415 3.645 20 0 CHADHO Cc1ccccc1[C@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)C(C)(C)C ZINC000422840942 330157255 /nfs/dbraw/zinc/15/72/55/330157255.db2.gz UWYNGUGGHPEVOY-ONYGOOLBSA-N 1 3 286.463 3.955 20 0 CHADHO CC[C@H](N[C@@H](C)[C@H]1CCC[NH2+]C1)c1cccc(Cl)c1 ZINC000422853423 330157349 /nfs/dbraw/zinc/15/73/49/330157349.db2.gz BTFJHYHHDXLTES-NOLJZWGESA-N 1 3 280.843 3.769 20 0 CHADHO C[C@@H](CCC[NH3+])N[C@H](c1ccccc1)c1cccc(F)c1 ZINC000422873308 330158710 /nfs/dbraw/zinc/15/87/10/330158710.db2.gz KZECMQNLYUMCGO-KBXCAEBGSA-N 1 3 286.394 3.632 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](c1cccc(F)c1)C1CCCC1 ZINC000422879413 330158775 /nfs/dbraw/zinc/15/87/75/330158775.db2.gz VIIHJNAKMYOQCD-GDZNZVCISA-N 1 3 278.415 3.772 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCCc1cccc(-c2ccccc2)c1 ZINC000422883662 330159210 /nfs/dbraw/zinc/15/92/10/330159210.db2.gz CPYIZQBCEBCGQF-HZPDHXFCSA-N 1 3 282.431 3.612 20 0 CHADHO C[C@@H](N)C[C@@H](C)[NH2+]CCc1cccc(-c2ccccc2)c1 ZINC000422883662 330159212 /nfs/dbraw/zinc/15/92/12/330159212.db2.gz CPYIZQBCEBCGQF-HZPDHXFCSA-N 1 3 282.431 3.612 20 0 CHADHO COc1ccc(-c2ccc(CN[C@@H](C)C[C@@H](C)[NH3+])cc2)cc1 ZINC000422917557 330160334 /nfs/dbraw/zinc/16/03/34/330160334.db2.gz GHTHFJSKEILJHF-CABCVRRESA-N 1 3 298.430 3.578 20 0 CHADHO C[C@@H](CCCC[NH3+])N[C@@H](C)c1c(F)cccc1Cl ZINC000422923474 330160490 /nfs/dbraw/zinc/16/04/90/330160490.db2.gz WHJRBZGVQDIKSX-QWRGUYRKSA-N 1 3 272.795 3.647 20 0 CHADHO C[C@@H]1C[C@@H]1[C@H]([NH2+][C@H]1CCC[C@H]1N)c1ccc(Cl)cc1 ZINC000422926812 330160913 /nfs/dbraw/zinc/16/09/13/330160913.db2.gz XOCZDNWHGHARLZ-NFWSPEMXSA-N 1 3 278.827 3.507 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H]1CCC(C)(C)c2ccccc21 ZINC000422939494 330161575 /nfs/dbraw/zinc/16/15/75/330161575.db2.gz FWMYLJKFOFZAFB-ZENOOKHLSA-N 1 3 260.425 3.515 20 0 CHADHO [NH3+]CC1CCC(NCc2cc(Cl)sc2Cl)CC1 ZINC000422996299 330163426 /nfs/dbraw/zinc/16/34/26/330163426.db2.gz SQNONOJTURDHEQ-UHFFFAOYSA-N 1 3 293.263 3.662 20 0 CHADHO CC(C)C[C@H](N[C@@H]1CCC[NH2+]CC1)c1cccs1 ZINC000422949579 330163894 /nfs/dbraw/zinc/16/38/94/330163894.db2.gz UJPLGOWCABQDDB-KGLIPLIRSA-N 1 3 266.454 3.567 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NC2(Cc3ccccc3)CCC2)c2ccccc21 ZINC000422956431 330164095 /nfs/dbraw/zinc/16/40/95/330164095.db2.gz LEPGZXWLVBGTLC-RTBURBONSA-N 1 3 292.426 3.886 20 0 CHADHO C[C@@H](CCC[NH3+])N[C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000422961781 330164227 /nfs/dbraw/zinc/16/42/27/330164227.db2.gz ZYCOLRGGUIETAO-STQMWFEESA-N 1 3 289.448 3.588 20 0 CHADHO c1ccc([C@@H](CC2CCCC2)[NH2+]C2CCNCC2)cc1 ZINC000423005620 330164853 /nfs/dbraw/zinc/16/48/53/330164853.db2.gz SNPFACUHEOPQMY-GOSISDBHSA-N 1 3 272.436 3.650 20 0 CHADHO C[C@@H](N[C@H]1CC[C@@H](C)c2ccccc21)[C@@H]1CCC[NH2+]C1 ZINC000423005409 330164961 /nfs/dbraw/zinc/16/49/61/330164961.db2.gz RZTCMMGZRKFMHP-ADAWSYLGSA-N 1 3 272.436 3.603 20 0 CHADHO C[C@@H]([NH2+][C@H]1CC[C@@H](C)c2ccccc21)[C@@H]1CCCNC1 ZINC000423005409 330164963 /nfs/dbraw/zinc/16/49/63/330164963.db2.gz RZTCMMGZRKFMHP-ADAWSYLGSA-N 1 3 272.436 3.603 20 0 CHADHO CC(C)CSCCC[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCCN1 ZINC000423016829 330165544 /nfs/dbraw/zinc/16/55/44/330165544.db2.gz UQYKOSDDXXQLFF-YESZJQIVSA-N 1 3 298.540 3.666 20 0 CHADHO [NH3+][C@H]1CCCCC[C@H]1NCC1(c2ccccc2Cl)CC1 ZINC000423021360 330165610 /nfs/dbraw/zinc/16/56/10/330165610.db2.gz FAZXAYGPXFSQNA-JKSUJKDBSA-N 1 3 292.854 3.621 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]C[C@H]1CCC(C)(C)c2ccccc21 ZINC000423020073 330165743 /nfs/dbraw/zinc/16/57/43/330165743.db2.gz YORIIUHDYAXVQG-RRFJBIMHSA-N 1 3 274.452 3.557 20 0 CHADHO CC(C)[C@H](CC(F)(F)F)[NH2+][C@H]1C[C@@H](N)c2ccccc21 ZINC000423054268 330166303 /nfs/dbraw/zinc/16/63/03/330166303.db2.gz BOGZQRJGEIKHHS-RDBSUJKOSA-N 1 3 286.341 3.698 20 0 CHADHO C[C@H](CCC[NH3+])N[C@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000423029397 330166366 /nfs/dbraw/zinc/16/63/66/330166366.db2.gz UZWWNFAJAKDGME-ZWNOBZJWSA-N 1 3 292.320 3.536 20 0 CHADHO Cc1cccc([C@@H](N[C@@H](C)CCCC[NH3+])c2ccccn2)c1 ZINC000423030779 330166380 /nfs/dbraw/zinc/16/63/80/330166380.db2.gz WHJKOLLKKVDUDX-QFBILLFUSA-N 1 3 297.446 3.587 20 0 CHADHO C[C@@H]([NH2+][C@H]1CCCNCC1)C1(c2ccccc2)CCCC1 ZINC000423045923 330166997 /nfs/dbraw/zinc/16/69/97/330166997.db2.gz CXMXIJNVCCMDEE-AEFFLSMTSA-N 1 3 286.463 3.619 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CC[C@@H](C)CC(C)(C)C ZINC000423059674 330167664 /nfs/dbraw/zinc/16/76/64/330167664.db2.gz MMVLGVAGHJNTLH-ZIAGYGMSSA-N 1 3 291.483 3.962 20 0 CHADHO Cc1ccccc1[C@H](CC(F)(F)F)N[C@H](C)CCC[NH3+] ZINC000423089074 330169171 /nfs/dbraw/zinc/16/91/71/330169171.db2.gz ROBIPKRABCADKC-OCCSQVGLSA-N 1 3 288.357 3.706 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H](C)CC1CCCCC1 ZINC000423087644 330169188 /nfs/dbraw/zinc/16/91/88/330169188.db2.gz ONSWYZSJDDFNPO-KBPBESRZSA-N 1 3 289.467 3.858 20 0 CHADHO N[C@H]1C[C@@H]([NH2+][C@H]2C[C@H](c3ccccc3F)C2)c2ccccc21 ZINC000423093536 330169410 /nfs/dbraw/zinc/16/94/10/330169410.db2.gz HXLUBQNQBWOBBM-BIPCEHGGSA-N 1 3 296.389 3.806 20 0 CHADHO CSc1ccc(CCN[C@@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000423094922 330169455 /nfs/dbraw/zinc/16/94/55/330169455.db2.gz KZNIJBJCTRZLSC-QZTJIDSGSA-N 1 3 298.455 3.685 20 0 CHADHO [NH3+][C@@H]1C[C@H](NCC2CC(c3ccccc3)C2)c2ccccc21 ZINC000423107183 330170490 /nfs/dbraw/zinc/17/04/90/330170490.db2.gz DQFDCCOOXNPNHH-YUNSAGIJSA-N 1 3 292.426 3.915 20 0 CHADHO Cc1c2cc(Cl)ccc2sc1CN[C@H](C)C1C[NH2+]C1 ZINC000423111429 330170954 /nfs/dbraw/zinc/17/09/54/330170954.db2.gz WUUCDRAELVESBP-SNVBAGLBSA-N 1 3 294.851 3.561 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](C)c1ccc(Oc2cccnc2)cc1 ZINC000423119883 330171046 /nfs/dbraw/zinc/17/10/46/330171046.db2.gz FRIVPTGNYBDXFK-ZNMIVQPWSA-N 1 3 299.418 3.650 20 0 CHADHO C[C@H](C[C@H]1CCCCC[NH2+]1)NCCc1cccc2[nH]ccc21 ZINC000423116841 330171162 /nfs/dbraw/zinc/17/11/62/330171162.db2.gz RSSFEDSJZFOZAD-NVXWUHKLSA-N 1 3 299.462 3.611 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NC[C@@H](c2ccccc2)C2CC2)c2ccccc21 ZINC000423123513 330171382 /nfs/dbraw/zinc/17/13/82/330171382.db2.gz FCCQLJYHHWJEHF-XUVXKRRUSA-N 1 3 292.426 3.915 20 0 CHADHO [NH3+][C@@H]1C[C@H](NC[C@H]2CCCCC(F)(F)C2)c2ccccc21 ZINC000423128134 330171493 /nfs/dbraw/zinc/17/14/93/330171493.db2.gz KFLUDEXVDIGROG-MAZHCROVSA-N 1 3 294.389 3.936 20 0 CHADHO CC(F)(F)c1ccc(C[NH2+][C@@H]2CCCCC[C@H]2N)cc1 ZINC000423127296 330171500 /nfs/dbraw/zinc/17/15/00/330171500.db2.gz BUGZWXFMFLAHQV-HUUCEWRRSA-N 1 3 282.378 3.548 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NCC2(C3CCC3)CCC2)c2ccccc21 ZINC000423162349 330173620 /nfs/dbraw/zinc/17/36/20/330173620.db2.gz KQWVDMLCBVYMQU-IAGOWNOFSA-N 1 3 270.420 3.691 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@@H]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000423170751 330174453 /nfs/dbraw/zinc/17/44/53/330174453.db2.gz YTHVIOLLRGOHFE-CAVOSLQRSA-N 1 3 280.843 3.692 20 0 CHADHO C[C@H](NCCC[NH3+])c1ccc(-c2ccccc2F)s1 ZINC000423185041 330175611 /nfs/dbraw/zinc/17/56/11/330175611.db2.gz UPJCLFPCXFPACH-NSHDSACASA-N 1 3 278.396 3.554 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@H](C)NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423212803 330178419 /nfs/dbraw/zinc/17/84/19/330178419.db2.gz KALZMWAFLCEBHU-UXGQPECPSA-N 1 3 292.854 3.705 20 0 CHADHO Clc1ccc2c(c1)[C@H](NC[C@@H]1CCC[NH2+]C1)CCCC2 ZINC000423221220 330179482 /nfs/dbraw/zinc/17/94/82/330179482.db2.gz ZJPOBPFXRJRIER-CXAGYDPISA-N 1 3 292.854 3.697 20 0 CHADHO CCC[C@@H](NCC[C@H](C)[NH3+])c1cccc(C(F)(F)F)c1 ZINC000423222684 330179878 /nfs/dbraw/zinc/17/98/78/330179878.db2.gz CCDCNBFPXJUGME-SMDDNHRTSA-N 1 3 288.357 3.874 20 0 CHADHO Cc1cc(OCCC[C@@H](C)[NH2+]CC[C@H](C)N)ccc1Cl ZINC000423224684 330180096 /nfs/dbraw/zinc/18/00/96/330180096.db2.gz JWEQKSJTXYAWGQ-UONOGXRCSA-N 1 3 298.858 3.523 20 0 CHADHO C[C@H]([NH3+])CCN[C@@H](C)c1cccc(-c2ccccc2)c1 ZINC000423225212 330180189 /nfs/dbraw/zinc/18/01/89/330180189.db2.gz LSZZTKBSEGSHGT-GJZGRUSLSA-N 1 3 268.404 3.742 20 0 CHADHO C[C@@H](NCC[C@H](C)[NH3+])c1ccc(-c2ccccc2)cc1 ZINC000423228880 330180698 /nfs/dbraw/zinc/18/06/98/330180698.db2.gz FRFBZEBRLLZSMS-LSDHHAIUSA-N 1 3 268.404 3.742 20 0 CHADHO Cc1ccsc1[C@@H](C)N[C@H](C[NH3+])C1CCCCC1 ZINC000423259164 330183469 /nfs/dbraw/zinc/18/34/69/330183469.db2.gz DDFYZWHWHORPCK-TZMCWYRMSA-N 1 3 266.454 3.615 20 0 CHADHO CC(C)[C@H](N)C[NH2+][C@@H](C)c1cc2ccccc2s1 ZINC000423262978 330183662 /nfs/dbraw/zinc/18/36/62/330183662.db2.gz ACUMTLDWJZLPRI-WCQYABFASA-N 1 3 262.422 3.535 20 0 CHADHO CSc1ccc([C@H](C)N[C@H]2CCCC[C@H]2C[NH3+])cc1F ZINC000423274150 330184633 /nfs/dbraw/zinc/18/46/33/330184633.db2.gz KCZMRJKCPDZCER-WHOFXGATSA-N 1 3 296.455 3.716 20 0 CHADHO C[C@H]1C[C@H](N[C@@H]2CCCC[C@H]2C[NH3+])c2ccsc2S1 ZINC000423277510 330185161 /nfs/dbraw/zinc/18/51/61/330185161.db2.gz OICFXBWNACDWCG-VTPLQMEGSA-N 1 3 296.505 3.781 20 0 CHADHO CC(C)[C@H]([NH3+])CN[C@@H]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000423279545 330185423 /nfs/dbraw/zinc/18/54/23/330185423.db2.gz SGWSRHMTUPRFRY-NUEKZKHPSA-N 1 3 280.843 3.549 20 0 CHADHO CCC[C@H](N[C@H]1CCCC[C@@H]1C[NH3+])c1ccsc1 ZINC000423279920 330185443 /nfs/dbraw/zinc/18/54/43/330185443.db2.gz SBZOYXAIKAJQJF-SNPRPXQTSA-N 1 3 266.454 3.696 20 0 CHADHO CC(C)[C@H]([NH3+])CN[C@@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000423278292 330185510 /nfs/dbraw/zinc/18/55/10/330185510.db2.gz QMWLRWCERZGDBR-NUEKZKHPSA-N 1 3 280.843 3.549 20 0 CHADHO C[C@H]([NH2+]CC(C)(C)N)c1cccc(-c2ccccc2)c1 ZINC000423288466 330186346 /nfs/dbraw/zinc/18/63/46/330186346.db2.gz SFOJHYDNOOIVAP-AWEZNQCLSA-N 1 3 268.404 3.742 20 0 CHADHO C[C@H]([NH2+]CC(C)(C)N)c1ccc(-c2ccc(F)cc2)s1 ZINC000423288876 330186561 /nfs/dbraw/zinc/18/65/61/330186561.db2.gz VMZMFXFGSFVRBO-NSHDSACASA-N 1 3 292.423 3.942 20 0 CHADHO CCC[C@@H]([NH2+]CC(N)(CC)CC)c1ccsc1 ZINC000423288727 330186637 /nfs/dbraw/zinc/18/66/37/330186637.db2.gz URFQMFSYCAMQLI-CYBMUJFWSA-N 1 3 254.443 3.696 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2c3cc(F)ccc3C[C@H]2C)cc1 ZINC000423291682 330187121 /nfs/dbraw/zinc/18/71/21/330187121.db2.gz JKVZRHSQFQWKIN-NQCMUKECSA-N 1 3 298.405 3.869 20 0 CHADHO CC(C)C[C@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccccn1 ZINC000423292016 330187550 /nfs/dbraw/zinc/18/75/50/330187550.db2.gz KYFDNBMGLRPEGK-KXBFYZLASA-N 1 3 297.446 3.978 20 0 CHADHO CCC([NH3+])(CC)CN[C@@H](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000423293700 330187925 /nfs/dbraw/zinc/18/79/25/330187925.db2.gz RZAKOJDFGAUVJK-OLZOCXBDSA-N 1 3 282.859 3.939 20 0 CHADHO CC[C@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccccc1OC ZINC000423296828 330188521 /nfs/dbraw/zinc/18/85/21/330188521.db2.gz ZZVWXQDHJZRTLS-KSSFIOAISA-N 1 3 298.430 3.956 20 0 CHADHO C[C@H](C[NH3+])CN[C@H](C)c1ccc(-c2cccs2)cc1 ZINC000423304392 330189254 /nfs/dbraw/zinc/18/92/54/330189254.db2.gz YPZFAIQQMCMXDE-CHWSQXEVSA-N 1 3 274.433 3.661 20 0 CHADHO C[C@@H](NC[C@@H](C)C[NH3+])c1ccc(-c2ccc(F)cc2)s1 ZINC000423304370 330189281 /nfs/dbraw/zinc/18/92/81/330189281.db2.gz YLSSJAATZJJAAR-NWDGAFQWSA-N 1 3 292.423 3.800 20 0 CHADHO C[C@H](CN)C[NH2+][C@@H]1CCC[C@H](c2ccc(Cl)cc2)C1 ZINC000423306551 330189321 /nfs/dbraw/zinc/18/93/21/330189321.db2.gz LTPODZDPOAKKRX-IVMMDQJWSA-N 1 3 280.843 3.551 20 0 CHADHO NC1(C[NH2+][C@H](Cc2ccccc2F)c2ccccc2)CCC1 ZINC000423317667 330190026 /nfs/dbraw/zinc/19/00/26/330190026.db2.gz CWPQTMCZQRUJJE-GOSISDBHSA-N 1 3 298.405 3.581 20 0 CHADHO NC1(C[NH2+][C@@H](CC2CC2)c2ccc(Cl)cc2)CCC1 ZINC000423324072 330190506 /nfs/dbraw/zinc/19/05/06/330190506.db2.gz KCMYDOTXBFWXPT-HNNXBMFYSA-N 1 3 278.827 3.652 20 0 CHADHO CC(C)[C@H](NCC1=CC[NH2+]CC1)c1ccc(Cl)cc1F ZINC000423334785 330191374 /nfs/dbraw/zinc/19/13/74/330191374.db2.gz FYOPXAHBPBHLMR-INIZCTEOSA-N 1 3 296.817 3.686 20 0 CHADHO C[C@@H](NCC1([NH3+])CCC1)C(c1ccccc1)c1ccccc1 ZINC000423336780 330191740 /nfs/dbraw/zinc/19/17/40/330191740.db2.gz VBKOEBPHCYRAQU-MRXNPFEDSA-N 1 3 294.442 3.678 20 0 CHADHO [NH3+]CCCCN[C@H]1CCCc2c(Cl)sc(Cl)c21 ZINC000423343991 330192271 /nfs/dbraw/zinc/19/22/71/330192271.db2.gz WOPOUSUTUSHMLB-VIFPVBQESA-N 1 3 293.263 3.761 20 0 CHADHO C[C@@H](NC[C@@]1(C)CCC[NH2+]C1)c1cc2c(s1)CCCC2 ZINC000423345330 330192349 /nfs/dbraw/zinc/19/23/49/330192349.db2.gz YTNMXPUZANEJAW-DYVFJYSZSA-N 1 3 292.492 3.667 20 0 CHADHO C[C@@H]([NH2+]C[C@@]1(C)CCCNC1)c1cc2c(s1)CCCC2 ZINC000423345330 330192350 /nfs/dbraw/zinc/19/23/50/330192350.db2.gz YTNMXPUZANEJAW-DYVFJYSZSA-N 1 3 292.492 3.667 20 0 CHADHO CC[C@H](NCC1=CC[NH2+]CC1)c1ccc(Cl)cc1Cl ZINC000423347573 330192572 /nfs/dbraw/zinc/19/25/72/330192572.db2.gz QQFBDNHQOYDUHJ-HNNXBMFYSA-N 1 3 299.245 3.954 20 0 CHADHO C[C@@H]1CC[C@H](NC[C@]2(C)CCC[NH2+]C2)c2sccc21 ZINC000423350148 330192768 /nfs/dbraw/zinc/19/27/68/330192768.db2.gz XBJVYHUUTURBNA-IVMMDQJWSA-N 1 3 278.465 3.666 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]C[C@]2(C)CCCNC2)c2sccc21 ZINC000423350148 330192769 /nfs/dbraw/zinc/19/27/69/330192769.db2.gz XBJVYHUUTURBNA-IVMMDQJWSA-N 1 3 278.465 3.666 20 0 CHADHO Clc1cccc([C@@H]2CCC[C@H](NC[C@@H]3CC[NH2+]C3)C2)c1 ZINC000423351870 330192783 /nfs/dbraw/zinc/19/27/83/330192783.db2.gz ZSLITBMRCFPXSN-UNEWFSDZSA-N 1 3 292.854 3.565 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)CCN1 ZINC000423363057 330193861 /nfs/dbraw/zinc/19/38/61/330193861.db2.gz AHCGVYIYKWSBBS-XFBWCDHKSA-N 1 3 278.827 3.521 20 0 CHADHO CCC[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccccc1 ZINC000423362333 330194033 /nfs/dbraw/zinc/19/40/33/330194033.db2.gz SRNNCVZTJAXIOY-LJQANCHMSA-N 1 3 280.415 3.921 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@@H](c3ccc(Cl)cc3)C2)C1 ZINC000423364895 330194218 /nfs/dbraw/zinc/19/42/18/330194218.db2.gz KBXDTZXRZKRABX-MXASKKJJSA-N 1 3 292.854 3.836 20 0 CHADHO CC[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccccc1 ZINC000423364393 330194429 /nfs/dbraw/zinc/19/44/29/330194429.db2.gz VVICATGUPMFXII-SFHVURJKSA-N 1 3 266.388 3.531 20 0 CHADHO CCC[C@H]([NH2+][C@H]1CCN[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000423365525 330194531 /nfs/dbraw/zinc/19/45/31/330194531.db2.gz BVTIPIIDXSCJCY-RCBQFDQVSA-N 1 3 280.843 3.911 20 0 CHADHO C[C@H](NCC[C@H]1CCC[NH2+]1)[C@@H](C)c1ccc(Cl)cc1 ZINC000423365918 330194701 /nfs/dbraw/zinc/19/47/01/330194701.db2.gz WXCJYTCXPLILFH-DVOMOZLQSA-N 1 3 280.843 3.564 20 0 CHADHO CCC[C@H]([NH2+][C@H]1CCN[C@H](C)C1)c1ccc(Cl)cc1 ZINC000423365522 330194704 /nfs/dbraw/zinc/19/47/04/330194704.db2.gz BVTIPIIDXSCJCY-KCXAZCMYSA-N 1 3 280.843 3.911 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H](CC2CC2)c2ccc(Cl)cc2)CCN1 ZINC000423367824 330194724 /nfs/dbraw/zinc/19/47/24/330194724.db2.gz AQPVXLBDOJAQDM-JLZZUVOBSA-N 1 3 292.854 3.911 20 0 CHADHO C[C@@H]1C[C@H](N[C@H](c2cccs2)C2CCCC2)CC[NH2+]1 ZINC000423369234 330194858 /nfs/dbraw/zinc/19/48/58/330194858.db2.gz FTSQQYYJZOQNRZ-XPKDYRNWSA-N 1 3 278.465 3.710 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H](c2cccs2)C2CCCC2)CCN1 ZINC000423369234 330194860 /nfs/dbraw/zinc/19/48/60/330194860.db2.gz FTSQQYYJZOQNRZ-XPKDYRNWSA-N 1 3 278.465 3.710 20 0 CHADHO Cc1cc(C)c([C@H](C)N[C@@H]2CCC[C@@H]([NH3+])C2)cc1C ZINC000423372092 330195182 /nfs/dbraw/zinc/19/51/82/330195182.db2.gz GTDVSWLAURWAAA-ARFHVFGLSA-N 1 3 260.425 3.532 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1ccc2ccccc2c1 ZINC000423372764 330195317 /nfs/dbraw/zinc/19/53/17/330195317.db2.gz ITGJSFDGAYFCKR-QWQRMKEZSA-N 1 3 268.404 3.631 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CCN[C@H](C)C1)[C@@H](C)c1ccc(Cl)cc1 ZINC000423371315 330195339 /nfs/dbraw/zinc/19/53/39/330195339.db2.gz FJBKJGVCICUFBS-BRXULGCHSA-N 1 3 280.843 3.562 20 0 CHADHO C[C@@H](N[C@@H]1CC[NH2+][C@H](C)C1)[C@@H](C)c1ccc(Cl)cc1 ZINC000423371315 330195340 /nfs/dbraw/zinc/19/53/40/330195340.db2.gz FJBKJGVCICUFBS-BRXULGCHSA-N 1 3 280.843 3.562 20 0 CHADHO COc1ccc2cc([C@H](C)N[C@@H]3CCC[C@@H]([NH3+])C3)ccc2c1 ZINC000423372114 330195366 /nfs/dbraw/zinc/19/53/66/330195366.db2.gz GTPKJCNDXPTUJZ-MORSLUCNSA-N 1 3 298.430 3.769 20 0 CHADHO CC(C)[C@H](CCc1ccccc1)[NH2+][C@H]1CCC[C@H](N)C1 ZINC000423372208 330195375 /nfs/dbraw/zinc/19/53/75/330195375.db2.gz GXDOVDXIJDPDOV-BZSNNMDCSA-N 1 3 274.452 3.503 20 0 CHADHO CC(C)C1CCC([NH2+]Cc2ccc3c(c2)CNC3)CC1 ZINC000423373649 330195691 /nfs/dbraw/zinc/19/56/91/330195691.db2.gz HXMHRBNWOCBWQI-UHFFFAOYSA-N 1 3 272.436 3.594 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@H]1N[C@H](CC1CCC1)c1ccccc1 ZINC000423397932 330195809 /nfs/dbraw/zinc/19/58/09/330195809.db2.gz OOWXPBDBHJYIEM-ZTFGCOKTSA-N 1 3 272.436 3.506 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@H](CC1CCC1)c1ccccc1 ZINC000423397932 330195810 /nfs/dbraw/zinc/19/58/10/330195810.db2.gz OOWXPBDBHJYIEM-ZTFGCOKTSA-N 1 3 272.436 3.506 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@@H](N)C1)C1(c2ccccc2)CCCC1 ZINC000423400458 330195922 /nfs/dbraw/zinc/19/59/22/330195922.db2.gz VKUPJTBWTMQVSO-CGTJXYLNSA-N 1 3 286.463 3.746 20 0 CHADHO Cc1ccc2c(c1)[C@@H](NCc1ccc3c(c1)C[NH2+]C3)CCC2 ZINC000423402149 330196339 /nfs/dbraw/zinc/19/63/39/330196339.db2.gz WHBYVSBLSSJUAS-FQEVSTJZSA-N 1 3 292.426 3.765 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@@H]([NH3+])C1)c1cc2c(s1)CCCC2 ZINC000423402986 330196369 /nfs/dbraw/zinc/19/63/69/330196369.db2.gz WWSJCJJYOIPZPQ-IACUBPJLSA-N 1 3 278.465 3.547 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1ccc(F)c2ccccc21 ZINC000423374741 330198752 /nfs/dbraw/zinc/19/87/52/330198752.db2.gz IHLSJPWDBMJSIQ-MGPQQGTHSA-N 1 3 286.394 3.770 20 0 CHADHO CC(C)c1ccc([C@@H](C)[NH2+][C@@H]2CCN[C@H](C)C2)cc1 ZINC000423378082 330198934 /nfs/dbraw/zinc/19/89/34/330198934.db2.gz MDWMTDFVOAXDIY-CKEIUWERSA-N 1 3 260.425 3.601 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)CCN1 ZINC000423377881 330198942 /nfs/dbraw/zinc/19/89/42/330198942.db2.gz KPXZYHZAQWMCLB-DQYPLSBCSA-N 1 3 292.854 3.911 20 0 CHADHO C[C@@H]([NH2+]Cc1ccc2c(c1)CNC2)[C@H](C)c1ccccc1 ZINC000423383049 330199232 /nfs/dbraw/zinc/19/92/32/330199232.db2.gz KHUNFVNJBAIWJZ-LSDHHAIUSA-N 1 3 280.415 3.572 20 0 CHADHO CCCC[C@H](N[C@@H]1CC[NH2+]C[C@H]1C)c1ccccc1 ZINC000423384490 330199746 /nfs/dbraw/zinc/19/97/46/330199746.db2.gz GAAXVVPWWHYOFI-OIISXLGYSA-N 1 3 260.425 3.506 20 0 CHADHO CCCC[C@H]([NH2+][C@@H]1CCNC[C@H]1C)c1ccccc1 ZINC000423384490 330199747 /nfs/dbraw/zinc/19/97/47/330199747.db2.gz GAAXVVPWWHYOFI-OIISXLGYSA-N 1 3 260.425 3.506 20 0 CHADHO CCCCOc1ccc([C@H](C)[NH2+][C@H]2CCNC[C@@H]2C)cc1 ZINC000423392702 330200557 /nfs/dbraw/zinc/20/05/57/330200557.db2.gz LTMVCKVZZBXQKR-MPGHIAIKSA-N 1 3 290.451 3.514 20 0 CHADHO Cc1nc(C(C)(C)C)sc1[C@H](C)N[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423395082 330200957 /nfs/dbraw/zinc/20/09/57/330200957.db2.gz RRGSBHDTGNMNCM-CYZMBNFOSA-N 1 3 295.496 3.670 20 0 CHADHO CC(C)[C@H](N[C@@H]1CCC[C@@H]([NH3+])C1)c1cc2ccccc2o1 ZINC000423395159 330201042 /nfs/dbraw/zinc/20/10/42/330201042.db2.gz RTHQZLVHUIAJHX-RKVPGOIHSA-N 1 3 286.419 3.989 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)c1ccc(-c2cccs2)cc1)[C@H](C)N ZINC000423452735 330203170 /nfs/dbraw/zinc/20/31/70/330203170.db2.gz WTONFGYPPBEIPB-XQQFMLRXSA-N 1 3 274.433 3.801 20 0 CHADHO CC[C@H]([NH2+][C@@H](C)[C@@H](C)N)c1ccc(Cl)c(Cl)c1 ZINC000423454763 330203378 /nfs/dbraw/zinc/20/33/78/330203378.db2.gz ZNQHNWFFUQZVJR-ZDMBXUJBSA-N 1 3 275.223 3.770 20 0 CHADHO CC[C@@H](N)C[NH2+][C@H](C)c1cccc(OCc2ccccc2)c1 ZINC000423464620 330204203 /nfs/dbraw/zinc/20/42/03/330204203.db2.gz MHXCPOFPSKHZST-CRAIPNDOSA-N 1 3 298.430 3.654 20 0 CHADHO C[C@H](N)[C@H](C)[NH2+][C@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423468581 330204794 /nfs/dbraw/zinc/20/47/94/330204794.db2.gz ONTPAOMUJRKMFI-ZIBATOQPSA-N 1 3 266.816 3.507 20 0 CHADHO C[C@@H]([NH2+][C@H](CC1CC1)c1ccc(Cl)cc1)[C@H](C)N ZINC000423468576 330204832 /nfs/dbraw/zinc/20/48/32/330204832.db2.gz ONTPAOMUJRKMFI-FIXISWKDSA-N 1 3 266.816 3.507 20 0 CHADHO C[C@@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1CCC1)[C@H](C)N ZINC000423471633 330205207 /nfs/dbraw/zinc/20/52/07/330205207.db2.gz PSXHCDIXZMDBLC-FIXISWKDSA-N 1 3 266.816 3.507 20 0 CHADHO CC[C@@H](N)C[NH2+][C@H](C)c1ccc(-c2cccs2)cc1 ZINC000423484755 330206531 /nfs/dbraw/zinc/20/65/31/330206531.db2.gz YWVLGMQJCRQDQS-IUODEOHRSA-N 1 3 274.433 3.803 20 0 CHADHO Cc1ccnc([C@@H](C)N[C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000423501355 330208380 /nfs/dbraw/zinc/20/83/80/330208380.db2.gz CRKHJYQYLJMZFB-WBVHZDCISA-N 1 3 283.419 3.521 20 0 CHADHO C[C@H](NCCC1=CC[NH2+]CC1)c1ccc(Cl)cc1Cl ZINC000423544353 330211434 /nfs/dbraw/zinc/21/14/34/330211434.db2.gz CPNQSFAKTIHFNO-NSHDSACASA-N 1 3 299.245 3.954 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1)[C@@H]1C[C@H]1C1CC1 ZINC000527691048 330279240 /nfs/dbraw/zinc/27/92/40/330279240.db2.gz KRPASNXYEMJJRW-NNYOOSKESA-N 1 3 290.495 3.664 20 0 CHADHO Cc1cccc([C@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)C(C)C)c1 ZINC000527905882 330290130 /nfs/dbraw/zinc/29/01/30/330290130.db2.gz RRODKXPNHVBCQM-XVLXNVKGSA-N 1 3 286.463 3.907 20 0 CHADHO Cc1cccc([C@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)C(C)C)c1 ZINC000527905882 330290131 /nfs/dbraw/zinc/29/01/31/330290131.db2.gz RRODKXPNHVBCQM-XVLXNVKGSA-N 1 3 286.463 3.907 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+]C1CC(c2ccccc2)C1 ZINC000036840386 330291978 /nfs/dbraw/zinc/29/19/78/330291978.db2.gz WIOGACNMNSUSDK-IPJUCJBFSA-N 1 3 286.463 3.787 20 0 CHADHO C[C@@H]1CCCC[N@@H+]1CCCNC1CC(c2ccccc2)C1 ZINC000036840386 330291979 /nfs/dbraw/zinc/29/19/79/330291979.db2.gz WIOGACNMNSUSDK-IPJUCJBFSA-N 1 3 286.463 3.787 20 0 CHADHO C[C@@H]1CCCC[N@H+]1CCCNC1CC(c2ccccc2)C1 ZINC000036840386 330291980 /nfs/dbraw/zinc/29/19/80/330291980.db2.gz WIOGACNMNSUSDK-IPJUCJBFSA-N 1 3 286.463 3.787 20 0 CHADHO C[C@H]1CCCC[C@H]1N1CCC([NH2+]CC2CC=CC2)CC1 ZINC000527947295 330294353 /nfs/dbraw/zinc/29/43/53/330294353.db2.gz YAZDJDHGQZOWKM-MAUKXSAKSA-N 1 3 276.468 3.585 20 0 CHADHO Cc1cc(C)c([C@@H](C)NC[C@H]2CCC[N@H+](C)C2)cc1C ZINC000044534201 330329687 /nfs/dbraw/zinc/32/96/87/330329687.db2.gz BZCDDUFVZXAZQB-IAGOWNOFSA-N 1 3 274.452 3.604 20 0 CHADHO Cc1cc(C)c([C@@H](C)NC[C@H]2CCC[N@@H+](C)C2)cc1C ZINC000044534201 330329688 /nfs/dbraw/zinc/32/96/88/330329688.db2.gz BZCDDUFVZXAZQB-IAGOWNOFSA-N 1 3 274.452 3.604 20 0 CHADHO C[C@H](NCCCC[NH+](C)C)c1cc(Cl)ccc1Cl ZINC000045663112 330347552 /nfs/dbraw/zinc/34/75/52/330347552.db2.gz JNPBRLBIGRZFQS-NSHDSACASA-N 1 3 289.250 3.986 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1ccc(Cl)c(F)c1 ZINC000212706920 330367100 /nfs/dbraw/zinc/36/71/00/330367100.db2.gz VSHSALITIJWGSH-RYUDHWBXSA-N 1 3 296.817 3.614 20 0 CHADHO C[C@@H]1CC(C)(C)C[C@H]1[NH2+]Cc1cccc(CN(C)C)c1 ZINC000434778797 330645086 /nfs/dbraw/zinc/64/50/86/330645086.db2.gz XXIDGQPTEVACBI-RHSMWYFYSA-N 1 3 274.452 3.663 20 0 CHADHO Cc1cc(CN2CCC(CCC[NH+](C)C)CC2)cs1 ZINC000449033184 330894092 /nfs/dbraw/zinc/89/40/92/330894092.db2.gz YUQJAAGGPFAYGA-UHFFFAOYSA-N 1 3 280.481 3.610 20 0 CHADHO CN(C)[C@@H]1CCC[N@H+](CC/C=C\c2ccccc2)CC1 ZINC000450853324 331003001 /nfs/dbraw/zinc/00/30/01/331003001.db2.gz HKXRDUDUPGMSON-HJLMUGLJSA-N 1 3 272.436 3.506 20 0 CHADHO CN(C)[C@@H]1CCC[N@@H+](CC/C=C\c2ccccc2)CC1 ZINC000450853324 331003002 /nfs/dbraw/zinc/00/30/02/331003002.db2.gz HKXRDUDUPGMSON-HJLMUGLJSA-N 1 3 272.436 3.506 20 0 CHADHO C[NH+](C)[C@@H]1CCCN(CC/C=C\c2ccccc2)CC1 ZINC000450853324 331003003 /nfs/dbraw/zinc/00/30/03/331003003.db2.gz HKXRDUDUPGMSON-HJLMUGLJSA-N 1 3 272.436 3.506 20 0 CHADHO C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)N1CC[C@@H]1CCC[N@@H+]1C ZINC000451146909 331017512 /nfs/dbraw/zinc/01/75/12/331017512.db2.gz NJGWJOHXQILRAM-CRWXNKLISA-N 1 3 292.389 3.522 20 0 CHADHO C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)N1CC[C@@H]1CCC[N@H+]1C ZINC000451146909 331017513 /nfs/dbraw/zinc/01/75/13/331017513.db2.gz NJGWJOHXQILRAM-CRWXNKLISA-N 1 3 292.389 3.522 20 0 CHADHO CCC1([NH2+]C2CCN([C@@H]3CCC[C@H](C)C3)CC2)CC1 ZINC000453277546 331110164 /nfs/dbraw/zinc/11/01/64/331110164.db2.gz DKRRQWZYQNGAJV-GOEBONIOSA-N 1 3 264.457 3.562 20 0 CHADHO CCC1(NC2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)CC1 ZINC000453277546 331110165 /nfs/dbraw/zinc/11/01/65/331110165.db2.gz DKRRQWZYQNGAJV-GOEBONIOSA-N 1 3 264.457 3.562 20 0 CHADHO CC/C=C/CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000453317464 331115683 /nfs/dbraw/zinc/11/56/83/331115683.db2.gz KSWKDQZITLHNKO-BKZWIDLJSA-N 1 3 284.447 3.738 20 0 CHADHO CC/C=C/CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000453317464 331115684 /nfs/dbraw/zinc/11/56/84/331115684.db2.gz KSWKDQZITLHNKO-BKZWIDLJSA-N 1 3 284.447 3.738 20 0 CHADHO c1ccc([C@@H]2C[C@H]2C[NH2+]C2CCN(C3CCCC3)CC2)cc1 ZINC000459427212 331280877 /nfs/dbraw/zinc/28/08/77/331280877.db2.gz AVTKGJNEYDMLCU-PXNSSMCTSA-N 1 3 298.474 3.787 20 0 CHADHO c1ccc([C@@H]2C[C@H]2CNC2CC[NH+](C3CCCC3)CC2)cc1 ZINC000459427212 331280878 /nfs/dbraw/zinc/28/08/78/331280878.db2.gz AVTKGJNEYDMLCU-PXNSSMCTSA-N 1 3 298.474 3.787 20 0 CHADHO c1cc(C2CC2)ccc1C[NH2+]C1CC(N2CCCCC2)C1 ZINC000459534872 331286428 /nfs/dbraw/zinc/28/64/28/331286428.db2.gz VCSFAOGBSWQEQO-UHFFFAOYSA-N 1 3 284.447 3.671 20 0 CHADHO Cc1cc(F)c(CNCCCC[N@@H+](C)C2CC2)c(Cl)c1 ZINC000459601135 331290221 /nfs/dbraw/zinc/29/02/21/331290221.db2.gz WHIXHTFAWKZSKN-UHFFFAOYSA-N 1 3 298.833 3.752 20 0 CHADHO Cc1cc(F)c(CNCCCC[N@H+](C)C2CC2)c(Cl)c1 ZINC000459601135 331290222 /nfs/dbraw/zinc/29/02/22/331290222.db2.gz WHIXHTFAWKZSKN-UHFFFAOYSA-N 1 3 298.833 3.752 20 0 CHADHO CCCN(CCC)CCC[NH2+][C@@H]1CCC[C@H](C)C1 ZINC000462776494 331328447 /nfs/dbraw/zinc/32/84/47/331328447.db2.gz SNTAYEQQXFBNHD-JKSUJKDBSA-N 1 3 254.462 3.667 20 0 CHADHO C[C@H](CCc1ccsc1)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000462799990 331329635 /nfs/dbraw/zinc/32/96/35/331329635.db2.gz AJGXPIATBBNSJG-CYBMUJFWSA-N 1 3 294.508 3.968 20 0 CHADHO C[C@H](CCc1ccsc1)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000462799990 331329636 /nfs/dbraw/zinc/32/96/36/331329636.db2.gz AJGXPIATBBNSJG-CYBMUJFWSA-N 1 3 294.508 3.968 20 0 CHADHO C[C@H](CCCC(F)(F)F)[NH2+][C@H]1CCC[C@H](N(C)C)C1 ZINC000480173759 331761381 /nfs/dbraw/zinc/76/13/81/331761381.db2.gz XDFZPRPBBCSDLV-AGIUHOORSA-N 1 3 280.378 3.570 20 0 CHADHO CC(C)C[NH+]1CCC(N[C@H]2CS[C@@H](C(C)(C)C)C2)CC1 ZINC000488429056 332007286 /nfs/dbraw/zinc/00/72/86/332007286.db2.gz IJQJISPOGAMWMU-HZPDHXFCSA-N 1 3 298.540 3.617 20 0 CHADHO CC(C)(C)[C@H]1C[C@@H](NC2CC[NH+](C(C)(C)C)CC2)CS1 ZINC000488456025 332010744 /nfs/dbraw/zinc/01/07/44/332010744.db2.gz FZXBJFTXASWXRX-HUUCEWRRSA-N 1 3 298.540 3.759 20 0 CHADHO Cc1ccc(F)cc1CN1CCC(CCC[NH+](C)C)CC1 ZINC000490394845 332088149 /nfs/dbraw/zinc/08/81/49/332088149.db2.gz ATOFJYISANAKMQ-UHFFFAOYSA-N 1 3 292.442 3.688 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCc1cccc(-c2ccccc2)c1 ZINC000575749202 335111802 /nfs/dbraw/zinc/11/18/02/335111802.db2.gz NIXZPZFJVHWBNH-HUUCEWRRSA-N 1 3 268.404 3.569 20 0 CHADHO CC(C)=CCN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000248825472 334318394 /nfs/dbraw/zinc/31/83/94/334318394.db2.gz GAMTZDKQQDQSDI-LDLYASANSA-N 1 3 284.447 3.738 20 0 CHADHO CC(C)=CCN[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000248825472 334318396 /nfs/dbraw/zinc/31/83/96/334318396.db2.gz GAMTZDKQQDQSDI-LDLYASANSA-N 1 3 284.447 3.738 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1)C1CC1 ZINC000310019497 333053054 /nfs/dbraw/zinc/05/30/54/333053054.db2.gz QLXWCOULYWROTP-SJLPKXTDSA-N 1 3 286.463 3.677 20 0 CHADHO C[C@H](NCc1ccc(C[NH+](C)C)cc1)c1ccsc1 ZINC000178382859 333071937 /nfs/dbraw/zinc/07/19/37/333071937.db2.gz UZJXQECQGHHPED-ZDUSSCGKSA-N 1 3 274.433 3.661 20 0 CHADHO Cc1cccc([C@H](C)[NH2+]CCCN2CCCC[C@H]2C)c1 ZINC000312051832 333076070 /nfs/dbraw/zinc/07/60/70/333076070.db2.gz STIGOBVCIFICMA-SJORKVTESA-N 1 3 274.452 3.910 20 0 CHADHO C[C@H](N[C@@H]1CCc2ccccc21)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183185139 333119514 /nfs/dbraw/zinc/11/95/14/333119514.db2.gz IBMJUXDJSANWFL-RIFZZMRRSA-N 1 3 298.474 3.917 20 0 CHADHO C[C@H](N[C@@H]1CCc2ccccc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000183185139 333119515 /nfs/dbraw/zinc/11/95/15/333119515.db2.gz IBMJUXDJSANWFL-RIFZZMRRSA-N 1 3 298.474 3.917 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCc2ccccc21)[C@H]1CCCN(C2CCC2)C1 ZINC000183185139 333119516 /nfs/dbraw/zinc/11/95/16/333119516.db2.gz IBMJUXDJSANWFL-RIFZZMRRSA-N 1 3 298.474 3.917 20 0 CHADHO CC[N@H+](C)C[C@H]1CCN(c2c(C)cnc3c(C)cccc32)C1 ZINC000185330895 333138628 /nfs/dbraw/zinc/13/86/28/333138628.db2.gz ZQBMTJPFSDVJDV-MRXNPFEDSA-N 1 3 297.446 3.630 20 0 CHADHO CC[N@@H+](C)C[C@H]1CCN(c2c(C)cnc3c(C)cccc32)C1 ZINC000185330895 333138629 /nfs/dbraw/zinc/13/86/29/333138629.db2.gz ZQBMTJPFSDVJDV-MRXNPFEDSA-N 1 3 297.446 3.630 20 0 CHADHO CCC[NH+]1CCC(CN[C@H](C)c2sccc2OC)CC1 ZINC000186153069 333155797 /nfs/dbraw/zinc/15/57/97/333155797.db2.gz MKCMESJEAQITJQ-CYBMUJFWSA-N 1 3 296.480 3.529 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+][C@@H]2CCC23CCCC3)C1 ZINC000189178448 333183734 /nfs/dbraw/zinc/18/37/34/333183734.db2.gz ULUBGNVEPUJOCT-IAGOWNOFSA-N 1 3 278.484 3.667 20 0 CHADHO CCCc1ccc([C@H](C)N[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000222930692 333202298 /nfs/dbraw/zinc/20/22/98/333202298.db2.gz QFXNHEVRGWYZHL-MPGHIAIKSA-N 1 3 274.452 3.772 20 0 CHADHO CCCc1ccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000222930692 333202299 /nfs/dbraw/zinc/20/22/99/333202299.db2.gz QFXNHEVRGWYZHL-MPGHIAIKSA-N 1 3 274.452 3.772 20 0 CHADHO CC(C)[C@@H]([NH2+]CCCN(C)C(C)C)c1ccccc1 ZINC000223025040 333203530 /nfs/dbraw/zinc/20/35/30/333203530.db2.gz FKJWLTKZBVJMPV-QGZVFWFLSA-N 1 3 262.441 3.704 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H](CC2CC2)c2ccccc2)C1 ZINC000575850824 335123547 /nfs/dbraw/zinc/12/35/47/335123547.db2.gz OUJIQYLUJKPCQI-IEBWSBKVSA-N 1 3 286.463 3.849 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H](CC2CC2)c2ccccc2)C1 ZINC000575850824 335123548 /nfs/dbraw/zinc/12/35/48/335123548.db2.gz OUJIQYLUJKPCQI-IEBWSBKVSA-N 1 3 286.463 3.849 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](CC2CC2)c2ccccc2)C1 ZINC000575850824 335123549 /nfs/dbraw/zinc/12/35/49/335123549.db2.gz OUJIQYLUJKPCQI-IEBWSBKVSA-N 1 3 286.463 3.849 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@@H](CC2CC2)c2ccccc2)C1 ZINC000575850823 335123586 /nfs/dbraw/zinc/12/35/86/335123586.db2.gz OUJIQYLUJKPCQI-HKUYNNGSSA-N 1 3 286.463 3.849 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@@H](CC2CC2)c2ccccc2)C1 ZINC000575850823 335123588 /nfs/dbraw/zinc/12/35/88/335123588.db2.gz OUJIQYLUJKPCQI-HKUYNNGSSA-N 1 3 286.463 3.849 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H](CC2CC2)c2ccccc2)C1 ZINC000575850823 335123589 /nfs/dbraw/zinc/12/35/89/335123589.db2.gz OUJIQYLUJKPCQI-HKUYNNGSSA-N 1 3 286.463 3.849 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](c2cccs2)C2CCCC2)C1 ZINC000226918745 333272082 /nfs/dbraw/zinc/27/20/82/333272082.db2.gz SZAUIFLXOZCTFI-PBHICJAKSA-N 1 3 292.492 3.911 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](c2cccs2)C2CCCC2)C1 ZINC000226918745 333272083 /nfs/dbraw/zinc/27/20/83/333272083.db2.gz SZAUIFLXOZCTFI-PBHICJAKSA-N 1 3 292.492 3.911 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](c2cccs2)C2CCCC2)C1 ZINC000226918745 333272084 /nfs/dbraw/zinc/27/20/84/333272084.db2.gz SZAUIFLXOZCTFI-PBHICJAKSA-N 1 3 292.492 3.911 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CCC[C@H]([C@H](C)[NH3+])C2)cc1 ZINC000227183782 333277584 /nfs/dbraw/zinc/27/75/84/333277584.db2.gz PMZCRRSZHVWILH-MPGHIAIKSA-N 1 3 274.452 3.930 20 0 CHADHO CN(C)CC[C@@H]([NH2+]Cc1ccccc1Cl)C(C)(C)C ZINC000523863174 333348575 /nfs/dbraw/zinc/34/85/75/333348575.db2.gz KURJSFKDTKSSSE-OAHLLOKOSA-N 1 3 282.859 3.796 20 0 CHADHO C/C(=C\c1ccccc1)C[NH2+]Cc1cccc(CN(C)C)c1 ZINC000237058372 333377395 /nfs/dbraw/zinc/37/73/95/333377395.db2.gz KFDLHDFONDJBGD-SFQUDFHCSA-N 1 3 294.442 3.941 20 0 CHADHO C(=C/c1ccccc1)\CN1CCC(C[NH+]2CCCC2)CC1 ZINC000127165407 333622032 /nfs/dbraw/zinc/62/20/32/333622032.db2.gz CQALNYYYLXDLMJ-RMKNXTFCSA-N 1 3 284.447 3.508 20 0 CHADHO CC[NH+]1CCC(CCNCc2ccc([C@H]3C[C@@H]3C)o2)CC1 ZINC000174551778 335158678 /nfs/dbraw/zinc/15/86/78/335158678.db2.gz CJLUQDQKMVRIDI-YOEHRIQHSA-N 1 3 290.451 3.615 20 0 CHADHO Fc1cc(Cl)ccc1CNCCCCC[NH+]1CCCC1 ZINC000549868531 334207750 /nfs/dbraw/zinc/20/77/50/334207750.db2.gz YEJWRRIHWWUVOF-UHFFFAOYSA-N 1 3 298.833 3.835 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H]2CCc3cc(Cl)ccc32)C1 ZINC000246996366 334273559 /nfs/dbraw/zinc/27/35/59/334273559.db2.gz KLAHBVARYCKHHI-GUYCJALGSA-N 1 3 292.854 3.649 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@H](C)c2ccc(C)cc2C)C1 ZINC000247000390 334273781 /nfs/dbraw/zinc/27/37/81/334273781.db2.gz KRFGQEGXPQBAGA-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@H](C)c2ccc(C)cc2C)C1 ZINC000247000390 334273782 /nfs/dbraw/zinc/27/37/82/334273782.db2.gz KRFGQEGXPQBAGA-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](C)c2ccc(C)cc2C)C1 ZINC000247000390 334273783 /nfs/dbraw/zinc/27/37/83/334273783.db2.gz KRFGQEGXPQBAGA-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1cccs1 ZINC000247070330 334274951 /nfs/dbraw/zinc/27/49/51/334274951.db2.gz MYSIJURSYBYKMM-MCIONIFRSA-N 1 3 266.454 3.662 20 0 CHADHO CCC[C@H](C)[C@@H](CC)[NH2+]C[C@H]1CCN(CCC)C1 ZINC000247097436 334275642 /nfs/dbraw/zinc/27/56/42/334275642.db2.gz PVDFKXUILUNPKZ-ARFHVFGLSA-N 1 3 254.462 3.523 20 0 CHADHO C(CN1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)C1CCCC1 ZINC000246421043 334257072 /nfs/dbraw/zinc/25/70/72/334257072.db2.gz CCDMWHARMYHVBR-WMZOPIPTSA-N 1 3 276.468 3.515 20 0 CHADHO C(CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)C1CCCC1 ZINC000246421043 334257074 /nfs/dbraw/zinc/25/70/74/334257074.db2.gz CCDMWHARMYHVBR-WMZOPIPTSA-N 1 3 276.468 3.515 20 0 CHADHO COc1cccc([C@@H](C)[N@H+](C)CC[C@H]2CCCCN2C)c1 ZINC000246471395 334259199 /nfs/dbraw/zinc/25/91/99/334259199.db2.gz GVYUFSDKAQNGDD-NVXWUHKLSA-N 1 3 290.451 3.562 20 0 CHADHO COc1cccc([C@@H](C)[N@@H+](C)CC[C@H]2CCCCN2C)c1 ZINC000246471395 334259200 /nfs/dbraw/zinc/25/92/00/334259200.db2.gz GVYUFSDKAQNGDD-NVXWUHKLSA-N 1 3 290.451 3.562 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](C)c2ccc(CC)s2)C1 ZINC000247228455 334277652 /nfs/dbraw/zinc/27/76/52/334277652.db2.gz YDANFCZREMPYLR-ZIAGYGMSSA-N 1 3 280.481 3.693 20 0 CHADHO C[C@H](CN1CC[C@@H](C[NH+]2CCCCC2)C1)c1ccccc1 ZINC000247249385 334278236 /nfs/dbraw/zinc/27/82/36/334278236.db2.gz DVKPGHKEZDFGLP-MSOLQXFVSA-N 1 3 286.463 3.598 20 0 CHADHO C[C@H](C[N@@H+]1CC[C@@H](CN2CCCCC2)C1)c1ccccc1 ZINC000247249385 334278237 /nfs/dbraw/zinc/27/82/37/334278237.db2.gz DVKPGHKEZDFGLP-MSOLQXFVSA-N 1 3 286.463 3.598 20 0 CHADHO C[C@H](C[N@H+]1CC[C@@H](CN2CCCCC2)C1)c1ccccc1 ZINC000247249385 334278238 /nfs/dbraw/zinc/27/82/38/334278238.db2.gz DVKPGHKEZDFGLP-MSOLQXFVSA-N 1 3 286.463 3.598 20 0 CHADHO Cc1c[nH+]ccc1N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000248666547 334312272 /nfs/dbraw/zinc/31/22/72/334312272.db2.gz OEPSFQIUQNBUPY-FUHWJXTLSA-N 1 3 295.430 3.855 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H]2CC(C)(C)C[C@H]2C)C1 ZINC000248858809 334319978 /nfs/dbraw/zinc/31/99/78/334319978.db2.gz LSBLBWSLDWCSGE-BZUAXINKSA-N 1 3 266.473 3.521 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](C)c2cc(C)c(C)cc2C)C1 ZINC000249382059 334332863 /nfs/dbraw/zinc/33/28/63/334332863.db2.gz TXXDJRJBDZNRTP-IAGOWNOFSA-N 1 3 274.452 3.604 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](C)c2cc(C)c(C)cc2C)C1 ZINC000249382059 334332864 /nfs/dbraw/zinc/33/28/64/334332864.db2.gz TXXDJRJBDZNRTP-IAGOWNOFSA-N 1 3 274.452 3.604 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](C)c2cc(C)c(C)cc2C)C1 ZINC000249382059 334332866 /nfs/dbraw/zinc/33/28/66/334332866.db2.gz TXXDJRJBDZNRTP-IAGOWNOFSA-N 1 3 274.452 3.604 20 0 CHADHO CC(C)[C@H](N[C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(F)c(F)c1 ZINC000552580090 334337470 /nfs/dbraw/zinc/33/74/70/334337470.db2.gz PJGKDHJRSZDOFX-JDFRZJQESA-N 1 3 296.405 3.734 20 0 CHADHO CC(C)[C@H](N[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(F)c(F)c1 ZINC000552580090 334337472 /nfs/dbraw/zinc/33/74/72/334337472.db2.gz PJGKDHJRSZDOFX-JDFRZJQESA-N 1 3 296.405 3.734 20 0 CHADHO CC(C)Oc1ccc([C@H](C)N[C@H]2CCCC[C@H]2C[NH3+])cc1 ZINC000250575042 334346321 /nfs/dbraw/zinc/34/63/21/334346321.db2.gz CUSJNQFUNFFBDC-ZVZYQTTQSA-N 1 3 290.451 3.642 20 0 CHADHO C[C@@H](c1ccccc1Cl)N(C)CC[C@H]1CCC[NH2+]C1 ZINC000251598193 334365308 /nfs/dbraw/zinc/36/53/08/334365308.db2.gz YSPNCVMOIQEYPU-UONOGXRCSA-N 1 3 280.843 3.723 20 0 CHADHO CC(C)(CC[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCCN1)C1CC1 ZINC000262143937 334532840 /nfs/dbraw/zinc/53/28/40/334532840.db2.gz FHKHTYNKGHXZNR-BRWVUGGUSA-N 1 3 278.484 3.713 20 0 CHADHO [NH3+]CCC1CCN(Cc2c(Cl)oc3ccccc32)CC1 ZINC000576709901 335238335 /nfs/dbraw/zinc/23/83/35/335238335.db2.gz XGYFNQKNROAZNC-UHFFFAOYSA-N 1 3 292.810 3.647 20 0 CHADHO C[NH+]1CCC([C@@H]2CCN(Cc3sccc3Cl)C2)CC1 ZINC000581098975 336008132 /nfs/dbraw/zinc/00/81/32/336008132.db2.gz HARYAISNUAKQMQ-CYBMUJFWSA-N 1 3 298.883 3.565 20 0 CHADHO CCCC1CCC(C[NH2+]C[C@@H]2CCN(C(C)C)C2)CC1 ZINC000581386344 336066594 /nfs/dbraw/zinc/06/65/94/336066594.db2.gz PYSLLDPZAWSGIO-ABHNRTSZSA-N 1 3 280.500 3.913 20 0 CHADHO CC[C@@H]([NH2+]CCCN1CCC(C)CC1)c1ccsc1 ZINC000382102556 336081787 /nfs/dbraw/zinc/08/17/87/336081787.db2.gz JJJHONDXKMCKPZ-MRXNPFEDSA-N 1 3 280.481 3.911 20 0 CHADHO CC(C)(CN[C@@H]1C[C@@H]([NH3+])c2ccccc21)C1CCC1 ZINC000384834589 336132112 /nfs/dbraw/zinc/13/21/12/336132112.db2.gz GHVFHPBZTLSUFW-HZPDHXFCSA-N 1 3 258.409 3.547 20 0 CHADHO CC(C)(CN[C@@H]1C[C@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000157410129 519270936 /nfs/dbraw/zinc/27/09/36/519270936.db2.gz LGKSKJJUMUAKSC-ZWKOTPCHSA-N 1 3 280.415 3.699 20 0 CHADHO CC(C)[NH+]1CCC(N(C)Cc2cccc3cccnc32)CC1 ZINC000299626342 519670400 /nfs/dbraw/zinc/67/04/00/519670400.db2.gz VJSHSDVAMLFAEJ-UHFFFAOYSA-N 1 3 297.446 3.539 20 0 CHADHO CCSc1cccc(CN(C)[C@H]2CC[N@H+](C)C[C@@H]2C)c1 ZINC000290354473 521756340 /nfs/dbraw/zinc/75/63/40/521756340.db2.gz GIAODDJZMFAWTG-YOEHRIQHSA-N 1 3 292.492 3.571 20 0 CHADHO CCSc1cccc(CN(C)[C@H]2CC[N@@H+](C)C[C@@H]2C)c1 ZINC000290354473 521756343 /nfs/dbraw/zinc/75/63/43/521756343.db2.gz GIAODDJZMFAWTG-YOEHRIQHSA-N 1 3 292.492 3.571 20 0 CHADHO CN(C)Cc1ccc(C[NH2+]C(C2CCC2)C2CCC2)cc1 ZINC000338690058 521907360 /nfs/dbraw/zinc/90/73/60/521907360.db2.gz SLTFKONWFMQREI-UHFFFAOYSA-N 1 3 286.463 3.807 20 0 CHADHO CC[C@H](NCC1CC[NH+](C)CC1)c1cccc(Cl)c1F ZINC000161670664 522575400 /nfs/dbraw/zinc/57/54/00/522575400.db2.gz HZYHFIOLSMWUIA-HNNXBMFYSA-N 1 3 298.833 3.862 20 0 CHADHO C[C@@H](CCN(C)C)[NH2+][C@H]1C[C@H](C)Sc2sccc21 ZINC000130478533 524479665 /nfs/dbraw/zinc/47/96/65/524479665.db2.gz YUKUVOMLLIZUBX-GVXVVHGQSA-N 1 3 284.494 3.603 20 0 CHADHO CSC1(CNC2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)CC1 ZINC000365106206 525331707 /nfs/dbraw/zinc/33/17/07/525331707.db2.gz CPSVVBDQLBQTLK-GOEBONIOSA-N 1 3 296.524 3.515 20 0 CHADHO CSC1(C[NH2+]C2CCN([C@@H]3CCCC[C@@H]3C)CC2)CC1 ZINC000365106206 525331714 /nfs/dbraw/zinc/33/17/14/525331714.db2.gz CPSVVBDQLBQTLK-GOEBONIOSA-N 1 3 296.524 3.515 20 0 CHADHO C[C@H](c1ccc(F)c(Cl)c1)N1CCC[C@@H](CC[NH3+])C1 ZINC000226327119 526055837 /nfs/dbraw/zinc/05/58/37/526055837.db2.gz JKLOVEUAEPAVKZ-NEPJUHHUSA-N 1 3 284.806 3.601 20 0 CHADHO CCC[N@H+](Cc1cc2cc(F)ccc2o1)C1CCNCC1 ZINC000347183394 528131465 /nfs/dbraw/zinc/13/14/65/528131465.db2.gz WVVCZSZBSIKXOW-UHFFFAOYSA-N 1 3 290.382 3.536 20 0 CHADHO CCC[N@@H+](Cc1cc2cc(F)ccc2o1)C1CCNCC1 ZINC000347183394 528131467 /nfs/dbraw/zinc/13/14/67/528131467.db2.gz WVVCZSZBSIKXOW-UHFFFAOYSA-N 1 3 290.382 3.536 20 0 CHADHO CCCN(Cc1ccc(Cl)c(C)c1)C1CC[NH2+]CC1 ZINC000347043422 528134484 /nfs/dbraw/zinc/13/44/84/528134484.db2.gz MRDXRPAAVYQSPL-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO CCC[N@H+](Cc1ccc(Cl)c(C)c1)C1CCNCC1 ZINC000347043422 528134488 /nfs/dbraw/zinc/13/44/88/528134488.db2.gz MRDXRPAAVYQSPL-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO CCC[N@@H+](Cc1ccc(Cl)c(C)c1)C1CCNCC1 ZINC000347043422 528134491 /nfs/dbraw/zinc/13/44/91/528134491.db2.gz MRDXRPAAVYQSPL-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H](CC)c2cccc(C)c2)C1 ZINC000353525334 528261494 /nfs/dbraw/zinc/26/14/94/528261494.db2.gz YINCEHORGCMJOV-SJLPKXTDSA-N 1 3 274.452 3.768 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H](CC)c2cccc(C)c2)C1 ZINC000353525334 528261498 /nfs/dbraw/zinc/26/14/98/528261498.db2.gz YINCEHORGCMJOV-SJLPKXTDSA-N 1 3 274.452 3.768 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](CC)c2cccc(C)c2)C1 ZINC000353525334 528261504 /nfs/dbraw/zinc/26/15/04/528261504.db2.gz YINCEHORGCMJOV-SJLPKXTDSA-N 1 3 274.452 3.768 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]Cc2ccc3occc3c2)C1 ZINC000352766424 529016066 /nfs/dbraw/zinc/01/60/66/529016066.db2.gz WSZQSIBEZZNLNB-INIZCTEOSA-N 1 3 286.419 3.643 20 0 CHADHO C[C@@H](N[C@H]1CCC[NH2+]CC1)c1cccc2ccccc21 ZINC000133580500 1125475560 /nfs/dbraw/zinc/47/55/60/1125475560.db2.gz NMVUHZHQIPSGTL-ZBFHGGJFSA-N 1 3 268.404 3.633 20 0 CHADHO Cc1cc(C[NH2+][C@@H]2CCN(C)C(C)(C)C2)ccc1Cl ZINC000623492148 1117861517 /nfs/dbraw/zinc/86/15/17/1117861517.db2.gz NRXMFRXTRBNXBI-CQSZACIVSA-N 1 3 280.843 3.611 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1cccc(Cl)c1 ZINC000624119847 1117983483 /nfs/dbraw/zinc/98/34/83/1117983483.db2.gz KVUBKYNHKHFSEE-ZIAGYGMSSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@H](NC1CC[NH+](CC)CC1)c1ccc(Cl)cc1 ZINC000037886391 1118043243 /nfs/dbraw/zinc/04/32/43/1118043243.db2.gz GDSUVTDTKIWNAL-INIZCTEOSA-N 1 3 280.843 3.865 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)N(C)C[C@@H]1CCC[N@H+](C)C1 ZINC000118841366 1118234395 /nfs/dbraw/zinc/23/43/95/1118234395.db2.gz NFXBEFAAFXVGQI-ZIAGYGMSSA-N 1 3 280.843 3.675 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000118841366 1118234399 /nfs/dbraw/zinc/23/43/99/1118234399.db2.gz NFXBEFAAFXVGQI-ZIAGYGMSSA-N 1 3 280.843 3.675 20 0 CHADHO CC(C)[C@@H](CSc1ccccc1)[NH2+]C[C@@H](C)CN(C)C ZINC000425938314 1122668774 /nfs/dbraw/zinc/66/87/74/1122668774.db2.gz WUYLPMMWBPXAGE-NVXWUHKLSA-N 1 3 294.508 3.591 20 0 CHADHO C[C@@H]([NH2+]CC1(N)CCCC1)c1cc2c(s1)CCCC2 ZINC000665247582 1123255629 /nfs/dbraw/zinc/25/56/29/1123255629.db2.gz FQLACPYMXZHRNV-GFCCVEGCSA-N 1 3 278.465 3.549 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000665281110 1123312215 /nfs/dbraw/zinc/31/22/15/1123312215.db2.gz UZBAPMUIFKGTDL-SMDDNHRTSA-N 1 3 288.357 3.729 20 0 CHADHO C[C@@H]1CC([NH2+]CCCCC2CCCCC2)C[C@@H](C)N1 ZINC001246480979 1131522801 /nfs/dbraw/zinc/52/28/01/1131522801.db2.gz ZWAJCQABJJSEIZ-HUUCEWRRSA-N 1 3 266.473 3.856 20 0 CHADHO CCCCCC1CCC([N@@H+]2CCC[C@H](N)CC2)CC1 ZINC001246548440 1131598250 /nfs/dbraw/zinc/59/82/50/1131598250.db2.gz TYUGEMXOJROGGV-CGZBRXJRSA-N 1 3 266.473 3.939 20 0 CHADHO CCCCCC1CCC([N@H+]2CCC[C@H](N)CC2)CC1 ZINC001246548440 1131598254 /nfs/dbraw/zinc/59/82/54/1131598254.db2.gz TYUGEMXOJROGGV-CGZBRXJRSA-N 1 3 266.473 3.939 20 0 CHADHO CCC[C@@H]1CCCC[N@@H+]1[C@H]1CCN[C@H](C(C)(C)C)C1 ZINC001246787672 1131781356 /nfs/dbraw/zinc/78/13/56/1131781356.db2.gz FEJFKCBIBBEIJE-PMPSAXMXSA-N 1 3 266.473 3.808 20 0 CHADHO CCC[C@@H]1CCCC[N@H+]1[C@H]1CCN[C@H](C(C)(C)C)C1 ZINC001246787672 1131781362 /nfs/dbraw/zinc/78/13/62/1131781362.db2.gz FEJFKCBIBBEIJE-PMPSAXMXSA-N 1 3 266.473 3.808 20 0 CHADHO CN1C(C)(C)CC([NH+]2CCCCCCC2)CC1(C)C ZINC001171639242 1132080893 /nfs/dbraw/zinc/08/08/93/1132080893.db2.gz AWGLFNXJKKXKKC-UHFFFAOYSA-N 1 3 266.473 3.904 20 0 CHADHO CCSC[C@H](C)[NH2+]C1CCN(C[C@@H]2CC=CCC2)CC1 ZINC001173297302 1132445838 /nfs/dbraw/zinc/44/58/38/1132445838.db2.gz CZHQZZIGLBJTHX-JKSUJKDBSA-N 1 3 296.524 3.538 20 0 CHADHO CCSC[C@H](C)NC1CC[NH+](C[C@@H]2CC=CCC2)CC1 ZINC001173297302 1132445840 /nfs/dbraw/zinc/44/58/40/1132445840.db2.gz CZHQZZIGLBJTHX-JKSUJKDBSA-N 1 3 296.524 3.538 20 0 CHADHO CC(C)=CCCC1=CC[C@H](CN2CC[C@@](C)([NH3+])C2)CC1 ZINC001204763191 1133481775 /nfs/dbraw/zinc/48/17/75/1133481775.db2.gz HUIJEJVLZDPZDD-ZWKOTPCHSA-N 1 3 276.468 3.882 20 0 CHADHO CCCN(CCC[NH+](C)C)CCc1cccc(Cl)c1 ZINC001207426220 1133800086 /nfs/dbraw/zinc/80/00/86/1133800086.db2.gz YHMYMAYZPBSGPY-UHFFFAOYSA-N 1 3 282.859 3.546 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CCC[C@@]12CCCNC2 ZINC001222232519 1135210706 /nfs/dbraw/zinc/21/07/06/1135210706.db2.gz VVAFFQJRHOLYCZ-ZWKOTPCHSA-N 1 3 278.484 3.977 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CCC[C@@]12CCCNC2 ZINC001222232519 1135210710 /nfs/dbraw/zinc/21/07/10/1135210710.db2.gz VVAFFQJRHOLYCZ-ZWKOTPCHSA-N 1 3 278.484 3.977 20 0 CHADHO C/C(=C/c1ccc(Cl)cc1)CNC[C@H]1CCC[N@@H+](C)C1 ZINC000532802403 1125582451 /nfs/dbraw/zinc/58/24/51/1125582451.db2.gz IFVMATPREAFGIY-SCOADAFUSA-N 1 3 292.854 3.675 20 0 CHADHO C/C(=C/c1ccc(Cl)cc1)CNC[C@H]1CCC[N@H+](C)C1 ZINC000532802403 1125582457 /nfs/dbraw/zinc/58/24/57/1125582457.db2.gz IFVMATPREAFGIY-SCOADAFUSA-N 1 3 292.854 3.675 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@@H](C)c2ccccc2C(C)(C)C)C1 ZINC000533638720 1125620186 /nfs/dbraw/zinc/62/01/86/1125620186.db2.gz MOPDLRMCLFBBSW-HOTGVXAUSA-N 1 3 288.479 3.977 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@@H](C)c2ccccc2C(C)(C)C)C1 ZINC000533638720 1125620189 /nfs/dbraw/zinc/62/01/89/1125620189.db2.gz MOPDLRMCLFBBSW-HOTGVXAUSA-N 1 3 288.479 3.977 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2ccccc2C(C)(C)C)C1 ZINC000533638720 1125620191 /nfs/dbraw/zinc/62/01/91/1125620191.db2.gz MOPDLRMCLFBBSW-HOTGVXAUSA-N 1 3 288.479 3.977 20 0 CHADHO C[C@@H]([NH2+]CC[C@@H]1C[C@H]1C1CC1)[C@H]1CCCN(C2CCC2)C1 ZINC000886127956 1125653646 /nfs/dbraw/zinc/65/36/46/1125653646.db2.gz YOFYJRLVWKIOFF-NWGLXNPWSA-N 1 3 290.495 3.665 20 0 CHADHO C1CC1C1([NH2+]C2CCN(C3CCCCC3)CC2)CCC1 ZINC000886392183 1125676758 /nfs/dbraw/zinc/67/67/58/1125676758.db2.gz ZVDMKOGADYUOOU-UHFFFAOYSA-N 1 3 276.468 3.706 20 0 CHADHO C[C@@H](Cc1cccc(F)c1)[NH2+]CCCN1CCCC[C@@H]1C ZINC000221810334 1125750005 /nfs/dbraw/zinc/75/00/05/1125750005.db2.gz JDTUUQPCXMYRMN-HOTGVXAUSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@@H]([NH2+][C@@H](CCN(C)C)C(C)(C)C)c1cc(F)cc(F)c1 ZINC000483194624 1126772563 /nfs/dbraw/zinc/77/25/63/1126772563.db2.gz JGECGJIVYOJEFB-WBMJQRKESA-N 1 3 298.421 3.982 20 0 CHADHO CN1CCC2(CCC[N@@H+]2CCC2CCCCC2)CC1 ZINC000483335039 1126781461 /nfs/dbraw/zinc/78/14/61/1126781461.db2.gz IOAPCFXJKPAZCC-UHFFFAOYSA-N 1 3 264.457 3.517 20 0 CHADHO CN1CCC2(CCC[N@H+]2CCC2CCCCC2)CC1 ZINC000483335039 1126781465 /nfs/dbraw/zinc/78/14/65/1126781465.db2.gz IOAPCFXJKPAZCC-UHFFFAOYSA-N 1 3 264.457 3.517 20 0 CHADHO CCCCCCc1ccc(CN2CC[C@@H](C[NH3+])C2)s1 ZINC001235749623 1130776490 /nfs/dbraw/zinc/77/64/90/1130776490.db2.gz IOZWYONWUIBCGM-AWEZNQCLSA-N 1 3 280.481 3.652 20 0 CHADHO CCc1ccc(CNC2CCC([NH+]3CCCCC3)CC2)o1 ZINC000760687584 1127183746 /nfs/dbraw/zinc/18/37/46/1127183746.db2.gz GASZHTZYFKIMLJ-UHFFFAOYSA-N 1 3 290.451 3.729 20 0 CHADHO Cc1sccc1CN1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000351813358 1127210502 /nfs/dbraw/zinc/21/05/02/1127210502.db2.gz QZZFOUCGPNQHND-DOTOQJQBSA-N 1 3 290.476 3.505 20 0 CHADHO Cc1sccc1CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000351813358 1127210504 /nfs/dbraw/zinc/21/05/04/1127210504.db2.gz QZZFOUCGPNQHND-DOTOQJQBSA-N 1 3 290.476 3.505 20 0 CHADHO CC[C@@H]1CCC[C@@H]([NH2+]CC[C@H](C)N2CCCCC2)C1 ZINC001308365064 1127372841 /nfs/dbraw/zinc/37/28/41/1127372841.db2.gz CLTUZFHDNDFRQO-GVDBMIGSSA-N 1 3 266.473 3.809 20 0 CHADHO C[C@@H]1C[C@H](NC2CC[NH+](C3CCC3)CC2)c2ccccc21 ZINC000289221467 1127377354 /nfs/dbraw/zinc/37/73/54/1127377354.db2.gz LHGKUXFFZPJLRO-KUHUBIRLSA-N 1 3 284.447 3.841 20 0 CHADHO CCN(CCC1CC[NH2+]CC1)Cc1ccccc1Cl ZINC000359221285 1127454561 /nfs/dbraw/zinc/45/45/61/1127454561.db2.gz OQOMVYVSEALFBF-UHFFFAOYSA-N 1 3 280.843 3.552 20 0 CHADHO CC[NH+]1CCC(N[C@H](C)c2cccc(C3CC3)c2)CC1 ZINC000293583781 1127507098 /nfs/dbraw/zinc/50/70/98/1127507098.db2.gz FAOHFSBSAAKRLH-CQSZACIVSA-N 1 3 272.436 3.699 20 0 CHADHO Cc1cc(N2CCC[N@@H+](C(C)(C)C)CC2)c2ccccc2n1 ZINC000601514654 1127529612 /nfs/dbraw/zinc/52/96/12/1127529612.db2.gz WDHCGRIIXPSWCT-UHFFFAOYSA-N 1 3 297.446 3.854 20 0 CHADHO Cc1cc(N2CCC[N@H+](C(C)(C)C)CC2)c2ccccc2n1 ZINC000601514654 1127529614 /nfs/dbraw/zinc/52/96/14/1127529614.db2.gz WDHCGRIIXPSWCT-UHFFFAOYSA-N 1 3 297.446 3.854 20 0 CHADHO C[C@H](N[C@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(C2CC2)c1 ZINC000294563994 1127582435 /nfs/dbraw/zinc/58/24/35/1127582435.db2.gz BNRKQKMMCICLMK-DEYYWGMASA-N 1 3 272.436 3.697 20 0 CHADHO C[C@H](N[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(C2CC2)c1 ZINC000294563994 1127582437 /nfs/dbraw/zinc/58/24/37/1127582437.db2.gz BNRKQKMMCICLMK-DEYYWGMASA-N 1 3 272.436 3.697 20 0 CHADHO C1[C@@H]2[C@H]1CCC[C@H]2[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000374600621 1127906086 /nfs/dbraw/zinc/90/60/86/1127906086.db2.gz FHRMEBYORMFAOX-BMGDILEWSA-N 1 3 276.468 3.562 20 0 CHADHO CCN1CC[C@H]([N@H+](C)C/C=C\c2ccc(F)cc2)C[C@H]1C ZINC000539819064 1127943459 /nfs/dbraw/zinc/94/34/59/1127943459.db2.gz JPFMOYZMCRFMRG-XSRQRWQSSA-N 1 3 290.426 3.644 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)C/C=C\c2ccc(F)cc2)C[C@H]1C ZINC000539819064 1127943460 /nfs/dbraw/zinc/94/34/60/1127943460.db2.gz JPFMOYZMCRFMRG-XSRQRWQSSA-N 1 3 290.426 3.644 20 0 CHADHO C[C@@H]1C[C@@H](C[NH3+])CN1Cc1ccc(-c2ccccc2)s1 ZINC000469850688 1128056180 /nfs/dbraw/zinc/05/61/80/1128056180.db2.gz WNONLEOTHLBTMS-KGLIPLIRSA-N 1 3 286.444 3.584 20 0 CHADHO C[N@H+](Cc1ccccc1-c1ccccc1)CC(C)(C)N ZINC000469876082 1128056468 /nfs/dbraw/zinc/05/64/68/1128056468.db2.gz PLDJSSXVYIIPIH-UHFFFAOYSA-N 1 3 268.404 3.523 20 0 CHADHO C[N@@H+](Cc1ccccc1-c1ccccc1)CC(C)(C)N ZINC000469876082 1128056473 /nfs/dbraw/zinc/05/64/73/1128056473.db2.gz PLDJSSXVYIIPIH-UHFFFAOYSA-N 1 3 268.404 3.523 20 0 CHADHO CC(C)CCN1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000303209973 1128059813 /nfs/dbraw/zinc/05/98/13/1128059813.db2.gz QYONEGNIWBXOPO-QGZVFWFLSA-N 1 3 266.473 3.621 20 0 CHADHO CCC[C@@H](CN(C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1 ZINC000470016457 1128061515 /nfs/dbraw/zinc/06/15/15/1128061515.db2.gz GCHFYICMFAKQRN-HTUJPFKRSA-N 1 3 286.463 3.785 20 0 CHADHO C[C@@H](C[NH2+]CCCN1CCCC1)c1cccc(Cl)c1 ZINC000470193214 1128065723 /nfs/dbraw/zinc/06/57/23/1128065723.db2.gz DSKMVEWKCKHXKT-AWEZNQCLSA-N 1 3 280.843 3.519 20 0 CHADHO CCN1CCC[C@@H](C[NH2+]C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000470198544 1128065847 /nfs/dbraw/zinc/06/58/47/1128065847.db2.gz SQHPSNJUUCTQJS-CABCVRRESA-N 1 3 294.870 3.765 20 0 CHADHO CCC[C@H](CC)[NH2+]CCCN1C[C@H](C)C[C@@H](C)C1 ZINC001257245088 1128078375 /nfs/dbraw/zinc/07/83/75/1128078375.db2.gz JTWHGVDOEAAOHG-OAGGEKHMSA-N 1 3 254.462 3.523 20 0 CHADHO C[C@@H](NCCC(C)(C)[NH3+])c1ccc(SC(F)F)cc1 ZINC000925740300 1128139662 /nfs/dbraw/zinc/13/96/62/1128139662.db2.gz IBTVSVMFGHLNGA-SNVBAGLBSA-N 1 3 288.407 3.779 20 0 CHADHO C[C@@H](NCCC(C)(C)[NH3+])c1cc2ccccc2s1 ZINC000925738622 1128139847 /nfs/dbraw/zinc/13/98/47/1128139847.db2.gz RFIZWRZWHIEOPA-LLVKDONJSA-N 1 3 262.422 3.679 20 0 CHADHO Cc1ccc2c(c1)[C@H](N[C@@H]1CCC[C@@H]([NH+](C)C)C1)[C@@H](C)C2 ZINC000493277491 1128137814 /nfs/dbraw/zinc/13/78/14/1128137814.db2.gz RGPXTPYPDFZADH-KNIMUDFMSA-N 1 3 286.463 3.691 20 0 CHADHO Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)[C@@H](C)C2 ZINC000493277491 1128137817 /nfs/dbraw/zinc/13/78/17/1128137817.db2.gz RGPXTPYPDFZADH-KNIMUDFMSA-N 1 3 286.463 3.691 20 0 CHADHO [NH3+][C@H]1CCCN(Cc2ccccc2-c2cccs2)CC1 ZINC001205110345 1128195906 /nfs/dbraw/zinc/19/59/06/1128195906.db2.gz SRTRFPHVOWPSOI-HNNXBMFYSA-N 1 3 286.444 3.728 20 0 CHADHO CCC[C@@H](C)[NH2+]C1CCN(C[C@@H]2CC=CCC2)CC1 ZINC001257314677 1128231700 /nfs/dbraw/zinc/23/17/00/1128231700.db2.gz OJSQUJXYPYGUBS-HZPDHXFCSA-N 1 3 264.457 3.585 20 0 CHADHO CC1(CN2CCCC[C@]23CCC[NH2+]C3)CCCCC1 ZINC001235173842 1128312361 /nfs/dbraw/zinc/31/23/61/1128312361.db2.gz RMGJHAYTIYINEO-QGZVFWFLSA-N 1 3 264.457 3.565 20 0 CHADHO CC1(C[N@@H+]2CCCC[C@]23CCCNC3)CCCCC1 ZINC001235173842 1128312367 /nfs/dbraw/zinc/31/23/67/1128312367.db2.gz RMGJHAYTIYINEO-QGZVFWFLSA-N 1 3 264.457 3.565 20 0 CHADHO CC1(C[N@H+]2CCCC[C@]23CCCNC3)CCCCC1 ZINC001235173842 1128312372 /nfs/dbraw/zinc/31/23/72/1128312372.db2.gz RMGJHAYTIYINEO-QGZVFWFLSA-N 1 3 264.457 3.565 20 0 CHADHO CC(C)Cc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)N3C)cc1 ZINC000322932994 1128351480 /nfs/dbraw/zinc/35/14/80/1128351480.db2.gz OVSRSNUFBVLCQC-YQQQUEKLSA-N 1 3 286.463 3.600 20 0 CHADHO CC(C)SCCNC1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1 ZINC000562063182 1128375873 /nfs/dbraw/zinc/37/58/73/1128375873.db2.gz AUTOCPCLFJMVJM-NVXWUHKLSA-N 1 3 298.540 3.761 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H](C)[C@H]2CCCC[C@H]2C)C1 ZINC000562522489 1128408041 /nfs/dbraw/zinc/40/80/41/1128408041.db2.gz GMIRLWPQSWQHHC-TWMKSMIVSA-N 1 3 266.473 3.521 20 0 CHADHO CCC(C)(C)[C@@H](C)[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000562778811 1128420154 /nfs/dbraw/zinc/42/01/54/1128420154.db2.gz JZABQJAHJFGSEO-HUUCEWRRSA-N 1 3 254.462 3.521 20 0 CHADHO CCCc1ccc([C@H](C)NC[C@@H]2CC[N@H+](CC)C2)cc1 ZINC000037643996 1128434023 /nfs/dbraw/zinc/43/40/23/1128434023.db2.gz HGGLQSQSYCLCSM-RDJZCZTQSA-N 1 3 274.452 3.632 20 0 CHADHO CCCc1ccc([C@H](C)NC[C@@H]2CC[N@@H+](CC)C2)cc1 ZINC000037643996 1128434026 /nfs/dbraw/zinc/43/40/26/1128434026.db2.gz HGGLQSQSYCLCSM-RDJZCZTQSA-N 1 3 274.452 3.632 20 0 CHADHO CCCc1ccc([C@H](C)[NH2+]C[C@@H]2CCN(CC)C2)cc1 ZINC000037643996 1128434027 /nfs/dbraw/zinc/43/40/27/1128434027.db2.gz HGGLQSQSYCLCSM-RDJZCZTQSA-N 1 3 274.452 3.632 20 0 CHADHO Cc1ccc([C@H](C)NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c(C)c1 ZINC000037772121 1128435394 /nfs/dbraw/zinc/43/53/94/1128435394.db2.gz TUZDKYQBBYEBKW-XYTVBORESA-N 1 3 272.436 3.579 20 0 CHADHO Cc1ccc([C@H](C)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(C)c1 ZINC000037772121 1128435397 /nfs/dbraw/zinc/43/53/97/1128435397.db2.gz TUZDKYQBBYEBKW-XYTVBORESA-N 1 3 272.436 3.579 20 0 CHADHO C[C@H](CN[C@@H](c1ccc(F)cc1)C1CC1)C[NH+]1CCCC1 ZINC000062078863 1128437006 /nfs/dbraw/zinc/43/70/06/1128437006.db2.gz SPELMIRFKKXAJV-RDTXWAMCSA-N 1 3 290.426 3.598 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+][C@@H](CCN(C)C)C(C)(C)C)o1 ZINC000126001636 1128460464 /nfs/dbraw/zinc/46/04/64/1128460464.db2.gz PLHZDDFPSDELBV-HIFRSBDPSA-N 1 3 266.429 3.605 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H]2CC[C@H](C)c3ccccc32)C1 ZINC000126566122 1128465068 /nfs/dbraw/zinc/46/50/68/1128465068.db2.gz CZHKJGQBPMDUEL-HDMKZQKVSA-N 1 3 272.436 3.556 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H]2CC[C@H](C)c3ccccc32)C1 ZINC000126566122 1128465070 /nfs/dbraw/zinc/46/50/70/1128465070.db2.gz CZHKJGQBPMDUEL-HDMKZQKVSA-N 1 3 272.436 3.556 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H]2CC[C@H](C)c3ccccc32)C1 ZINC000126566122 1128465072 /nfs/dbraw/zinc/46/50/72/1128465072.db2.gz CZHKJGQBPMDUEL-HDMKZQKVSA-N 1 3 272.436 3.556 20 0 CHADHO CC[C@@H](NCc1ccc(C[NH3+])cc1)c1cccc(F)c1 ZINC000566245870 1128540698 /nfs/dbraw/zinc/54/06/98/1128540698.db2.gz XGWSWZQSPUPJEM-QGZVFWFLSA-N 1 3 272.367 3.525 20 0 CHADHO CCCCN1CCC([NH2+]Cc2ccc3cc[nH]c3c2)CC1 ZINC000229632723 1128546491 /nfs/dbraw/zinc/54/64/91/1128546491.db2.gz ZVGWOKFQWDUCCF-UHFFFAOYSA-N 1 3 285.435 3.522 20 0 CHADHO C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(CC2(C)CCC2)C1 ZINC000556105231 1128547265 /nfs/dbraw/zinc/54/72/65/1128547265.db2.gz VDJDHWVMNDNXAQ-IAGOWNOFSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(CC2(C)CCC2)C1 ZINC000556105231 1128547267 /nfs/dbraw/zinc/54/72/67/1128547267.db2.gz VDJDHWVMNDNXAQ-IAGOWNOFSA-N 1 3 278.484 3.763 20 0 CHADHO CCC[N@H+](CCCN(C)C)Cc1ccc(SC)s1 ZINC000567529832 1128566080 /nfs/dbraw/zinc/56/60/80/1128566080.db2.gz KXFMEVQVPGLRFY-UHFFFAOYSA-N 1 3 286.510 3.634 20 0 CHADHO CCC[N@@H+](CCCN(C)C)Cc1ccc(SC)s1 ZINC000567529832 1128566082 /nfs/dbraw/zinc/56/60/82/1128566082.db2.gz KXFMEVQVPGLRFY-UHFFFAOYSA-N 1 3 286.510 3.634 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H](C)CCC2CCCC2)C1 ZINC000568564737 1128587704 /nfs/dbraw/zinc/58/77/04/1128587704.db2.gz ARDCUSGGMWZIKA-DOTOQJQBSA-N 1 3 266.473 3.665 20 0 CHADHO CN1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccc3ccccc3c2)C1 ZINC000571924244 1128639785 /nfs/dbraw/zinc/63/97/85/1128639785.db2.gz FRIPYTIHRPDDTL-VQTJNVASSA-N 1 3 294.442 3.756 20 0 CHADHO CN1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccc3ccccc3c2)C1 ZINC000571924244 1128639786 /nfs/dbraw/zinc/63/97/86/1128639786.db2.gz FRIPYTIHRPDDTL-VQTJNVASSA-N 1 3 294.442 3.756 20 0 CHADHO Cc1ccccc1C[C@H](C)N[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000157400780 1128654753 /nfs/dbraw/zinc/65/47/53/1128654753.db2.gz MYRORJRFFBDDPQ-ZOCIIQOWSA-N 1 3 280.415 3.660 20 0 CHADHO C[C@@H](CSC(C)(C)C)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000159614077 1128713740 /nfs/dbraw/zinc/71/37/40/1128713740.db2.gz FCIDQSIXWGYXEU-LBPRGKRZSA-N 1 3 286.529 3.805 20 0 CHADHO CC1=C[C@H](C)C[C@@H](C[NH2+]C[C@@H]2CCCN(C(C)C)C2)C1 ZINC000578513866 1128720118 /nfs/dbraw/zinc/72/01/18/1128720118.db2.gz POSDZQTZSVWRDY-RYQLBKOJSA-N 1 3 278.484 3.689 20 0 CHADHO C[C@@H]1C[C@H]1c1ccc(CNCCCCC[NH+]2CCCC2)o1 ZINC000339496540 1117808374 /nfs/dbraw/zinc/80/83/74/1117808374.db2.gz CCYKJPFASOWGDX-NVXWUHKLSA-N 1 3 290.451 3.759 20 0 CHADHO CC(C)[C@@H](N[C@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(F)cc1 ZINC000623343532 1117836336 /nfs/dbraw/zinc/83/63/36/1117836336.db2.gz YXDNNTHIPYEFSD-DLBZAZTESA-N 1 3 292.442 3.985 20 0 CHADHO CC(C)[C@@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(F)cc1 ZINC000623343532 1117836343 /nfs/dbraw/zinc/83/63/43/1117836343.db2.gz YXDNNTHIPYEFSD-DLBZAZTESA-N 1 3 292.442 3.985 20 0 CHADHO Cc1ccc([C@@H](C)N[C@@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000623363269 1117841715 /nfs/dbraw/zinc/84/17/15/1117841715.db2.gz KOYBVPWLEPDAHB-GDBMZVCRSA-N 1 3 260.425 3.518 20 0 CHADHO Cc1ccc([C@@H](C)N[C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000623363269 1117841721 /nfs/dbraw/zinc/84/17/21/1117841721.db2.gz KOYBVPWLEPDAHB-GDBMZVCRSA-N 1 3 260.425 3.518 20 0 CHADHO CC[C@H]1CCN1CC(C)(C)C[N@H+](C)Cc1ccccc1 ZINC000430198788 1117853742 /nfs/dbraw/zinc/85/37/42/1117853742.db2.gz PZFVVEAJEAONNW-KRWDZBQOSA-N 1 3 274.452 3.629 20 0 CHADHO CC[C@H]1CCN1CC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC000430198788 1117853748 /nfs/dbraw/zinc/85/37/48/1117853748.db2.gz PZFVVEAJEAONNW-KRWDZBQOSA-N 1 3 274.452 3.629 20 0 CHADHO Cc1cccc([C@@H](C)N[C@@H]2CC[N@H+](C)C(C)(C)C2)c1C ZINC000623420816 1117854444 /nfs/dbraw/zinc/85/44/44/1117854444.db2.gz PGELICKWPCGAII-HZPDHXFCSA-N 1 3 274.452 3.827 20 0 CHADHO Cc1cccc([C@@H](C)N[C@@H]2CC[N@@H+](C)C(C)(C)C2)c1C ZINC000623420816 1117854449 /nfs/dbraw/zinc/85/44/49/1117854449.db2.gz PGELICKWPCGAII-HZPDHXFCSA-N 1 3 274.452 3.827 20 0 CHADHO CCC[C@H](C)C[N@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236371825 1128742766 /nfs/dbraw/zinc/74/27/66/1128742766.db2.gz NPKFKXQDZOCDHD-JKSUJKDBSA-N 1 3 266.473 3.667 20 0 CHADHO CCC[C@H](C)C[N@@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236371825 1128742769 /nfs/dbraw/zinc/74/27/69/1128742769.db2.gz NPKFKXQDZOCDHD-JKSUJKDBSA-N 1 3 266.473 3.667 20 0 CHADHO C[N@H+](CCC1CC1)C1CCN(C2CCCCC2)CC1 ZINC001208687421 1117911827 /nfs/dbraw/zinc/91/18/27/1117911827.db2.gz SUIWQTRRNCQSJG-UHFFFAOYSA-N 1 3 264.457 3.515 20 0 CHADHO C[N@@H+](CCC1CC1)C1CCN(C2CCCCC2)CC1 ZINC001208687421 1117911830 /nfs/dbraw/zinc/91/18/30/1117911830.db2.gz SUIWQTRRNCQSJG-UHFFFAOYSA-N 1 3 264.457 3.515 20 0 CHADHO Clc1ccccc1C1CC([NH2+]CCCN2CCCC2)C1 ZINC000036843487 1117928230 /nfs/dbraw/zinc/92/82/30/1117928230.db2.gz NKEPPKTVQBAEBI-UHFFFAOYSA-N 1 3 292.854 3.662 20 0 CHADHO C[C@H]1C[C@@H](NC2(c3ccc(Cl)cc3)CCC2)CC[N@@H+]1C ZINC000180355589 1117928562 /nfs/dbraw/zinc/92/85/62/1117928562.db2.gz CYPSMFXOKLFXCK-BBRMVZONSA-N 1 3 292.854 3.792 20 0 CHADHO C[C@H]1C[C@@H](NC2(c3ccc(Cl)cc3)CCC2)CC[N@H+]1C ZINC000180355589 1117928564 /nfs/dbraw/zinc/92/85/64/1117928564.db2.gz CYPSMFXOKLFXCK-BBRMVZONSA-N 1 3 292.854 3.792 20 0 CHADHO C[C@@H]1[C@H]([NH2+]C[C@H]2CCCCN(C)C2)C[C@H]1c1ccccc1 ZINC000624122314 1117984544 /nfs/dbraw/zinc/98/45/44/1117984544.db2.gz OCFFNVKPZWAHKS-QFHJOOASSA-N 1 3 286.463 3.500 20 0 CHADHO Cc1cc(C)cc([C@@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)c1 ZINC000624120947 1117985173 /nfs/dbraw/zinc/98/51/73/1117985173.db2.gz KOOBHLYFMIJLOT-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc([C@@H](C)NC[C@@H]2CCCC[N@H+](C)C2)c(C)c1 ZINC000624119551 1117985605 /nfs/dbraw/zinc/98/56/05/1117985605.db2.gz DXJMZTXMBHHISL-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc([C@@H](C)NC[C@@H]2CCCC[N@@H+](C)C2)c(C)c1 ZINC000624119551 1117985608 /nfs/dbraw/zinc/98/56/08/1117985608.db2.gz DXJMZTXMBHHISL-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)c(C)c1 ZINC000624119551 1117985612 /nfs/dbraw/zinc/98/56/12/1117985612.db2.gz DXJMZTXMBHHISL-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO Cc1cccc(CC[C@@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)c1 ZINC000624120667 1117985740 /nfs/dbraw/zinc/98/57/40/1117985740.db2.gz DPHCEYKUJMPWOZ-MJGOQNOKSA-N 1 3 288.479 3.638 20 0 CHADHO CC(C)(C)c1ccc(C[NH2+]C[C@@H]2CCN(C3CC3)C2)cc1 ZINC000037408232 1118012354 /nfs/dbraw/zinc/01/23/54/1118012354.db2.gz HVYGSQCTGSUPMN-INIZCTEOSA-N 1 3 286.463 3.558 20 0 CHADHO CC[C@H](NC[C@@H]1CC[N@H+](CC)C1)c1ccc(Cl)cc1 ZINC000037644079 1118033900 /nfs/dbraw/zinc/03/39/00/1118033900.db2.gz QMZLUPMQQXYCKX-BBRMVZONSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@H](NC[C@@H]1CC[N@@H+](CC)C1)c1ccc(Cl)cc1 ZINC000037644079 1118033904 /nfs/dbraw/zinc/03/39/04/1118033904.db2.gz QMZLUPMQQXYCKX-BBRMVZONSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@H]([NH2+]C[C@@H]1CCN(CC)C1)c1ccc(Cl)cc1 ZINC000037644079 1118033908 /nfs/dbraw/zinc/03/39/08/1118033908.db2.gz QMZLUPMQQXYCKX-BBRMVZONSA-N 1 3 280.843 3.723 20 0 CHADHO C[C@H](CC[NH2+][C@@H](C)c1ccccc1)N1CCCCC1 ZINC000184503412 1118054961 /nfs/dbraw/zinc/05/49/61/1118054961.db2.gz WGPISIHYKZVJKC-CVEARBPZSA-N 1 3 260.425 3.602 20 0 CHADHO C[C@@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc(C2CC2)c1 ZINC000340175832 1118098701 /nfs/dbraw/zinc/09/87/01/1118098701.db2.gz RCQZHMSSVNEHPQ-CABCVRRESA-N 1 3 284.447 3.699 20 0 CHADHO C[C@@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1cccc(C2CC2)c1 ZINC000340175832 1118098704 /nfs/dbraw/zinc/09/87/04/1118098704.db2.gz RCQZHMSSVNEHPQ-CABCVRRESA-N 1 3 284.447 3.699 20 0 CHADHO C[C@H](NCCCC[N@@H+]1CCCC[C@@H]1C)c1ccncc1F ZINC000340187619 1118105280 /nfs/dbraw/zinc/10/52/80/1118105280.db2.gz XYLOVTREBPXDMB-GJZGRUSLSA-N 1 3 293.430 3.526 20 0 CHADHO C[C@H](NCCCC[N@H+]1CCCC[C@@H]1C)c1ccncc1F ZINC000340187619 1118105283 /nfs/dbraw/zinc/10/52/83/1118105283.db2.gz XYLOVTREBPXDMB-GJZGRUSLSA-N 1 3 293.430 3.526 20 0 CHADHO C[C@H](NCCCC[N@@H+]1CCCC[C@H]1C)c1ccncc1F ZINC000340187618 1118105446 /nfs/dbraw/zinc/10/54/46/1118105446.db2.gz XYLOVTREBPXDMB-CABCVRRESA-N 1 3 293.430 3.526 20 0 CHADHO C[C@H](NCCCC[N@H+]1CCCC[C@H]1C)c1ccncc1F ZINC000340187618 1118105449 /nfs/dbraw/zinc/10/54/49/1118105449.db2.gz XYLOVTREBPXDMB-CABCVRRESA-N 1 3 293.430 3.526 20 0 CHADHO C[C@H](C[NH2+][C@H](C)CC(C)(C)c1ccccc1)CN(C)C ZINC000312520555 1118150718 /nfs/dbraw/zinc/15/07/18/1118150718.db2.gz OKXAEAWSVBNTRK-HZPDHXFCSA-N 1 3 276.468 3.530 20 0 CHADHO CC[C@H](c1ccccc1)N1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1 ZINC000225877774 1118168039 /nfs/dbraw/zinc/16/80/39/1118168039.db2.gz UHVJWNUOGIZLET-FGTMMUONSA-N 1 3 272.436 3.602 20 0 CHADHO C[C@@H]([NH2+][C@H]1CC[C@@H](C)SC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000655750398 1118203359 /nfs/dbraw/zinc/20/33/59/1118203359.db2.gz AEYIZONCNPBFKY-FPCVCCKLSA-N 1 3 296.524 3.513 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](NC2(c3cccc(Cl)c3)CCC2)C1 ZINC000656200202 1118440101 /nfs/dbraw/zinc/44/01/01/1118440101.db2.gz HBJMPKZWEZHCFW-HUUCEWRRSA-N 1 3 278.827 3.579 20 0 CHADHO CC[C@@H]1C[C@H]1CN1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC001167425611 1118485943 /nfs/dbraw/zinc/48/59/43/1118485943.db2.gz RQKFMOSXCYDLIM-MLHJIOFPSA-N 1 3 278.484 3.619 20 0 CHADHO CC[C@@H]1C[C@H]1CN1CCC[C@@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC001167425611 1118485944 /nfs/dbraw/zinc/48/59/44/1118485944.db2.gz RQKFMOSXCYDLIM-MLHJIOFPSA-N 1 3 278.484 3.619 20 0 CHADHO CC[NH+](CC)CCCC1CCN(C/C=C\Cl)CC1 ZINC000588422444 1118655069 /nfs/dbraw/zinc/65/50/69/1118655069.db2.gz CJWCPDGUAQPCKP-POHAHGRESA-N 1 3 272.864 3.573 20 0 CHADHO C[NH+](C)CCCN[C@@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000341460234 1118712427 /nfs/dbraw/zinc/71/24/27/1118712427.db2.gz RQOLECNYNCYWKH-INIZCTEOSA-N 1 3 280.431 3.844 20 0 CHADHO C[C@H](CN1CCC[C@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000157084676 1118725337 /nfs/dbraw/zinc/72/53/37/1118725337.db2.gz ZQSCIXLAENBPKK-MJGOQNOKSA-N 1 3 286.463 3.740 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NCCC2=CCCCC2)c2ccccc21 ZINC000131923404 1118776031 /nfs/dbraw/zinc/77/60/31/1118776031.db2.gz NLRBHMPCXBCFHA-IAGOWNOFSA-N 1 3 256.393 3.611 20 0 CHADHO C[C@@H](C[NH2+]C1CCN(C2CCCCC2)CC1)CC(F)F ZINC000647226697 1118896019 /nfs/dbraw/zinc/89/60/19/1118896019.db2.gz TYFHUENLIINJEP-CYBMUJFWSA-N 1 3 288.426 3.664 20 0 CHADHO C[C@H](CC[NH2+][C@@H]1CCC[C@@H]1CCCF)N1CCCCC1 ZINC000511030649 1118962438 /nfs/dbraw/zinc/96/24/38/1118962438.db2.gz OOKGYAYKIADORC-BRWVUGGUSA-N 1 3 284.463 3.759 20 0 CHADHO C[C@H]1C[C@@H](NCc2cccc(C3CCCC3)c2)CC[N@@H+]1C ZINC000657376483 1119040656 /nfs/dbraw/zinc/04/06/56/1119040656.db2.gz RADBEBPCCIAQAA-KXBFYZLASA-N 1 3 286.463 3.917 20 0 CHADHO C[C@H]1C[C@@H](NCc2cccc(C3CCCC3)c2)CC[N@H+]1C ZINC000657376483 1119040659 /nfs/dbraw/zinc/04/06/59/1119040659.db2.gz RADBEBPCCIAQAA-KXBFYZLASA-N 1 3 286.463 3.917 20 0 CHADHO C[N@@H+]1CCc2ncc(Nc3ccnc(C(C)(C)C)c3)cc2C1 ZINC001213163042 1119147776 /nfs/dbraw/zinc/14/77/76/1119147776.db2.gz SQJLHSUQLHRQKJ-UHFFFAOYSA-N 1 3 296.418 3.506 20 0 CHADHO C[N@H+]1CCc2ncc(Nc3ccnc(C(C)(C)C)c3)cc2C1 ZINC001213163042 1119147779 /nfs/dbraw/zinc/14/77/79/1119147779.db2.gz SQJLHSUQLHRQKJ-UHFFFAOYSA-N 1 3 296.418 3.506 20 0 CHADHO C[C@@H]1C[C@H]1C[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000583294974 1119337629 /nfs/dbraw/zinc/33/76/29/1119337629.db2.gz JAUAIWDOENWBFN-NEWSRXKRSA-N 1 3 286.463 3.534 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@@H](C)c2ccc(C)cc2C)C1 ZINC000151126582 1119405208 /nfs/dbraw/zinc/40/52/08/1119405208.db2.gz KRFGQEGXPQBAGA-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@@H](C)c2ccc(C)cc2C)C1 ZINC000151126582 1119405209 /nfs/dbraw/zinc/40/52/09/1119405209.db2.gz KRFGQEGXPQBAGA-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO CC[C@@H](NCc1ccc(C[NH3+])cc1F)c1ccc(C)cc1 ZINC000650751986 1119408099 /nfs/dbraw/zinc/40/80/99/1119408099.db2.gz GVCRDGLIXRXTLX-GOSISDBHSA-N 1 3 286.394 3.834 20 0 CHADHO Clc1cscc1CNCC1CC[NH+](CC2CC2)CC1 ZINC000657813275 1119448622 /nfs/dbraw/zinc/44/86/22/1119448622.db2.gz MSNDIJMRKMELIL-UHFFFAOYSA-N 1 3 298.883 3.613 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1N[C@@H]1CCCc2ccc(F)cc21 ZINC000089213924 1119537743 /nfs/dbraw/zinc/53/77/43/1119537743.db2.gz QCJRJQAEKILSNT-JGTCGTHISA-N 1 3 290.426 3.521 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1N[C@@H]1CCCc2ccc(F)cc21 ZINC000089213924 1119537751 /nfs/dbraw/zinc/53/77/51/1119537751.db2.gz QCJRJQAEKILSNT-JGTCGTHISA-N 1 3 290.426 3.521 20 0 CHADHO CCCN1CC[C@H](C[NH2+]C[C@H](C)CCc2ccccc2)C1 ZINC001648920569 1119595447 /nfs/dbraw/zinc/59/54/47/1119595447.db2.gz CEUHVKKAUUULNS-IEBWSBKVSA-N 1 3 288.479 3.577 20 0 CHADHO C[NH+]1CCC([C@@H]2CCN(Cc3cscc3Cl)C2)CC1 ZINC000685462802 1119610814 /nfs/dbraw/zinc/61/08/14/1119610814.db2.gz HZOCEXHHINJCES-CYBMUJFWSA-N 1 3 298.883 3.565 20 0 CHADHO CCN(CCC[NH+]1CCCC1)Cc1cccc2cnccc21 ZINC000685459762 1119612779 /nfs/dbraw/zinc/61/27/79/1119612779.db2.gz YGUXCSKKDRRGKQ-UHFFFAOYSA-N 1 3 297.446 3.543 20 0 CHADHO C[C@H](CC[NH2+]C[C@H]1CCCCN(C)C1)c1ccccc1 ZINC000628425640 1128858854 /nfs/dbraw/zinc/85/88/54/1128858854.db2.gz QUNOLUZZODMMGD-IAGOWNOFSA-N 1 3 274.452 3.502 20 0 CHADHO C[C@H]([NH2+][C@H]1CCCSCC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000657969786 1119655584 /nfs/dbraw/zinc/65/55/84/1119655584.db2.gz UQICCUYOYRVNKG-XHSDSOJGSA-N 1 3 296.524 3.515 20 0 CHADHO C[C@H]1C[C@@H]([NH2+]C[C@H]2CCCCN(C)C2)CC(C)(C)C1 ZINC000708786858 1119843158 /nfs/dbraw/zinc/84/31/58/1119843158.db2.gz FMYWRDVMSYNCKW-ARFHVFGLSA-N 1 3 266.473 3.523 20 0 CHADHO CCCC[N@H+](C)CC1CCN(Cc2ccccc2F)CC1 ZINC000613492946 1119941032 /nfs/dbraw/zinc/94/10/32/1119941032.db2.gz VEZCTFFJFLLCGE-UHFFFAOYSA-N 1 3 292.442 3.770 20 0 CHADHO CCCC[N@@H+](C)CC1CCN(Cc2ccccc2F)CC1 ZINC000613492946 1119941036 /nfs/dbraw/zinc/94/10/36/1119941036.db2.gz VEZCTFFJFLLCGE-UHFFFAOYSA-N 1 3 292.442 3.770 20 0 CHADHO CC[C@@H]1CCC[C@@H](C[N@@H+]2CCCC23CCN(C)CC3)C1 ZINC000472595309 1119997476 /nfs/dbraw/zinc/99/74/76/1119997476.db2.gz FACKCQUKJVYBSA-IAGOWNOFSA-N 1 3 278.484 3.763 20 0 CHADHO CC[C@@H]1CCC[C@@H](C[N@H+]2CCCC23CCN(C)CC3)C1 ZINC000472595309 1119997479 /nfs/dbraw/zinc/99/74/79/1119997479.db2.gz FACKCQUKJVYBSA-IAGOWNOFSA-N 1 3 278.484 3.763 20 0 CHADHO CC[C@H](C)C[C@H](CC)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000624119504 1120051596 /nfs/dbraw/zinc/05/15/96/1120051596.db2.gz DGAGCGGXFAHHBB-JYJNAYRXSA-N 1 3 254.462 3.523 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]C2CCN(CC3CC3)CC2)cc1F ZINC000165605292 1120056005 /nfs/dbraw/zinc/05/60/05/1120056005.db2.gz ADAIUCZXUCACHP-CQSZACIVSA-N 1 3 290.426 3.659 20 0 CHADHO CCC(CC)(CC)C[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000628425665 1120061418 /nfs/dbraw/zinc/06/14/18/1120061418.db2.gz RDUOJAXVDQXDDQ-HNNXBMFYSA-N 1 3 254.462 3.524 20 0 CHADHO CN1CCCC[C@H](C[NH2+]Cc2csc3ccccc23)C1 ZINC000623656456 1120063969 /nfs/dbraw/zinc/06/39/69/1120063969.db2.gz UMMQCSREGMTGDQ-CQSZACIVSA-N 1 3 288.460 3.723 20 0 CHADHO C[C@@H](C[NH2+]C[C@H]1CCCCN(C)C1)c1cccc(Cl)c1 ZINC000623657335 1120065181 /nfs/dbraw/zinc/06/51/81/1120065181.db2.gz NXGXUACVWBIDCO-LSDHHAIUSA-N 1 3 294.870 3.765 20 0 CHADHO CC[C@@H](Cc1ccc(C)cc1)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000624121139 1120076328 /nfs/dbraw/zinc/07/63/28/1120076328.db2.gz OVKADCYYKVNVOZ-OALUTQOASA-N 1 3 288.479 3.638 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@H]2CCCc3ccc(F)cc32)C1 ZINC000624121832 1120101482 /nfs/dbraw/zinc/10/14/82/1120101482.db2.gz DOZLAFFFIPFFIS-KDOFPFPSSA-N 1 3 290.426 3.525 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCc1ccc(SC(F)(F)F)cc1 ZINC000843127098 1120124658 /nfs/dbraw/zinc/12/46/58/1120124658.db2.gz CGLIKZSMJMDMLN-UWVGGRQHSA-N 1 3 292.370 3.514 20 0 CHADHO CN1CCC[C@@H]2C[N@H+](CC[C@H]3CCc4ccccc43)CC[C@@H]21 ZINC000660009766 1120339169 /nfs/dbraw/zinc/33/91/69/1120339169.db2.gz ACHBPBQAQHRWLQ-GGPKGHCWSA-N 1 3 298.474 3.523 20 0 CHADHO CN1CCC[C@@H]2C[N@@H+](CC[C@H]3CCc4ccccc43)CC[C@@H]21 ZINC000660009766 1120339172 /nfs/dbraw/zinc/33/91/72/1120339172.db2.gz ACHBPBQAQHRWLQ-GGPKGHCWSA-N 1 3 298.474 3.523 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H](CCC(C)C)C2CC2)C1 ZINC000517042775 1120359427 /nfs/dbraw/zinc/35/94/27/1120359427.db2.gz ADVJPZKPNVNIMB-WBVHZDCISA-N 1 3 266.473 3.523 20 0 CHADHO CCC(F)(F)C(C)(C)CN[C@@H](Cc1ccccc1)[C@H](C)[NH3+] ZINC000629531343 1128913587 /nfs/dbraw/zinc/91/35/87/1128913587.db2.gz HWPGDHITNWKFED-ZFWWWQNUSA-N 1 3 298.421 3.606 20 0 CHADHO N[C@H]1C[C@@H]([NH2+]CC2(C(F)(F)F)CCCC2)c2ccccc21 ZINC000629551981 1128915433 /nfs/dbraw/zinc/91/54/33/1128915433.db2.gz ZCALOSOFEMLKPB-UONOGXRCSA-N 1 3 298.352 3.844 20 0 CHADHO C[C@H]([NH2+]CCCC1CCC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000660255336 1120467906 /nfs/dbraw/zinc/46/79/06/1120467906.db2.gz BIKHNUHUVDQPIM-DOTOQJQBSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1)CN(C)C ZINC000425939154 1120475179 /nfs/dbraw/zinc/47/51/79/1120475179.db2.gz ZDEKKAIQEXHKBA-FEPKRQSRSA-N 1 3 294.405 3.531 20 0 CHADHO CC(C)[C@@H](N[C@@H]1CC[NH2+]C(C)(C)C1)c1ccccc1 ZINC000709268027 1120482742 /nfs/dbraw/zinc/48/27/42/1120482742.db2.gz WYOWDALNDREKRW-HZPDHXFCSA-N 1 3 260.425 3.504 20 0 CHADHO CC[C@H](C[N@@H+]1CCC[C@H]2CN(C)CC[C@H]21)c1ccccc1 ZINC000582115069 1120539622 /nfs/dbraw/zinc/53/96/22/1120539622.db2.gz WDJAFCHOAFSJAU-NZSAHSFTSA-N 1 3 286.463 3.596 20 0 CHADHO CC[C@H](C[N@H+]1CCC[C@H]2CN(C)CC[C@H]21)c1ccccc1 ZINC000582115069 1120539624 /nfs/dbraw/zinc/53/96/24/1120539624.db2.gz WDJAFCHOAFSJAU-NZSAHSFTSA-N 1 3 286.463 3.596 20 0 CHADHO C[C@H]1CCC[C@@H](N2CCC([NH2+]C3CC4(CCC4)C3)CC2)C1 ZINC000652051707 1120570973 /nfs/dbraw/zinc/57/09/73/1120570973.db2.gz NSYPWXLJWLJFDA-MAUKXSAKSA-N 1 3 290.495 3.952 20 0 CHADHO CN(C)C1(C)CC[NH+](CC[C@H]2CCc3ccccc32)CC1 ZINC000931356194 1120636961 /nfs/dbraw/zinc/63/69/61/1120636961.db2.gz ZMZHYPUACDPIKG-QGZVFWFLSA-N 1 3 286.463 3.523 20 0 CHADHO CC[C@H](C)[NH2+][C@H](C)c1ccc(OC)c(CN(CC)CC)c1 ZINC000182193471 1128940990 /nfs/dbraw/zinc/94/09/90/1128940990.db2.gz GWMVFHLMYYBKJG-LSDHHAIUSA-N 1 3 292.467 3.986 20 0 CHADHO CCC[NH+]1CCC(NC2(c3ccccc3C)CCC2)CC1 ZINC000652218221 1120801196 /nfs/dbraw/zinc/80/11/96/1120801196.db2.gz BVLZTBMYZHIHRB-UHFFFAOYSA-N 1 3 286.463 3.838 20 0 CHADHO C[C@H]1CCCC[C@H]1N1CCC([NH2+]C2(C3CCC3)CC2)CC1 ZINC000652272285 1120806655 /nfs/dbraw/zinc/80/66/55/1120806655.db2.gz GYYCOBDSHNCUJW-MAUKXSAKSA-N 1 3 290.495 3.952 20 0 CHADHO CC(C)CN1CCC([NH2+][C@H](C)c2cccc(F)c2)CC1 ZINC000221689137 1120900318 /nfs/dbraw/zinc/90/03/18/1120900318.db2.gz UNMOVDWUATZIBP-CQSZACIVSA-N 1 3 278.415 3.597 20 0 CHADHO CC[C@@H](NCCC[NH+]1CCCC1)c1ccc(C)cc1 ZINC000021811213 1120971071 /nfs/dbraw/zinc/97/10/71/1120971071.db2.gz QQBGVHVCWMHHJG-QGZVFWFLSA-N 1 3 260.425 3.522 20 0 CHADHO CC[C@@H]([NH2+]CCCN1CCCC1)c1ccc(C)cc1 ZINC000021811213 1120971073 /nfs/dbraw/zinc/97/10/73/1120971073.db2.gz QQBGVHVCWMHHJG-QGZVFWFLSA-N 1 3 260.425 3.522 20 0 CHADHO C([NH2+][C@H](C1CC1)C1CCCC1)[C@H]1CCCN(CC2CC2)C1 ZINC000663464994 1120980144 /nfs/dbraw/zinc/98/01/44/1120980144.db2.gz HWILUSWABPLYKU-APWZRJJASA-N 1 3 290.495 3.667 20 0 CHADHO CC1(C)[C@H]2CCC[C@H]2[C@@H]1[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663467268 1120980703 /nfs/dbraw/zinc/98/07/03/1120980703.db2.gz ZTPINUKUFKJUEA-BDXSIMOUSA-N 1 3 290.495 3.523 20 0 CHADHO CCCC(CCC)[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663472179 1120985825 /nfs/dbraw/zinc/98/58/25/1120985825.db2.gz ZHFGIUDMGUJKOX-INIZCTEOSA-N 1 3 266.473 3.667 20 0 CHADHO CC(C)CC[C@H](C)[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663470213 1120985200 /nfs/dbraw/zinc/98/52/00/1120985200.db2.gz SZGHQTXZRGXBKV-DOTOQJQBSA-N 1 3 266.473 3.523 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](CC2CCC2)c2ccccc2)C1 ZINC000344035138 1121061596 /nfs/dbraw/zinc/06/15/96/1121061596.db2.gz PYQHZNZKUQRKSI-PKOBYXMFSA-N 1 3 286.463 3.849 20 0 CHADHO C[C@H](c1cccc(Cl)c1)N1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000063197596 1121201800 /nfs/dbraw/zinc/20/18/00/1121201800.db2.gz QAJDWUCZCGNJHH-CXAGYDPISA-N 1 3 292.854 3.865 20 0 CHADHO CC(C)CC(CC(C)C)[N@@H+]1CC[C@@]2(C1)CCCNC2 ZINC000709852378 1121375912 /nfs/dbraw/zinc/37/59/12/1121375912.db2.gz VWXPLNPWTNDXOX-KRWDZBQOSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)CC(CC(C)C)[N@H+]1CC[C@@]2(C1)CCCNC2 ZINC000709852378 1121375920 /nfs/dbraw/zinc/37/59/20/1121375920.db2.gz VWXPLNPWTNDXOX-KRWDZBQOSA-N 1 3 266.473 3.523 20 0 CHADHO C[NH+]1CCC(CNCc2oc3ccccc3c2Cl)CC1 ZINC000631063721 1128981860 /nfs/dbraw/zinc/98/18/60/1128981860.db2.gz HBKPHUKZLWFFGS-UHFFFAOYSA-N 1 3 292.810 3.518 20 0 CHADHO CCN(Cc1ccc(C[NH+](C)C)cc1)[C@H](C)c1ccccn1 ZINC000626062748 1121593883 /nfs/dbraw/zinc/59/38/83/1121593883.db2.gz FEHMMZAGDWJGMW-MRXNPFEDSA-N 1 3 297.446 3.726 20 0 CHADHO CC[NH+](CC)CCCN1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000513236995 1121676645 /nfs/dbraw/zinc/67/66/45/1121676645.db2.gz ROWLAOXHDTWBMC-WMZOPIPTSA-N 1 3 274.452 3.801 20 0 CHADHO CCN(CC)CCC[N@@H+]1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000513236995 1121676647 /nfs/dbraw/zinc/67/66/47/1121676647.db2.gz ROWLAOXHDTWBMC-WMZOPIPTSA-N 1 3 274.452 3.801 20 0 CHADHO CCN(CC)CCC[N@H+]1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000513236995 1121676650 /nfs/dbraw/zinc/67/66/50/1121676650.db2.gz ROWLAOXHDTWBMC-WMZOPIPTSA-N 1 3 274.452 3.801 20 0 CHADHO Cc1cc(CN2CCC[C@@](C)(C[NH3+])CC2)c(F)cc1Cl ZINC001206326949 1121781789 /nfs/dbraw/zinc/78/17/89/1121781789.db2.gz RAUUDRMDYJGPNR-MRXNPFEDSA-N 1 3 298.833 3.738 20 0 CHADHO Fc1cc(CN[C@@H]2CCC[N@H+]3CCCC[C@@H]23)ccc1Cl ZINC001179044727 1121841055 /nfs/dbraw/zinc/84/10/55/1121841055.db2.gz OWKXJWNFYQPKMS-CVEARBPZSA-N 1 3 296.817 3.586 20 0 CHADHO Fc1cc(CN[C@@H]2CCC[N@@H+]3CCCC[C@@H]23)ccc1Cl ZINC001179044727 1121841045 /nfs/dbraw/zinc/84/10/45/1121841045.db2.gz OWKXJWNFYQPKMS-CVEARBPZSA-N 1 3 296.817 3.586 20 0 CHADHO Fc1cc(CN[C@H]2CCC[N@@H+]3CCCC[C@H]23)ccc1Cl ZINC001179044730 1121841350 /nfs/dbraw/zinc/84/13/50/1121841350.db2.gz OWKXJWNFYQPKMS-JKSUJKDBSA-N 1 3 296.817 3.586 20 0 CHADHO Fc1cc(CN[C@H]2CCC[N@H+]3CCCC[C@H]23)ccc1Cl ZINC001179044730 1121841359 /nfs/dbraw/zinc/84/13/59/1121841359.db2.gz OWKXJWNFYQPKMS-JKSUJKDBSA-N 1 3 296.817 3.586 20 0 CHADHO CCN(Cc1csc2ccccc12)[C@@H]1CCC[NH2+]CC1 ZINC000345195407 1121852477 /nfs/dbraw/zinc/85/24/77/1121852477.db2.gz AWRAQNHHKQOXLA-OAHLLOKOSA-N 1 3 288.460 3.865 20 0 CHADHO CC(C)(CCN[C@H]1C[C@@H]([NH3+])c2ccccc21)C1CC1 ZINC000262128302 1129014203 /nfs/dbraw/zinc/01/42/03/1129014203.db2.gz CVIJAVPBHPCWIH-CVEARBPZSA-N 1 3 258.409 3.547 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)CCSC2CCCCC2)[C@H](C)C1 ZINC000501035658 1121946278 /nfs/dbraw/zinc/94/62/78/1121946278.db2.gz IPXRGOXLDFGRSG-WBVHZDCISA-N 1 3 298.540 3.714 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)CCSC2CCCCC2)[C@H](C)C1 ZINC000501035658 1121946287 /nfs/dbraw/zinc/94/62/87/1121946287.db2.gz IPXRGOXLDFGRSG-WBVHZDCISA-N 1 3 298.540 3.714 20 0 CHADHO Cc1cc([C@H](C)[NH2+][C@@H](CCN(C)C)C(C)(C)C)oc1C ZINC000502724716 1122144736 /nfs/dbraw/zinc/14/47/36/1122144736.db2.gz FWEIBLAWPPSVOO-BBRMVZONSA-N 1 3 280.456 3.913 20 0 CHADHO CC1=C(C)C[C@H]([C@H](C)[NH2+]C[C@H]2CCCCN(C)C2)CC1 ZINC001182908913 1122196084 /nfs/dbraw/zinc/19/60/84/1122196084.db2.gz DDVMSIVLEXGTAE-RCCFBDPRSA-N 1 3 278.484 3.833 20 0 CHADHO C[C@@H](CN(C)C)[C@@H]1CCCC[N@@H+]1Cc1cc2ccccc2[nH]1 ZINC001183065554 1122204199 /nfs/dbraw/zinc/20/41/99/1122204199.db2.gz LXRYGCQTCXCVQC-KXBFYZLASA-N 1 3 299.462 3.720 20 0 CHADHO C[C@@H](CN(C)C)[C@@H]1CCCC[N@H+]1Cc1cc2ccccc2[nH]1 ZINC001183065554 1122204202 /nfs/dbraw/zinc/20/42/02/1122204202.db2.gz LXRYGCQTCXCVQC-KXBFYZLASA-N 1 3 299.462 3.720 20 0 CHADHO C[C@@H]1C[C@@]1([NH2+]CC[C@H]1CCCN1C)c1ccc(Cl)cc1 ZINC000503368534 1122256619 /nfs/dbraw/zinc/25/66/19/1122256619.db2.gz DMQUJXWIUMRZDG-XYPHTWIQSA-N 1 3 292.854 3.649 20 0 CHADHO Cc1ccc(C[N@@H+]2CCC(C)(C)NC(C)(C)C2)cc1C ZINC001184373961 1122273321 /nfs/dbraw/zinc/27/33/21/1122273321.db2.gz HIPOGPNDBYHCST-UHFFFAOYSA-N 1 3 274.452 3.656 20 0 CHADHO Cc1ccc(C[N@H+]2CCC(C)(C)NC(C)(C)C2)cc1C ZINC001184373961 1122273323 /nfs/dbraw/zinc/27/33/23/1122273323.db2.gz HIPOGPNDBYHCST-UHFFFAOYSA-N 1 3 274.452 3.656 20 0 CHADHO CC[C@@H]1CCC[C@H]([NH2+][C@H](C)CCN(CC)CC)C1 ZINC001184418011 1122275756 /nfs/dbraw/zinc/27/57/56/1122275756.db2.gz JSXNDBVGUVCWED-OAGGEKHMSA-N 1 3 254.462 3.665 20 0 CHADHO c1ccc(CN2C[C@@H]3CCCC[C@H]([NH2+]CC4CC4)[C@H]3C2)cc1 ZINC000514103651 1122375970 /nfs/dbraw/zinc/37/59/70/1122375970.db2.gz DFQCWVVPKSHUNJ-UFYCRDLUSA-N 1 3 298.474 3.677 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CC[C@H](c2ccccc2)C1)CN1CCCC1 ZINC000436276875 1122532786 /nfs/dbraw/zinc/53/27/86/1122532786.db2.gz VSERVRBETYRFMK-NZSAHSFTSA-N 1 3 286.463 3.644 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+](C[C@H](C)C2CCCCC2)C1 ZINC001191367585 1122596742 /nfs/dbraw/zinc/59/67/42/1122596742.db2.gz QHRMMJRKIVJTAW-IRXDYDNUSA-N 1 3 280.500 3.867 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+](C[C@H](C)C2CCCCC2)C1 ZINC001191367585 1122596745 /nfs/dbraw/zinc/59/67/45/1122596745.db2.gz QHRMMJRKIVJTAW-IRXDYDNUSA-N 1 3 280.500 3.867 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]C2CCN([C@H]3CCC[C@H](C)C3)CC2)C1 ZINC000437052942 1122606618 /nfs/dbraw/zinc/60/66/18/1122606618.db2.gz XOVWBXXTRPZMHB-MVJTYMMSSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@@H](C[NH2+][C@H](CC1CCC1)c1ccccc1)CN(C)C ZINC000425916476 1122658893 /nfs/dbraw/zinc/65/88/93/1122658893.db2.gz FQXCFOVJEBYCRL-MAUKXSAKSA-N 1 3 274.452 3.705 20 0 CHADHO C[C@@H](CN[C@H](CC1CCC1)c1ccccc1)C[NH+](C)C ZINC000425916476 1122658896 /nfs/dbraw/zinc/65/88/96/1122658896.db2.gz FQXCFOVJEBYCRL-MAUKXSAKSA-N 1 3 274.452 3.705 20 0 CHADHO Cc1cc2c(cc1C)[C@H]([NH2+]C[C@@H](C)CN(C)C)CCS2 ZINC000425913630 1122659074 /nfs/dbraw/zinc/65/90/74/1122659074.db2.gz AGVXCDXHUWZQNI-MLGOLLRUSA-N 1 3 292.492 3.628 20 0 CHADHO C[C@H](C[NH2+][C@H](C)c1ccc(-c2ccncc2)cc1)CN(C)C ZINC000425941787 1122671452 /nfs/dbraw/zinc/67/14/52/1122671452.db2.gz DYYXLUIVZUCHLA-HZPDHXFCSA-N 1 3 297.446 3.597 20 0 CHADHO Cc1ccc([C@@H]([NH2+]C[C@H](C)CN(C)C)C2CCC2)cc1 ZINC000425940829 1122671701 /nfs/dbraw/zinc/67/17/01/1122671701.db2.gz AWNFZTWCLISYNU-YJBOKZPZSA-N 1 3 274.452 3.624 20 0 CHADHO C[C@@H](NCc1ccc(C[NH3+])cc1)c1ccc(Cl)c(F)c1 ZINC000517742843 1122695712 /nfs/dbraw/zinc/69/57/12/1122695712.db2.gz MPWSSRZFRKFAHR-LLVKDONJSA-N 1 3 292.785 3.789 20 0 CHADHO C[NH+](C)CCCCCCC[NH2+]Cc1cc([O-])cc(Cl)c1 ZINC001648955263 1122731875 /nfs/dbraw/zinc/73/18/75/1122731875.db2.gz AXDLNQMSPCITQE-UHFFFAOYSA-N 1 3 298.858 3.647 20 0 CHADHO CC(C)CC[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167966613 1122839274 /nfs/dbraw/zinc/83/92/74/1122839274.db2.gz XMJMEEGGCFAYPH-CCNLRDMRSA-N 1 3 278.484 3.806 20 0 CHADHO C(C1CC1)N1[C@@H]2CC[C@H]1CC([NH2+][C@H]1CC[C@@H]3CCC[C@@H]31)C2 ZINC001167968174 1122848849 /nfs/dbraw/zinc/84/88/49/1122848849.db2.gz NPQJFWDYORYBMV-IEZPQTAPSA-N 1 3 288.479 3.560 20 0 CHADHO C[C@H]1C[N@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CCC[C@@H]1C ZINC001167985083 1122945422 /nfs/dbraw/zinc/94/54/22/1122945422.db2.gz VCVXMXPPJZBPML-LQJGXABVSA-N 1 3 290.495 3.760 20 0 CHADHO C[C@H]1C[N@@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CCC[C@@H]1C ZINC001167985083 1122945425 /nfs/dbraw/zinc/94/54/25/1122945425.db2.gz VCVXMXPPJZBPML-LQJGXABVSA-N 1 3 290.495 3.760 20 0 CHADHO CC[C@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)c1cccc(F)c1 ZINC000187964785 1122982076 /nfs/dbraw/zinc/98/20/76/1122982076.db2.gz SXSDWFSGSASGBR-QAPCUYQASA-N 1 3 292.442 3.987 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1ccccc1 ZINC001203314966 1122983964 /nfs/dbraw/zinc/98/39/64/1122983964.db2.gz XKGLSCIJINDFRP-ZWKOTPCHSA-N 1 3 272.436 3.525 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC001203314966 1122983967 /nfs/dbraw/zinc/98/39/67/1122983967.db2.gz XKGLSCIJINDFRP-ZWKOTPCHSA-N 1 3 272.436 3.525 20 0 CHADHO C[N@@H+]1CCC[C@H]1C[C@H]1CCCCN1Cc1ccccc1 ZINC001203314966 1122983969 /nfs/dbraw/zinc/98/39/69/1122983969.db2.gz XKGLSCIJINDFRP-ZWKOTPCHSA-N 1 3 272.436 3.525 20 0 CHADHO C[N@H+]1CCC[C@H]1C[C@H]1CCCCN1Cc1ccccc1 ZINC001203314966 1122983972 /nfs/dbraw/zinc/98/39/72/1122983972.db2.gz XKGLSCIJINDFRP-ZWKOTPCHSA-N 1 3 272.436 3.525 20 0 CHADHO Cc1ccc(CNCCCC[N@H+]2CCCC[C@H]2C)c(F)c1 ZINC001199336498 1123027924 /nfs/dbraw/zinc/02/79/24/1123027924.db2.gz PQAIEXXMUKOEQY-MRXNPFEDSA-N 1 3 292.442 3.878 20 0 CHADHO Cc1ccc(CNCCCC[N@@H+]2CCCC[C@H]2C)c(F)c1 ZINC001199336498 1123027929 /nfs/dbraw/zinc/02/79/29/1123027929.db2.gz PQAIEXXMUKOEQY-MRXNPFEDSA-N 1 3 292.442 3.878 20 0 CHADHO CC[C@@H](F)CN1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000440715867 1123033577 /nfs/dbraw/zinc/03/35/77/1123033577.db2.gz RFGKKDFITVHXOA-GOSISDBHSA-N 1 3 292.442 3.579 20 0 CHADHO CC[C@@H](F)CN1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000440715867 1123033583 /nfs/dbraw/zinc/03/35/83/1123033583.db2.gz RFGKKDFITVHXOA-GOSISDBHSA-N 1 3 292.442 3.579 20 0 CHADHO C[C@@H]1[C@H](C[NH3+])CCCN1Cc1ccc(C2CCC2)cc1 ZINC001205915233 1123083357 /nfs/dbraw/zinc/08/33/57/1123083357.db2.gz OXIFHRMDRZMHKQ-KDOFPFPSSA-N 1 3 272.436 3.513 20 0 CHADHO CC(C)(C)C[NH+]1CCC2(CN(Cc3ccccc3)C2)CC1 ZINC001201442466 1123105541 /nfs/dbraw/zinc/10/55/41/1123105541.db2.gz COJRJHGHTRIVIH-UHFFFAOYSA-N 1 3 286.463 3.631 20 0 CHADHO CC[C@H]1CCCC[N@@H+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167995311 1123106202 /nfs/dbraw/zinc/10/62/02/1123106202.db2.gz ZTBDIWIPDNBAPH-XNHLSEOASA-N 1 3 276.468 3.656 20 0 CHADHO CC[C@H]1CCCC[N@H+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167995311 1123106203 /nfs/dbraw/zinc/10/62/03/1123106203.db2.gz ZTBDIWIPDNBAPH-XNHLSEOASA-N 1 3 276.468 3.656 20 0 CHADHO CCCCCN1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC001201737581 1123143290 /nfs/dbraw/zinc/14/32/90/1123143290.db2.gz VQEMYFSOEJKNEJ-RTBURBONSA-N 1 3 286.463 3.631 20 0 CHADHO CCCCCN1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC001201737581 1123143291 /nfs/dbraw/zinc/14/32/91/1123143291.db2.gz VQEMYFSOEJKNEJ-RTBURBONSA-N 1 3 286.463 3.631 20 0 CHADHO CCCCCN1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001201737540 1123143448 /nfs/dbraw/zinc/14/34/48/1123143448.db2.gz SXUQPKBIHVOHPG-UHFFFAOYSA-N 1 3 286.463 3.699 20 0 CHADHO CCCCCN1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001201737540 1123143449 /nfs/dbraw/zinc/14/34/49/1123143449.db2.gz SXUQPKBIHVOHPG-UHFFFAOYSA-N 1 3 286.463 3.699 20 0 CHADHO CC(C)(C[NH2+]C[C@H]1CCCC(C)(C)C1)CN1CCCC1 ZINC001202241599 1123192878 /nfs/dbraw/zinc/19/28/78/1123192878.db2.gz DZNXLNWJJZBGAF-INIZCTEOSA-N 1 3 280.500 3.914 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]CC1(N)CCCC1 ZINC000665247276 1123260214 /nfs/dbraw/zinc/26/02/14/1123260214.db2.gz ZCCWCYXUVYLPOH-QGZVFWFLSA-N 1 3 297.446 3.715 20 0 CHADHO C[C@H]([NH2+]CC1(N)CCCC1)c1cccc2ccccc21 ZINC000665250672 1123265446 /nfs/dbraw/zinc/26/54/46/1123265446.db2.gz ZCFRAWZXSHHGDT-AWEZNQCLSA-N 1 3 268.404 3.762 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@H]1CC[C@@H](C)c2ccsc21 ZINC000665282498 1123316423 /nfs/dbraw/zinc/31/64/23/1123316423.db2.gz ZGMIYHLZATYXSK-BNOWGMLFSA-N 1 3 266.454 3.650 20 0 CHADHO CC(C)(C[NH2+]C1CCC(C(F)F)CC1)CN1CCCC1 ZINC000442865276 1123343337 /nfs/dbraw/zinc/34/33/37/1123343337.db2.gz TWPVKUCQJZZRCU-UHFFFAOYSA-N 1 3 288.426 3.522 20 0 CHADHO CC(C)(CN[C@H]1C[C@@H]([NH3+])c2ccccc21)CC(F)(F)F ZINC000665301094 1123350408 /nfs/dbraw/zinc/35/04/08/1123350408.db2.gz OCSBKMGFILUBIP-OLZOCXBDSA-N 1 3 286.341 3.699 20 0 CHADHO CCCCN1CCC([N@H+](C)Cc2cc(C)cc(F)c2)CC1 ZINC001143591834 1123415434 /nfs/dbraw/zinc/41/54/34/1123415434.db2.gz LOPLIWBPDWGBOV-UHFFFAOYSA-N 1 3 292.442 3.830 20 0 CHADHO CCCCN1CCC([N@@H+](C)Cc2cc(C)cc(F)c2)CC1 ZINC001143591834 1123415436 /nfs/dbraw/zinc/41/54/36/1123415436.db2.gz LOPLIWBPDWGBOV-UHFFFAOYSA-N 1 3 292.442 3.830 20 0 CHADHO CCCCC[C@H](C)[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000853240651 1123429386 /nfs/dbraw/zinc/42/93/86/1123429386.db2.gz QEEPQUVBPBXUOU-DOTOQJQBSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@@H](c1ccc2ccccc2c1)N1CC[C@H](C[NH+](C)C)C1 ZINC000114198448 1123481650 /nfs/dbraw/zinc/48/16/50/1123481650.db2.gz YMMMAXTWDBFZJV-JKSUJKDBSA-N 1 3 282.431 3.784 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)N1CC[C@H](C[NH+](C)C)C1 ZINC000114198450 1123481668 /nfs/dbraw/zinc/48/16/68/1123481668.db2.gz YMMMAXTWDBFZJV-HZPDHXFCSA-N 1 3 282.431 3.784 20 0 CHADHO CCN(C)C[C@@H]1CC[N@H+](C[C@H](c2ccccc2)C(C)C)C1 ZINC000474263541 1123497451 /nfs/dbraw/zinc/49/74/51/1123497451.db2.gz CYZJBECDSLDYRY-HKUYNNGSSA-N 1 3 288.479 3.700 20 0 CHADHO CCN(C)C[C@@H]1CC[N@@H+](C[C@H](c2ccccc2)C(C)C)C1 ZINC000474263541 1123497454 /nfs/dbraw/zinc/49/74/54/1123497454.db2.gz CYZJBECDSLDYRY-HKUYNNGSSA-N 1 3 288.479 3.700 20 0 CHADHO COc1ccc([C@@H](C)[C@@H](C)[NH2+]CCCN(C)C(C)C)cc1 ZINC000474465206 1123534738 /nfs/dbraw/zinc/53/47/38/1123534738.db2.gz WOKRTFRPXFWHEQ-JKSUJKDBSA-N 1 3 292.467 3.507 20 0 CHADHO COc1ccc([C@@H](C)[C@H](C)[NH2+]CCCN(C)C(C)C)cc1 ZINC000474465201 1123535007 /nfs/dbraw/zinc/53/50/07/1123535007.db2.gz WOKRTFRPXFWHEQ-HOTGVXAUSA-N 1 3 292.467 3.507 20 0 CHADHO C[C@H]([NH2+]C1CCN([C@@H]2CCC[C@@H](C)C2)CC1)C1(C)CC1 ZINC000776883505 1123557278 /nfs/dbraw/zinc/55/72/78/1123557278.db2.gz ZLOMCXVEISFVEH-HLLBOEOZSA-N 1 3 278.484 3.808 20 0 CHADHO CN(C)[C@H]1CCC[N@H+](Cc2ccc3ccccc3c2)CC1 ZINC000429540767 1123585048 /nfs/dbraw/zinc/58/50/48/1123585048.db2.gz UANHFAFGOMPVDE-IBGZPJMESA-N 1 3 282.431 3.756 20 0 CHADHO CN(C)[C@H]1CCC[N@@H+](Cc2ccc3ccccc3c2)CC1 ZINC000429540767 1123585052 /nfs/dbraw/zinc/58/50/52/1123585052.db2.gz UANHFAFGOMPVDE-IBGZPJMESA-N 1 3 282.431 3.756 20 0 CHADHO CN1CCC2(CCC[N@@H+]2Cc2ccc3ccccc3c2)CC1 ZINC000475117609 1123795801 /nfs/dbraw/zinc/79/58/01/1123795801.db2.gz HYXKIZWOHUIOKL-UHFFFAOYSA-N 1 3 294.442 3.900 20 0 CHADHO CN1CCC2(CCC[N@H+]2Cc2ccc3ccccc3c2)CC1 ZINC000475117609 1123795805 /nfs/dbraw/zinc/79/58/05/1123795805.db2.gz HYXKIZWOHUIOKL-UHFFFAOYSA-N 1 3 294.442 3.900 20 0 CHADHO CC(C)c1ccc(C[N@@H+]2CCCC23CCN(C)CC3)cc1 ZINC000475125534 1123797676 /nfs/dbraw/zinc/79/76/76/1123797676.db2.gz SXDVNSXFZINWGV-UHFFFAOYSA-N 1 3 286.463 3.870 20 0 CHADHO CC(C)c1ccc(C[N@H+]2CCCC23CCN(C)CC3)cc1 ZINC000475125534 1123797678 /nfs/dbraw/zinc/79/76/78/1123797678.db2.gz SXDVNSXFZINWGV-UHFFFAOYSA-N 1 3 286.463 3.870 20 0 CHADHO CCc1ccccc1CCN(C)C1CC[NH+](C(C)C)CC1 ZINC000444600794 1124046707 /nfs/dbraw/zinc/04/67/07/1124046707.db2.gz CTYCLQDNOXHBBS-UHFFFAOYSA-N 1 3 288.479 3.596 20 0 CHADHO CC(C)[C@@H]1C[C@H](N[C@H]2CC[N@H+](C)[C@@H](C)C2)c2ccccc21 ZINC000447542241 1124486251 /nfs/dbraw/zinc/48/62/51/1124486251.db2.gz INWLQYCGDSGEMI-LNMJFAINSA-N 1 3 286.463 3.943 20 0 CHADHO CC(C)[C@@H]1C[C@H](N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c2ccccc21 ZINC000447542241 1124486255 /nfs/dbraw/zinc/48/62/55/1124486255.db2.gz INWLQYCGDSGEMI-LNMJFAINSA-N 1 3 286.463 3.943 20 0 CHADHO C[C@H]([NH2+]CCCN1CCCC[C@@H]1C)c1cccs1 ZINC000019913056 1124666090 /nfs/dbraw/zinc/66/60/90/1124666090.db2.gz WLHANWMXSINUEL-KBPBESRZSA-N 1 3 266.454 3.663 20 0 CHADHO C(=C\c1ccccc1)\CCN1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000450429942 1125022816 /nfs/dbraw/zinc/02/28/16/1125022816.db2.gz OGFXQAUBXCEISO-CUPZGDSWSA-N 1 3 284.447 3.508 20 0 CHADHO C[N@H+](CC1CC1)C[C@@H]1CCN(CCC2=CCCCC2)C1 ZINC000450456561 1125033554 /nfs/dbraw/zinc/03/35/54/1125033554.db2.gz UBOXKGJVKGDOME-SFHVURJKSA-N 1 3 276.468 3.541 20 0 CHADHO C[N@@H+](CC1CC1)C[C@@H]1CCN(CCC2=CCCCC2)C1 ZINC000450456561 1125033562 /nfs/dbraw/zinc/03/35/62/1125033562.db2.gz UBOXKGJVKGDOME-SFHVURJKSA-N 1 3 276.468 3.541 20 0 CHADHO CCc1c2ccccc2oc1[C@@H](C)NCC1=CC[N@H+](C)CC1 ZINC000392242982 1125142831 /nfs/dbraw/zinc/14/28/31/1125142831.db2.gz MQRDQYVATWEBPC-CQSZACIVSA-N 1 3 298.430 3.908 20 0 CHADHO CCc1c2ccccc2oc1[C@@H](C)NCC1=CC[N@@H+](C)CC1 ZINC000392242982 1125142834 /nfs/dbraw/zinc/14/28/34/1125142834.db2.gz MQRDQYVATWEBPC-CQSZACIVSA-N 1 3 298.430 3.908 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2c(C)cccc2C)C[C@H]1C ZINC000530663048 1125170339 /nfs/dbraw/zinc/17/03/39/1125170339.db2.gz CLUQXIPNNIGNLN-IAGOWNOFSA-N 1 3 274.452 3.608 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2c(C)cccc2C)C[C@H]1C ZINC000530663048 1125170343 /nfs/dbraw/zinc/17/03/43/1125170343.db2.gz CLUQXIPNNIGNLN-IAGOWNOFSA-N 1 3 274.452 3.608 20 0 CHADHO Cc1csc(C[N@@H+]2CCCC[C@@H]2CCN2CCCC2)c1 ZINC001137157142 1125282789 /nfs/dbraw/zinc/28/27/89/1125282789.db2.gz MMTHHFSVBNVMBT-MRXNPFEDSA-N 1 3 292.492 3.897 20 0 CHADHO Cc1csc(C[N@H+]2CCCC[C@@H]2CCN2CCCC2)c1 ZINC001137157142 1125282795 /nfs/dbraw/zinc/28/27/95/1125282795.db2.gz MMTHHFSVBNVMBT-MRXNPFEDSA-N 1 3 292.492 3.897 20 0 CHADHO C[C@H](c1cccc(Cl)c1)N(C)C[C@@H]1CCC[N@H+](C)C1 ZINC000152364449 1125306666 /nfs/dbraw/zinc/30/66/66/1125306666.db2.gz YWIWBGHRGGAXPR-ZIAGYGMSSA-N 1 3 280.843 3.675 20 0 CHADHO C[C@H](c1cccc(Cl)c1)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000152364449 1125306668 /nfs/dbraw/zinc/30/66/68/1125306668.db2.gz YWIWBGHRGGAXPR-ZIAGYGMSSA-N 1 3 280.843 3.675 20 0 CHADHO CN1CCC[C@H]1CC[NH2+][C@H](c1ccccc1)C1CCC1 ZINC000348267283 1125453137 /nfs/dbraw/zinc/45/31/37/1125453137.db2.gz PUGGNPFLRWNURP-ZWKOTPCHSA-N 1 3 272.436 3.602 20 0 CHADHO C[N@@H+]1CCC[C@H]1CCN[C@H](c1ccccc1)C1CCC1 ZINC000348267283 1125453139 /nfs/dbraw/zinc/45/31/39/1125453139.db2.gz PUGGNPFLRWNURP-ZWKOTPCHSA-N 1 3 272.436 3.602 20 0 CHADHO C[N@H+]1CCC[C@H]1CCN[C@H](c1ccccc1)C1CCC1 ZINC000348267283 1125453146 /nfs/dbraw/zinc/45/31/46/1125453146.db2.gz PUGGNPFLRWNURP-ZWKOTPCHSA-N 1 3 272.436 3.602 20 0 CHADHO CC(C)[N@H+](CC[C@@H]1CCCN1C)Cc1cccc(F)c1 ZINC000348084237 1129280039 /nfs/dbraw/zinc/28/00/39/1129280039.db2.gz WACWSMODLXLFLV-KRWDZBQOSA-N 1 3 278.415 3.520 20 0 CHADHO CC(C)[N@@H+](CC[C@@H]1CCCN1C)Cc1cccc(F)c1 ZINC000348084237 1129280043 /nfs/dbraw/zinc/28/00/43/1129280043.db2.gz WACWSMODLXLFLV-KRWDZBQOSA-N 1 3 278.415 3.520 20 0 CHADHO C/C=C/CN[C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000639353624 1129305247 /nfs/dbraw/zinc/30/52/47/1129305247.db2.gz VNCJJDTZPABANW-OTUKTJHOSA-N 1 3 270.420 3.520 20 0 CHADHO C/C=C/CN[C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000639353624 1129305252 /nfs/dbraw/zinc/30/52/52/1129305252.db2.gz VNCJJDTZPABANW-OTUKTJHOSA-N 1 3 270.420 3.520 20 0 CHADHO CCCCCCN1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246836587 1129336402 /nfs/dbraw/zinc/33/64/02/1129336402.db2.gz OKYYRLXRPXQXIA-DOTOQJQBSA-N 1 3 264.457 3.515 20 0 CHADHO CCCCCCN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246836587 1129336407 /nfs/dbraw/zinc/33/64/07/1129336407.db2.gz OKYYRLXRPXQXIA-DOTOQJQBSA-N 1 3 264.457 3.515 20 0 CHADHO NC[C@@H]1CCC[C@H]1[NH2+]CCc1ccc(-c2ccccc2)cc1 ZINC000643467722 1129442215 /nfs/dbraw/zinc/44/22/15/1129442215.db2.gz XGGPLUBUFGTDBF-VQTJNVASSA-N 1 3 294.442 3.613 20 0 CHADHO CCCCC[C@H](CCC)[NH+]1CCC2(CN(C)C2)CC1 ZINC001258672659 1129486272 /nfs/dbraw/zinc/48/62/72/1129486272.db2.gz DGJBPCWPZIFTTD-INIZCTEOSA-N 1 3 266.473 3.763 20 0 CHADHO c1ccc2c(c1)cccc2C[N@H+](C1CC1)C1CCNCC1 ZINC000647814484 1129585219 /nfs/dbraw/zinc/58/52/19/1129585219.db2.gz PZSCKBDSWGXPBW-UHFFFAOYSA-N 1 3 280.415 3.556 20 0 CHADHO c1ccc2c(c1)cccc2C[N@@H+](C1CC1)C1CCNCC1 ZINC000647814484 1129585223 /nfs/dbraw/zinc/58/52/23/1129585223.db2.gz PZSCKBDSWGXPBW-UHFFFAOYSA-N 1 3 280.415 3.556 20 0 CHADHO c1ccc2c(c1)cccc2CN(C1CC1)C1CC[NH2+]CC1 ZINC000647814484 1129585226 /nfs/dbraw/zinc/58/52/26/1129585226.db2.gz PZSCKBDSWGXPBW-UHFFFAOYSA-N 1 3 280.415 3.556 20 0 CHADHO Fc1ccccc1CN(CCCC1CC[NH2+]CC1)C1CC1 ZINC000647873444 1129586272 /nfs/dbraw/zinc/58/62/72/1129586272.db2.gz KFJNTNKZORBNSJ-UHFFFAOYSA-N 1 3 290.426 3.570 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)N(C[C@H]1CC[NH2+]C1)C1CC1 ZINC000647882035 1129587259 /nfs/dbraw/zinc/58/72/59/1129587259.db2.gz DIKQETHSEWEPJB-CVEARBPZSA-N 1 3 294.442 3.975 20 0 CHADHO C[C@H]1c2c(F)cccc2CCN1CCCC1CC[NH2+]CC1 ZINC000647885766 1129587394 /nfs/dbraw/zinc/58/73/94/1129587394.db2.gz OERICQDAVVGTFX-AWEZNQCLSA-N 1 3 290.426 3.525 20 0 CHADHO CC(C)C[C@H](Cc1ccccc1)[NH2+]CC[C@@H]1CCCN1C ZINC001169058170 1129693694 /nfs/dbraw/zinc/69/36/94/1129693694.db2.gz DIIPOHIJPVOJEQ-MOPGFXCFSA-N 1 3 288.479 3.718 20 0 CHADHO CC(C)c1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)N3C)cc1 ZINC001169092253 1129699916 /nfs/dbraw/zinc/69/99/16/1129699916.db2.gz AUFLQUJGVKIOKG-NNZMDNLPSA-N 1 3 272.436 3.525 20 0 CHADHO Cc1ccc([C@H](C)N[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)c(C)c1 ZINC001169108606 1129703660 /nfs/dbraw/zinc/70/36/60/1129703660.db2.gz TUZDKYQBBYEBKW-NXOAAHMSSA-N 1 3 272.436 3.579 20 0 CHADHO Cc1ccc([C@H](C)N[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(C)c1 ZINC001169108606 1129703662 /nfs/dbraw/zinc/70/36/62/1129703662.db2.gz TUZDKYQBBYEBKW-NXOAAHMSSA-N 1 3 272.436 3.579 20 0 CHADHO Cc1cccc(CN(C2CC2)[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1C ZINC001169153428 1129705566 /nfs/dbraw/zinc/70/55/66/1129705566.db2.gz ISZYNTKGJDHXCV-PMOLBWCYSA-N 1 3 298.474 3.893 20 0 CHADHO Cc1cccc(CN(C2CC2)[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1C ZINC001169153428 1129705567 /nfs/dbraw/zinc/70/55/67/1129705567.db2.gz ISZYNTKGJDHXCV-PMOLBWCYSA-N 1 3 298.474 3.893 20 0 CHADHO CC[NH+]1CCC(NCCSc2ccc(Cl)cc2)CC1 ZINC001169221477 1129709610 /nfs/dbraw/zinc/70/96/10/1129709610.db2.gz IJEWNQQICWDPGS-UHFFFAOYSA-N 1 3 298.883 3.506 20 0 CHADHO Cc1ccccc1[C@@H]1C[C@H]1N[C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000650742410 1129720980 /nfs/dbraw/zinc/72/09/80/1129720980.db2.gz XRCMONIFFTTZQS-CENDIDJXSA-N 1 3 298.474 3.751 20 0 CHADHO Cc1ccc2c(c1)[C@@H](NCc1ccc(C[NH3+])cc1F)CCC2 ZINC000650754290 1129721165 /nfs/dbraw/zinc/72/11/65/1129721165.db2.gz FVOLAEBKBRKIPR-IBGZPJMESA-N 1 3 298.405 3.760 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@@H](C)c1ccc(OC)cc1C ZINC000650756265 1129721893 /nfs/dbraw/zinc/72/18/93/1129721893.db2.gz XYHJBWYDFWGWAH-HNNXBMFYSA-N 1 3 298.430 3.574 20 0 CHADHO [NH3+]Cc1ccc(CN[C@@H](c2ccccc2)C2CC2)c(F)c1 ZINC000650755034 1129722242 /nfs/dbraw/zinc/72/22/42/1129722242.db2.gz XEWNSOPAPUDQBE-SFHVURJKSA-N 1 3 284.378 3.525 20 0 CHADHO Cc1ccc2c(c1)[C@H](NCc1ccc(C[NH3+])cc1F)CCC2 ZINC000650754291 1129722246 /nfs/dbraw/zinc/72/22/46/1129722246.db2.gz FVOLAEBKBRKIPR-LJQANCHMSA-N 1 3 298.405 3.760 20 0 CHADHO C[C@H](NCCCCCCC[NH+]1CCCC1)c1cscn1 ZINC000768102083 1129831490 /nfs/dbraw/zinc/83/14/90/1129831490.db2.gz MYTSSUWKLLHXRE-HNNXBMFYSA-N 1 3 295.496 3.840 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N1CCCC(F)(F)[C@H](F)C1 ZINC001258908251 1129845245 /nfs/dbraw/zinc/84/52/45/1129845245.db2.gz UANVWSBSUSGFOG-UONOGXRCSA-N 1 3 294.405 3.566 20 0 CHADHO CC[C@@H]1CCC[C@@H]([NH2+]CCCN2C[C@H](C)C[C@H](C)C2)C1 ZINC001461046511 1129902656 /nfs/dbraw/zinc/90/26/56/1129902656.db2.gz AXKZQCYGZZNGRY-XMTFNYHQSA-N 1 3 280.500 3.913 20 0 CHADHO C[NH+](C)C[C@@H]1CCN(Cc2ccccc2-c2ccccc2)C1 ZINC000769404593 1129906564 /nfs/dbraw/zinc/90/65/64/1129906564.db2.gz OYRIODIUSRWIDO-KRWDZBQOSA-N 1 3 294.442 3.737 20 0 CHADHO c1ccc([C@@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC2)C2CC2)cc1 ZINC000903062453 1130107644 /nfs/dbraw/zinc/10/76/44/1130107644.db2.gz RVMUQNGBTZUXRH-ZNBHLAFESA-N 1 3 296.458 3.885 20 0 CHADHO c1ccc([C@@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)C2CC2)cc1 ZINC000903062453 1130107647 /nfs/dbraw/zinc/10/76/47/1130107647.db2.gz RVMUQNGBTZUXRH-ZNBHLAFESA-N 1 3 296.458 3.885 20 0 CHADHO CN(C)Cc1cncc(-c2ccc(C[NH2+]C(C)(C)C)cc2)c1 ZINC001240373396 1130282583 /nfs/dbraw/zinc/28/25/83/1130282583.db2.gz IWXIKAOXSKOFOX-UHFFFAOYSA-N 1 3 297.446 3.698 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]C2CCN(C[C@H]3CC=CCC3)CC2)C1 ZINC001170124241 1130285332 /nfs/dbraw/zinc/28/53/32/1130285332.db2.gz FXFGWVXYBMXEJQ-RYRKJORJSA-N 1 3 276.468 3.585 20 0 CHADHO C[C@@H]1CCc2ccccc2[C@@H]1N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000678609518 1130442054 /nfs/dbraw/zinc/44/20/54/1130442054.db2.gz PAZLEKOLQZSPLU-KLICCBINSA-N 1 3 284.447 3.526 20 0 CHADHO C[C@@H]1CCc2ccccc2[C@@H]1N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000678609518 1130442059 /nfs/dbraw/zinc/44/20/59/1130442059.db2.gz PAZLEKOLQZSPLU-KLICCBINSA-N 1 3 284.447 3.526 20 0 CHADHO Cc1cc(C[NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)c(C)o1 ZINC000793206203 1130533689 /nfs/dbraw/zinc/53/36/89/1130533689.db2.gz CNAQDSPHKQXMFS-SFHVURJKSA-N 1 3 298.430 3.508 20 0 CHADHO CCCN1CC[C@@H](C[NH2+]CC(CC)(CC)CC)C1 ZINC000679840841 1130559564 /nfs/dbraw/zinc/55/95/64/1130559564.db2.gz NZQBJLSERRUQFD-HNNXBMFYSA-N 1 3 254.462 3.524 20 0 CHADHO Cc1ccc(CN2CCC[C@@]3(CC[NH2+]C3)C2)c2ccccc12 ZINC001234995318 1130700738 /nfs/dbraw/zinc/70/07/38/1130700738.db2.gz ZUAAEFUFGRVDGT-FQEVSTJZSA-N 1 3 294.442 3.724 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CCC12CCNCC2 ZINC001235103566 1130709903 /nfs/dbraw/zinc/70/99/03/1130709903.db2.gz UZKJDPJTQMFPCG-INIZCTEOSA-N 1 3 264.457 3.587 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CCC12CCNCC2 ZINC001235103566 1130709907 /nfs/dbraw/zinc/70/99/07/1130709907.db2.gz UZKJDPJTQMFPCG-INIZCTEOSA-N 1 3 264.457 3.587 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CCCC12CCNCC2 ZINC001235141338 1130714359 /nfs/dbraw/zinc/71/43/59/1130714359.db2.gz RGBKUCVLYONLMX-KRWDZBQOSA-N 1 3 278.484 3.977 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CCCC12CCNCC2 ZINC001235141338 1130714363 /nfs/dbraw/zinc/71/43/63/1130714363.db2.gz RGBKUCVLYONLMX-KRWDZBQOSA-N 1 3 278.484 3.977 20 0 CHADHO Fc1cccc2c(C[N@@H+]3CCCC34CCNCC4)cccc12 ZINC001235145857 1130714759 /nfs/dbraw/zinc/71/47/59/1130714759.db2.gz WVCNXGOIPVAPHA-UHFFFAOYSA-N 1 3 298.405 3.697 20 0 CHADHO Fc1cccc2c(C[N@H+]3CCCC34CCNCC4)cccc12 ZINC001235145857 1130714763 /nfs/dbraw/zinc/71/47/63/1130714763.db2.gz WVCNXGOIPVAPHA-UHFFFAOYSA-N 1 3 298.405 3.697 20 0 CHADHO Fc1cccc2c(CN3CCCC34CC[NH2+]CC4)cccc12 ZINC001235145857 1130714765 /nfs/dbraw/zinc/71/47/65/1130714765.db2.gz WVCNXGOIPVAPHA-UHFFFAOYSA-N 1 3 298.405 3.697 20 0 CHADHO CCCCc1ccc(CN2CCCC23CC[NH2+]CC3)s1 ZINC001235141357 1130714827 /nfs/dbraw/zinc/71/48/27/1130714827.db2.gz RZCUGDYLWOFFPV-UHFFFAOYSA-N 1 3 292.492 3.809 20 0 CHADHO CCCCc1ccc(C[N@@H+]2CCCC23CCNCC3)s1 ZINC001235141357 1130714832 /nfs/dbraw/zinc/71/48/32/1130714832.db2.gz RZCUGDYLWOFFPV-UHFFFAOYSA-N 1 3 292.492 3.809 20 0 CHADHO CCCCc1ccc(C[N@H+]2CCCC23CCNCC3)s1 ZINC001235141357 1130714836 /nfs/dbraw/zinc/71/48/36/1130714836.db2.gz RZCUGDYLWOFFPV-UHFFFAOYSA-N 1 3 292.492 3.809 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CC[C@]2(C1)CNCC[C@H]2F ZINC001235403555 1130738202 /nfs/dbraw/zinc/73/82/02/1130738202.db2.gz LALPFNBYJQMTAC-GRFNRIFCSA-N 1 3 296.474 3.927 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CC[C@]2(C1)CNCC[C@H]2F ZINC001235403555 1130738208 /nfs/dbraw/zinc/73/82/08/1130738208.db2.gz LALPFNBYJQMTAC-GRFNRIFCSA-N 1 3 296.474 3.927 20 0 CHADHO CC/C=C\CCCCCCN1CC[C@]2(C1)C[NH2+]CC[C@H]2F ZINC001235403555 1130738217 /nfs/dbraw/zinc/73/82/17/1130738217.db2.gz LALPFNBYJQMTAC-GRFNRIFCSA-N 1 3 296.474 3.927 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CC[C@]2(C1)CNCC[C@@H]2F ZINC001235403558 1130739486 /nfs/dbraw/zinc/73/94/86/1130739486.db2.gz LALPFNBYJQMTAC-JWRSSPFQSA-N 1 3 296.474 3.927 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CC[C@]2(C1)CNCC[C@@H]2F ZINC001235403558 1130739490 /nfs/dbraw/zinc/73/94/90/1130739490.db2.gz LALPFNBYJQMTAC-JWRSSPFQSA-N 1 3 296.474 3.927 20 0 CHADHO CC/C=C\CCCCCCN1CC[C@]2(C1)C[NH2+]CC[C@@H]2F ZINC001235403558 1130739497 /nfs/dbraw/zinc/73/94/97/1130739497.db2.gz LALPFNBYJQMTAC-JWRSSPFQSA-N 1 3 296.474 3.927 20 0 CHADHO CCC[C@@H]1CCCC[N@@H+]1Cc1cc2c(s1)CNCC2 ZINC001235694876 1130769190 /nfs/dbraw/zinc/76/91/90/1130769190.db2.gz WWGJPNGISLBJFJ-CQSZACIVSA-N 1 3 278.465 3.548 20 0 CHADHO CCC[C@@H]1CCCC[N@H+]1Cc1cc2c(s1)CNCC2 ZINC001235694876 1130769195 /nfs/dbraw/zinc/76/91/95/1130769195.db2.gz WWGJPNGISLBJFJ-CQSZACIVSA-N 1 3 278.465 3.548 20 0 CHADHO Cc1ccc(-c2ccc(CN3[C@@H]4CC[C@H]3C[C@@H]([NH3+])C4)cc2)o1 ZINC001235808702 1130782567 /nfs/dbraw/zinc/78/25/67/1130782567.db2.gz DKISUZBILBLCOW-BCDXTJNWSA-N 1 3 296.414 3.709 20 0 CHADHO Cc1c(C[N@H+]2C[C@H](N)CC[C@@H]2C)cccc1-c1ccccc1 ZINC001235891742 1130794721 /nfs/dbraw/zinc/79/47/21/1130794721.db2.gz IQJMHKCVFVLDFS-HNAYVOBHSA-N 1 3 294.442 3.974 20 0 CHADHO Cc1c(C[N@@H+]2C[C@H](N)CC[C@@H]2C)cccc1-c1ccccc1 ZINC001235891742 1130794727 /nfs/dbraw/zinc/79/47/27/1130794727.db2.gz IQJMHKCVFVLDFS-HNAYVOBHSA-N 1 3 294.442 3.974 20 0 CHADHO c1cc(C[N@@H+]2CC[C@@H](C3CCCCC3)C2)cc2c1CNC2 ZINC001235949645 1130813909 /nfs/dbraw/zinc/81/39/09/1130813909.db2.gz PQLASXXROFEIIE-GOSISDBHSA-N 1 3 284.447 3.692 20 0 CHADHO c1cc(C[N@H+]2CC[C@@H](C3CCCCC3)C2)cc2c1CNC2 ZINC001235949645 1130813914 /nfs/dbraw/zinc/81/39/14/1130813914.db2.gz PQLASXXROFEIIE-GOSISDBHSA-N 1 3 284.447 3.692 20 0 CHADHO [NH3+]Cc1cccc(-c2cccc(CN3CCCCC3)c2F)c1 ZINC001236012154 1130832642 /nfs/dbraw/zinc/83/26/42/1130832642.db2.gz LOHVXAUKZDPYON-UHFFFAOYSA-N 1 3 298.405 3.937 20 0 CHADHO c1cc(C[N@@H+]2CCC[C@H]2C2CCCCC2)cc2c1CNC2 ZINC001236040975 1130835328 /nfs/dbraw/zinc/83/53/28/1130835328.db2.gz GOBHBNMWKMZZHF-IBGZPJMESA-N 1 3 284.447 3.835 20 0 CHADHO c1cc(C[N@H+]2CCC[C@H]2C2CCCCC2)cc2c1CNC2 ZINC001236040975 1130835334 /nfs/dbraw/zinc/83/53/34/1130835334.db2.gz GOBHBNMWKMZZHF-IBGZPJMESA-N 1 3 284.447 3.835 20 0 CHADHO C[C@@H]1C[C@H](N)C[N@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001236047185 1130837629 /nfs/dbraw/zinc/83/76/29/1130837629.db2.gz LDPSJURSMXUQDK-KGLIPLIRSA-N 1 3 299.462 3.635 20 0 CHADHO C[C@@H]1C[C@H](N)C[N@@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001236047185 1130837636 /nfs/dbraw/zinc/83/76/36/1130837636.db2.gz LDPSJURSMXUQDK-KGLIPLIRSA-N 1 3 299.462 3.635 20 0 CHADHO C[NH2+]C[C@@H]1CCN(Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001236068919 1130847990 /nfs/dbraw/zinc/84/79/90/1130847990.db2.gz YXRWWWMVFPHECV-AWEZNQCLSA-N 1 3 299.462 3.507 20 0 CHADHO c1[nH]c2ccccc2c1[C@H]1CCCN1CC[C@H]1CCCC[NH2+]1 ZINC001236191018 1130883857 /nfs/dbraw/zinc/88/38/57/1130883857.db2.gz JBZAAJUQJQQYRF-DNVCBOLYSA-N 1 3 297.446 3.837 20 0 CHADHO C[N@H+](Cc1ccc(C2CCC2)cc1)[C@@H]1CCCC[C@@H]1N ZINC001236217004 1130894140 /nfs/dbraw/zinc/89/41/40/1130894140.db2.gz MKBMSPILPZBVRQ-ZWKOTPCHSA-N 1 3 272.436 3.656 20 0 CHADHO C[N@@H+](Cc1ccc(C2CCC2)cc1)[C@@H]1CCCC[C@@H]1N ZINC001236217004 1130894144 /nfs/dbraw/zinc/89/41/44/1130894144.db2.gz MKBMSPILPZBVRQ-ZWKOTPCHSA-N 1 3 272.436 3.656 20 0 CHADHO Cc1sc2ccccc2c1C[N@@H+](C)[C@H]1CCCC[C@@H]1N ZINC001236216187 1130894380 /nfs/dbraw/zinc/89/43/80/1130894380.db2.gz IWLHHYIYEQSDHY-HOTGVXAUSA-N 1 3 288.460 3.911 20 0 CHADHO Cc1sc2ccccc2c1C[N@H+](C)[C@H]1CCCC[C@@H]1N ZINC001236216187 1130894384 /nfs/dbraw/zinc/89/43/84/1130894384.db2.gz IWLHHYIYEQSDHY-HOTGVXAUSA-N 1 3 288.460 3.911 20 0 CHADHO c1ccc(-c2ccccc2CN2CCC[NH2+]CCC2)cc1 ZINC001236240719 1130902230 /nfs/dbraw/zinc/90/22/30/1130902230.db2.gz SZQPYQOQJHYNSZ-UHFFFAOYSA-N 1 3 280.415 3.539 20 0 CHADHO CC(C)C[NH2+]Cc1ccc(-c2cc(CN(C)C)ccn2)cc1 ZINC001236430056 1130939675 /nfs/dbraw/zinc/93/96/75/1130939675.db2.gz WFFZTFIMEMGVEQ-UHFFFAOYSA-N 1 3 297.446 3.556 20 0 CHADHO C[C@@H]1C[C@H]1C[N@H+](Cc1ccc(Cl)cc1)C1CCNCC1 ZINC001236452564 1130945512 /nfs/dbraw/zinc/94/55/12/1130945512.db2.gz FVTIAFFBRZFKNZ-HIFRSBDPSA-N 1 3 292.854 3.550 20 0 CHADHO C[C@@H]1C[C@H]1C[N@@H+](Cc1ccc(Cl)cc1)C1CCNCC1 ZINC001236452564 1130945516 /nfs/dbraw/zinc/94/55/16/1130945516.db2.gz FVTIAFFBRZFKNZ-HIFRSBDPSA-N 1 3 292.854 3.550 20 0 CHADHO C[C@@H]1C[C@H]1CN(Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001236452564 1130945519 /nfs/dbraw/zinc/94/55/19/1130945519.db2.gz FVTIAFFBRZFKNZ-HIFRSBDPSA-N 1 3 292.854 3.550 20 0 CHADHO Cc1cc(C[N@H+](CC(C)(C)C)C2CCNCC2)ccc1F ZINC001236456736 1130946158 /nfs/dbraw/zinc/94/61/58/1130946158.db2.gz GKYYBMXLWAHYRI-UHFFFAOYSA-N 1 3 292.442 3.734 20 0 CHADHO Cc1cc(C[N@@H+](CC(C)(C)C)C2CCNCC2)ccc1F ZINC001236456736 1130946160 /nfs/dbraw/zinc/94/61/60/1130946160.db2.gz GKYYBMXLWAHYRI-UHFFFAOYSA-N 1 3 292.442 3.734 20 0 CHADHO Cc1cc(CN(CC(C)(C)C)C2CC[NH2+]CC2)ccc1F ZINC001236456736 1130946161 /nfs/dbraw/zinc/94/61/61/1130946161.db2.gz GKYYBMXLWAHYRI-UHFFFAOYSA-N 1 3 292.442 3.734 20 0 CHADHO Cc1ccc(Cl)cc1CN(C1CCC1)C1CC[NH2+]CC1 ZINC001236638232 1130987152 /nfs/dbraw/zinc/98/71/52/1130987152.db2.gz XCQRJHSGTJQAPQ-UHFFFAOYSA-N 1 3 292.854 3.755 20 0 CHADHO Cc1ccc(Cl)cc1C[N@H+](C1CCC1)C1CCNCC1 ZINC001236638232 1130987154 /nfs/dbraw/zinc/98/71/54/1130987154.db2.gz XCQRJHSGTJQAPQ-UHFFFAOYSA-N 1 3 292.854 3.755 20 0 CHADHO Cc1ccc(Cl)cc1C[N@@H+](C1CCC1)C1CCNCC1 ZINC001236638232 1130987158 /nfs/dbraw/zinc/98/71/58/1130987158.db2.gz XCQRJHSGTJQAPQ-UHFFFAOYSA-N 1 3 292.854 3.755 20 0 CHADHO Cc1c2ccccc2sc1CN1CCC[C@](C)(C[NH3+])C1 ZINC001237057450 1131044164 /nfs/dbraw/zinc/04/41/64/1131044164.db2.gz MWVQNJYBUAGUMT-QGZVFWFLSA-N 1 3 288.460 3.771 20 0 CHADHO CC(C)C1=NCCc2ccc(C[NH+]3C[C@H]4CCC[C@@H]4C3)cc21 ZINC001237880076 1131147169 /nfs/dbraw/zinc/14/71/69/1131147169.db2.gz CPRLZLZBBYAGNF-QZTJIDSGSA-N 1 3 296.458 3.920 20 0 CHADHO CC(C)C1=NCCc2ccc(C[NH+]3C4CCC3CC4)cc21 ZINC001237879900 1131147174 /nfs/dbraw/zinc/14/71/74/1131147174.db2.gz QQQKKIUAGGQDSL-UHFFFAOYSA-N 1 3 282.431 3.815 20 0 CHADHO C[C@H](C[NH3+])CN[C@@H](C)c1ccccc1SC(C)(C)C ZINC000817962405 1131193083 /nfs/dbraw/zinc/19/30/83/1131193083.db2.gz LERTWCPZCWZQGA-OLZOCXBDSA-N 1 3 280.481 3.823 20 0 CHADHO CC(C)(C)C1CC[NH+]([C@H]2CCN[C@@H](C(C)(C)C)C2)CC1 ZINC001246546682 1131593507 /nfs/dbraw/zinc/59/35/07/1131593507.db2.gz LVQMFEJUZCVYGM-JKSUJKDBSA-N 1 3 280.500 3.911 20 0 CHADHO CCCCCC[C@H](CC)[N@@H+]1CCC[C@H](CN)[C@H]1C ZINC001246559389 1131621130 /nfs/dbraw/zinc/62/11/30/1131621130.db2.gz ANKJRNYOQYSXHF-OAGGEKHMSA-N 1 3 254.462 3.795 20 0 CHADHO CCCCCC[C@H](CC)[N@H+]1CCC[C@H](CN)[C@H]1C ZINC001246559389 1131621132 /nfs/dbraw/zinc/62/11/32/1131621132.db2.gz ANKJRNYOQYSXHF-OAGGEKHMSA-N 1 3 254.462 3.795 20 0 CHADHO C[C@@H]1CCC[N@@H+]([C@@H]2CCNC3(CCCCC3)C2)C[C@H]1C ZINC001246577429 1131664948 /nfs/dbraw/zinc/66/49/48/1131664948.db2.gz WLTYRIYXCQNGGH-BRWVUGGUSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H]1CCC[N@H+]([C@@H]2CCNC3(CCCCC3)C2)C[C@H]1C ZINC001246577429 1131664950 /nfs/dbraw/zinc/66/49/50/1131664950.db2.gz WLTYRIYXCQNGGH-BRWVUGGUSA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[N@@H+]1C[C@H](CN)CC[C@@H]1C ZINC001246590679 1131707228 /nfs/dbraw/zinc/70/72/28/1131707228.db2.gz KOXSXBBJXLGTDG-VGWMRTNUSA-N 1 3 254.462 3.506 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[N@H+]1C[C@H](CN)CC[C@@H]1C ZINC001246590679 1131707231 /nfs/dbraw/zinc/70/72/31/1131707231.db2.gz KOXSXBBJXLGTDG-VGWMRTNUSA-N 1 3 254.462 3.506 20 0 CHADHO CCCCCC[C@H](CC)[N@@H+]1CCCC[C@@H](CN)C1 ZINC001246584775 1131693611 /nfs/dbraw/zinc/69/36/11/1131693611.db2.gz UUJHSJZXFJKORY-HOTGVXAUSA-N 1 3 254.462 3.796 20 0 CHADHO CCCCCC[C@H](CC)[N@H+]1CCCC[C@@H](CN)C1 ZINC001246584775 1131693613 /nfs/dbraw/zinc/69/36/13/1131693613.db2.gz UUJHSJZXFJKORY-HOTGVXAUSA-N 1 3 254.462 3.796 20 0 CHADHO C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@]3(CCCCN3)C2)CC(C)(C)C1 ZINC001246614160 1131718729 /nfs/dbraw/zinc/71/87/29/1131718729.db2.gz MNXWGLQKFDMUFJ-NUJGCVRESA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H]1C[C@@H]([N@H+]2CCC[C@@]3(CCCCN3)C2)CC(C)(C)C1 ZINC001246614160 1131718732 /nfs/dbraw/zinc/71/87/32/1131718732.db2.gz MNXWGLQKFDMUFJ-NUJGCVRESA-N 1 3 278.484 3.809 20 0 CHADHO C1CN([C@@H]2CCCC3(CCCCC3)C2)[C@]2(C1)CC[NH2+]C2 ZINC001246646523 1131773479 /nfs/dbraw/zinc/77/34/79/1131773479.db2.gz FRHKVRHVDWRAGA-SJLPKXTDSA-N 1 3 276.468 3.707 20 0 CHADHO CC(C)[N@H+](CC1CC1)[C@@H]1CCNC2(CCCCC2)C1 ZINC001246787293 1131781608 /nfs/dbraw/zinc/78/16/08/1131781608.db2.gz CGQYWTNSIWWOFU-MRXNPFEDSA-N 1 3 264.457 3.562 20 0 CHADHO CC(C)[N@@H+](CC1CC1)[C@@H]1CCNC2(CCCCC2)C1 ZINC001246787293 1131781612 /nfs/dbraw/zinc/78/16/12/1131781612.db2.gz CGQYWTNSIWWOFU-MRXNPFEDSA-N 1 3 264.457 3.562 20 0 CHADHO C[NH2+]CC[C@@H](C)N1CCC[C@H]1c1ccccc1SC ZINC001246884591 1131804117 /nfs/dbraw/zinc/80/41/17/1131804117.db2.gz BZNQXGJMLLWRAJ-HIFRSBDPSA-N 1 3 278.465 3.543 20 0 CHADHO C[NH2+]CC[C@@H](C)N1CCC[C@@H]1c1ccccc1SC ZINC001246884592 1131804165 /nfs/dbraw/zinc/80/41/65/1131804165.db2.gz BZNQXGJMLLWRAJ-UKRRQHHQSA-N 1 3 278.465 3.543 20 0 CHADHO CCC[N@H+](CC(C)C)C1C[C@@H](CC)N[C@H](CC)C1 ZINC001246912762 1131814520 /nfs/dbraw/zinc/81/45/20/1131814520.db2.gz SRDDMFJPVFFWRJ-HUUCEWRRSA-N 1 3 254.462 3.664 20 0 CHADHO CCC[N@@H+](CC(C)C)C1C[C@@H](CC)N[C@H](CC)C1 ZINC001246912762 1131814529 /nfs/dbraw/zinc/81/45/29/1131814529.db2.gz SRDDMFJPVFFWRJ-HUUCEWRRSA-N 1 3 254.462 3.664 20 0 CHADHO C[C@H]([NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)C1CCC1 ZINC000716634467 1132028351 /nfs/dbraw/zinc/02/83/51/1132028351.db2.gz BDVIMWUFTWKQQP-UHMOLFJZSA-N 1 3 298.474 3.818 20 0 CHADHO C1=C[C@H](C[NH2+][C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)CC1 ZINC000716694226 1132029124 /nfs/dbraw/zinc/02/91/24/1132029124.db2.gz RXQMHMAWRPAOLN-LEAZDLGRSA-N 1 3 296.458 3.595 20 0 CHADHO C=C/C=C/CC[NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000716703098 1132030574 /nfs/dbraw/zinc/03/05/74/1132030574.db2.gz XNQITIVWFZXMOE-PRVURJPBSA-N 1 3 296.458 3.761 20 0 CHADHO CN1C(C)(C)CC([NH2+]CC2CC(C)(C)C2)CC1(C)C ZINC001171628877 1132060337 /nfs/dbraw/zinc/06/03/37/1132060337.db2.gz KTWVOIDOBIGSTQ-UHFFFAOYSA-N 1 3 266.473 3.664 20 0 CHADHO C[NH+]1C(C)(C)CC(NCCc2ccccc2F)CC1(C)C ZINC001171618297 1132066126 /nfs/dbraw/zinc/06/61/26/1132066126.db2.gz VEQCRPCRSXPBDC-UHFFFAOYSA-N 1 3 292.442 3.609 20 0 CHADHO CC(C)C([NH2+]C1CC(C)(C)N(C)C(C)(C)C1)C(C)C ZINC001171623187 1132067537 /nfs/dbraw/zinc/06/75/37/1132067537.db2.gz NRPMIUIWCUEIME-UHFFFAOYSA-N 1 3 268.489 3.908 20 0 CHADHO C[C@@H]1CCN1[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172070400 1132121446 /nfs/dbraw/zinc/12/14/46/1132121446.db2.gz ZNTOODNQLPJTFK-YSHGAJCASA-N 1 3 284.447 3.666 20 0 CHADHO C[C@@H]1CCN1[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172070400 1132121449 /nfs/dbraw/zinc/12/14/49/1132121449.db2.gz ZNTOODNQLPJTFK-YSHGAJCASA-N 1 3 284.447 3.666 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cc3ccccc3o1)C2 ZINC001172104671 1132129976 /nfs/dbraw/zinc/12/99/76/1132129976.db2.gz DZRZQPXQSYLGTQ-MUJYYYPQSA-N 1 3 284.403 3.538 20 0 CHADHO CCN(C)C1CC[NH+]([C@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172565560 1132269715 /nfs/dbraw/zinc/26/97/15/1132269715.db2.gz KIVSUZULZBWBGP-MJGOQNOKSA-N 1 3 286.463 3.739 20 0 CHADHO CCN(CCC[NH+](C)C)Cc1c(C)ccc2ccccc21 ZINC001142387845 1132381458 /nfs/dbraw/zinc/38/14/58/1132381458.db2.gz IDRQOYKDWBKFEV-UHFFFAOYSA-N 1 3 284.447 3.922 20 0 CHADHO C[N@@H+](Cc1cc2cnccc2[nH]1)CC1CCCCC1 ZINC001232016386 1132411547 /nfs/dbraw/zinc/41/15/47/1132411547.db2.gz WQNFGACPIACBSG-UHFFFAOYSA-N 1 3 257.381 3.575 20 0 CHADHO C[N@H+](Cc1cc2cnccc2[nH]1)CC1CCCCC1 ZINC001232016386 1132411554 /nfs/dbraw/zinc/41/15/54/1132411554.db2.gz WQNFGACPIACBSG-UHFFFAOYSA-N 1 3 257.381 3.575 20 0 CHADHO C[C@H]1CC[C@H]([N@H+](C)Cc2cc(F)cc(CN(C)C)c2)CC1 ZINC001232148270 1132427580 /nfs/dbraw/zinc/42/75/80/1132427580.db2.gz AIDRLCNMFCCUND-PPUGGXLSSA-N 1 3 292.442 3.898 20 0 CHADHO C[C@H]1CC[C@H]([N@@H+](C)Cc2cc(F)cc(CN(C)C)c2)CC1 ZINC001232148270 1132427588 /nfs/dbraw/zinc/42/75/88/1132427588.db2.gz AIDRLCNMFCCUND-PPUGGXLSSA-N 1 3 292.442 3.898 20 0 CHADHO C[C@H]1CCC[C@H](C)[NH+]1Cc1cc(F)cc(CN(C)C)c1 ZINC001232144202 1132428517 /nfs/dbraw/zinc/42/85/17/1132428517.db2.gz KGBIVJCTXTVSHY-KBPBESRZSA-N 1 3 278.415 3.650 20 0 CHADHO CC[C@@H]1CC[C@@H]([NH+]2C(C)(C)CC(N)CC2(C)C)C1 ZINC001173261858 1132428898 /nfs/dbraw/zinc/42/88/98/1132428898.db2.gz DGINHYKBYWIJSO-TZMCWYRMSA-N 1 3 252.446 3.545 20 0 CHADHO C(C[NH2+][C@@H]1CCCC2(CCCCC2)C1)CN1CCCC1 ZINC001173338292 1132466660 /nfs/dbraw/zinc/46/66/60/1132466660.db2.gz HHCCEXWPAACBHL-QGZVFWFLSA-N 1 3 278.484 3.955 20 0 CHADHO CCCC(C[NH3+])(CCC)Nc1cc2[nH]ccc2c(C)n1 ZINC001163040297 1133127602 /nfs/dbraw/zinc/12/76/02/1133127602.db2.gz JJRIIYWJQZVLQO-UHFFFAOYSA-N 1 3 274.412 3.581 20 0 CHADHO C[NH+]1CCC2(CCN(Cc3ccc(Cl)s3)CC2)CC1 ZINC001204443647 1133448799 /nfs/dbraw/zinc/44/87/99/1133448799.db2.gz BBIJQAICUOFBDD-UHFFFAOYSA-N 1 3 298.883 3.709 20 0 CHADHO [NH3+][C@H]1CCCN(Cc2ccc3oc4ccccc4c3c2)CC1 ZINC001205101229 1133530502 /nfs/dbraw/zinc/53/05/02/1133530502.db2.gz BUAOKXROHNIQBK-HNNXBMFYSA-N 1 3 294.398 3.899 20 0 CHADHO C[C@H]1CN(Cc2ccc(Oc3ccccc3)cc2)C[C@H]1C[NH3+] ZINC001205131362 1133534616 /nfs/dbraw/zinc/53/46/16/1133534616.db2.gz VWZNSBFOJOPXNG-DOTOQJQBSA-N 1 3 296.414 3.506 20 0 CHADHO C[C@H]1CN(Cc2cc3c(s2)C[NH2+]CC3)Cc2ccccc21 ZINC001205164424 1133539801 /nfs/dbraw/zinc/53/98/01/1133539801.db2.gz FSAZPDRAHTUUKX-ZDUSSCGKSA-N 1 3 298.455 3.513 20 0 CHADHO Cc1ccc([C@H](C)C[NH2+]CC[C@H](C)N2CCCCC2)cc1 ZINC001205391379 1133573517 /nfs/dbraw/zinc/57/35/17/1133573517.db2.gz MVLZRHLPZGNRJO-MSOLQXFVSA-N 1 3 288.479 3.953 20 0 CHADHO Cc1c(Cl)ccc(CN2CC[C@@H](C[NH3+])[C@@H](C)CC2)c1F ZINC001205651729 1133600402 /nfs/dbraw/zinc/60/04/02/1133600402.db2.gz IREUYLWGJYZCIL-AAEUAGOBSA-N 1 3 298.833 3.594 20 0 CHADHO CC(C)(C)c1[nH]c2ccccc2c1C[N@@H+]1CCCC[C@H](N)C1 ZINC001205930552 1133631081 /nfs/dbraw/zinc/63/10/81/1133631081.db2.gz ALCUITPXGAPUIJ-AWEZNQCLSA-N 1 3 299.462 3.779 20 0 CHADHO CC(C)(C)c1[nH]c2ccccc2c1C[N@H+]1CCCC[C@H](N)C1 ZINC001205930552 1133631086 /nfs/dbraw/zinc/63/10/86/1133631086.db2.gz ALCUITPXGAPUIJ-AWEZNQCLSA-N 1 3 299.462 3.779 20 0 CHADHO Cc1cc(CN2CCC[C@H](C[NH3+])[C@H](C)C2)c(F)cc1Cl ZINC001206027278 1133644464 /nfs/dbraw/zinc/64/44/64/1133644464.db2.gz VRVMXNSBHWCDBK-CHWSQXEVSA-N 1 3 298.833 3.594 20 0 CHADHO CC(C)=CCCC1=CC[C@H](CN2C[C@@H](C)[C@H]([NH3+])C2)CC1 ZINC001206053218 1133650284 /nfs/dbraw/zinc/65/02/84/1133650284.db2.gz NSZMWWQBSUMOJK-BPQIPLTHSA-N 1 3 276.468 3.738 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@H+]1CCNC[C@@H](C)C1 ZINC001206276574 1133681298 /nfs/dbraw/zinc/68/12/98/1133681298.db2.gz GRUSUBKZJDQAMG-MRXNPFEDSA-N 1 3 294.442 3.703 20 0 CHADHO Cc1ccccc1-c1ccccc1C[N@@H+]1CCNC[C@@H](C)C1 ZINC001206276574 1133681299 /nfs/dbraw/zinc/68/12/99/1133681299.db2.gz GRUSUBKZJDQAMG-MRXNPFEDSA-N 1 3 294.442 3.703 20 0 CHADHO CSc1cc(C)cc(CN2CCCC[C@](C)(C[NH3+])C2)c1 ZINC001206574151 1133721180 /nfs/dbraw/zinc/72/11/80/1133721180.db2.gz PRHJTYBJLYFAJO-QGZVFWFLSA-N 1 3 292.492 3.668 20 0 CHADHO CC(C)[N@H+](CCCc1ccccc1F)[C@@H]1CCCNCC1 ZINC001206580116 1133722176 /nfs/dbraw/zinc/72/21/76/1133722176.db2.gz CIHZKMYJPPIHRD-QGZVFWFLSA-N 1 3 292.442 3.611 20 0 CHADHO CC(C)[N@@H+](CCCc1ccccc1F)[C@@H]1CCCNCC1 ZINC001206580116 1133722179 /nfs/dbraw/zinc/72/21/79/1133722179.db2.gz CIHZKMYJPPIHRD-QGZVFWFLSA-N 1 3 292.442 3.611 20 0 CHADHO CC(C)[N@H+](CC1(C)CCCCC1)[C@H]1CCCNCC1 ZINC001206580069 1133722593 /nfs/dbraw/zinc/72/25/93/1133722593.db2.gz BXWFGMSHJKGTNI-INIZCTEOSA-N 1 3 266.473 3.809 20 0 CHADHO CC(C)[N@@H+](CC1(C)CCCCC1)[C@H]1CCCNCC1 ZINC001206580069 1133722594 /nfs/dbraw/zinc/72/25/94/1133722594.db2.gz BXWFGMSHJKGTNI-INIZCTEOSA-N 1 3 266.473 3.809 20 0 CHADHO NC[C@H]1CCCC[N@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001206623858 1133728819 /nfs/dbraw/zinc/72/88/19/1133728819.db2.gz PORJTHMFKCKLBU-QGZVFWFLSA-N 1 3 294.442 3.914 20 0 CHADHO NC[C@H]1CCCC[N@@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001206623858 1133728823 /nfs/dbraw/zinc/72/88/23/1133728823.db2.gz PORJTHMFKCKLBU-QGZVFWFLSA-N 1 3 294.442 3.914 20 0 CHADHO CCCCc1ccc(CN2C[C@H](C[NH3+])CC[C@H]2C)cc1 ZINC001206769381 1133746140 /nfs/dbraw/zinc/74/61/40/1133746140.db2.gz OXNNFGIHVSDIRQ-QAPCUYQASA-N 1 3 274.452 3.588 20 0 CHADHO CCCC[NH+]1CCC(N(C)CCc2cccc(C)c2)CC1 ZINC001207554869 1133819781 /nfs/dbraw/zinc/81/97/81/1133819781.db2.gz QKDCHAYSAABSMO-UHFFFAOYSA-N 1 3 288.479 3.734 20 0 CHADHO CCN(CC)CC[C@H]([NH2+][C@@H]1CC[C@@H]1C)c1ccccc1 ZINC001207805834 1133849839 /nfs/dbraw/zinc/84/98/39/1133849839.db2.gz KZKUQGIVZBIOQB-JQHSSLGASA-N 1 3 274.452 3.848 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@H]1CC(C)(C)C[C@H]1C ZINC001207857993 1133855008 /nfs/dbraw/zinc/85/50/08/1133855008.db2.gz AGYWAZYUQYBPCW-ILXRZTDVSA-N 1 3 254.462 3.521 20 0 CHADHO CN(C)CC1(C[N@@H+]2CC[C@@H]2c2ccccc2)CCCC1 ZINC001208186122 1133902950 /nfs/dbraw/zinc/90/29/50/1133902950.db2.gz MTTJYCWZKVSDPU-QGZVFWFLSA-N 1 3 272.436 3.555 20 0 CHADHO CN(C)CC1(C[N@H+]2CC[C@@H]2c2ccccc2)CCCC1 ZINC001208186122 1133902955 /nfs/dbraw/zinc/90/29/55/1133902955.db2.gz MTTJYCWZKVSDPU-QGZVFWFLSA-N 1 3 272.436 3.555 20 0 CHADHO CC/C=C\CCCCC[NH+]1CCC2(CN(C)C2)CC1 ZINC001208194481 1133904516 /nfs/dbraw/zinc/90/45/16/1133904516.db2.gz PKBVYLXDUSJGRL-PLNGDYQASA-N 1 3 264.457 3.541 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@@H+]1CCC1CCCC1 ZINC001208694513 1133928911 /nfs/dbraw/zinc/92/89/11/1133928911.db2.gz RCXQCCOOIGHZCV-ZWKOTPCHSA-N 1 3 278.484 3.906 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@H+]1CCC1CCCC1 ZINC001208694513 1133928913 /nfs/dbraw/zinc/92/89/13/1133928913.db2.gz RCXQCCOOIGHZCV-ZWKOTPCHSA-N 1 3 278.484 3.906 20 0 CHADHO C[C@@H](CN(C)CCC[NH+](C)C)c1cccc2ccccc21 ZINC001208702398 1133930521 /nfs/dbraw/zinc/93/05/21/1133930521.db2.gz ABEJDJABJZPJED-INIZCTEOSA-N 1 3 284.447 3.827 20 0 CHADHO c1ccc(CN2CC[C@H](C[N@@H+]3CCC[C@H]4CCC[C@H]43)C2)cc1 ZINC001208954600 1133965373 /nfs/dbraw/zinc/96/53/73/1133965373.db2.gz WOKKQFIIROXDGB-XUVXKRRUSA-N 1 3 298.474 3.773 20 0 CHADHO c1ccc(CN2CC[C@H](C[N@H+]3CCC[C@H]4CCC[C@H]43)C2)cc1 ZINC001208954600 1133965377 /nfs/dbraw/zinc/96/53/77/1133965377.db2.gz WOKKQFIIROXDGB-XUVXKRRUSA-N 1 3 298.474 3.773 20 0 CHADHO C[N@H+](CCCN1CCCCC1)Cc1cccc2cccnc21 ZINC001209449162 1134023853 /nfs/dbraw/zinc/02/38/53/1134023853.db2.gz VSZQQVJGFABRGI-UHFFFAOYSA-N 1 3 297.446 3.543 20 0 CHADHO C[N@@H+](CCCN1CCCCC1)Cc1cccc2cccnc21 ZINC001209449162 1134023858 /nfs/dbraw/zinc/02/38/58/1134023858.db2.gz VSZQQVJGFABRGI-UHFFFAOYSA-N 1 3 297.446 3.543 20 0 CHADHO CC[C@H](c1ccccc1)N(C)CCC[NH+]1CCCCC1 ZINC001209450960 1134024154 /nfs/dbraw/zinc/02/41/54/1134024154.db2.gz PIJKYKXKVZCEMN-GOSISDBHSA-N 1 3 274.452 3.946 20 0 CHADHO CC[C@@H](c1ccccc1)N(C)CCC[NH+]1CCCCC1 ZINC001209450962 1134024481 /nfs/dbraw/zinc/02/44/81/1134024481.db2.gz PIJKYKXKVZCEMN-SFHVURJKSA-N 1 3 274.452 3.946 20 0 CHADHO C[C@@H]1CCN(Cc2ccc(-c3ccccc3)cc2)C[C@H]1C[NH3+] ZINC000317926506 1135176368 /nfs/dbraw/zinc/17/63/68/1135176368.db2.gz PFMAPLDZXNPKBZ-OXQOHEQNSA-N 1 3 294.442 3.770 20 0 CHADHO Cc1c2ccccc2[nH]c1CN1CCC[C@]12CCC[NH2+]CC2 ZINC001222314822 1135223676 /nfs/dbraw/zinc/22/36/76/1135223676.db2.gz IWPFCBQQVNWSBQ-IBGZPJMESA-N 1 3 297.446 3.584 20 0 CHADHO Cc1cc(C)cc([C@H](C)[NH2+]CCCN(C)C(C)C)c1 ZINC000221908904 262322833 /nfs/dbraw/zinc/32/28/33/262322833.db2.gz QXMSLETVHAJHDZ-INIZCTEOSA-N 1 3 262.441 3.684 20 0 CHADHO c1ccc2c(c1)SCC[C@@H]2[NH2+]CCCN1CCCCC1 ZINC000020128814 171016556 /nfs/dbraw/zinc/01/65/56/171016556.db2.gz CAPXGPFIZITGTB-INIZCTEOSA-N 1 3 290.476 3.689 20 0 CHADHO CCC[NH+]1CCC(N[C@H](CC)c2ccc(C)cc2)CC1 ZINC000020189871 171057130 /nfs/dbraw/zinc/05/71/30/171057130.db2.gz SQZNWVSTVWSYIA-GOSISDBHSA-N 1 3 274.452 3.910 20 0 CHADHO Cc1ccc(CNCCC[N@@H+](C)Cc2ccccc2)cc1 ZINC000020552226 171247916 /nfs/dbraw/zinc/24/79/16/171247916.db2.gz KJLSIVJXVALTID-UHFFFAOYSA-N 1 3 282.431 3.607 20 0 CHADHO Cc1ccc(CNCCC[N@H+](C)Cc2ccccc2)cc1 ZINC000020552226 171247917 /nfs/dbraw/zinc/24/79/17/171247917.db2.gz KJLSIVJXVALTID-UHFFFAOYSA-N 1 3 282.431 3.607 20 0 CHADHO CC[C@H]([NH2+]CCCN1CCCC1)c1cccc(Cl)c1 ZINC000021030576 171291778 /nfs/dbraw/zinc/29/17/78/171291778.db2.gz LJZHWJOOCUJDTN-INIZCTEOSA-N 1 3 280.843 3.867 20 0 CHADHO CCC1CCC([NH2+]C2CC(C)(C)NC(C)(C)C2)CC1 ZINC000021031877 171292017 /nfs/dbraw/zinc/29/20/17/171292017.db2.gz LZVNHFJZDGUEDD-UHFFFAOYSA-N 1 3 266.473 3.854 20 0 CHADHO C[C@@H](C[NH2+]CCCN1CCC(C)CC1)c1ccccc1 ZINC000021787838 171322943 /nfs/dbraw/zinc/32/29/43/171322943.db2.gz NRNIHPCLOGIGLE-KRWDZBQOSA-N 1 3 274.452 3.502 20 0 CHADHO Cc1ccccc1[C@@H](C)[NH2+]C[C@@H](C)CN1CCCCC1 ZINC000038041720 174043097 /nfs/dbraw/zinc/04/30/97/174043097.db2.gz CULGSRINXPTZGF-NVXWUHKLSA-N 1 3 274.452 3.768 20 0 CHADHO C[C@H](CN[C@H]1C[C@@H](C)c2ccccc21)C[NH+]1CCCC1 ZINC000313585311 260303349 /nfs/dbraw/zinc/30/33/49/260303349.db2.gz YKVXSEWYLRDOJQ-RKVPGOIHSA-N 1 3 272.436 3.556 20 0 CHADHO C[C@H](C[NH2+][C@H]1C[C@@H](C)c2ccccc21)CN1CCCC1 ZINC000313585311 260303350 /nfs/dbraw/zinc/30/33/50/260303350.db2.gz YKVXSEWYLRDOJQ-RKVPGOIHSA-N 1 3 272.436 3.556 20 0 CHADHO CO[C@H](C)[C@H](C)NC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449272292 260337094 /nfs/dbraw/zinc/33/70/94/260337094.db2.gz VNXOQSAKAAWGON-LSDHHAIUSA-N 1 3 298.515 3.679 20 0 CHADHO CC(C)(C)N1CCC([NH2+][C@@H]2CCc3cc(F)ccc32)CC1 ZINC000129973619 260391981 /nfs/dbraw/zinc/39/19/81/260391981.db2.gz MDCVGBCBUOZKJT-QGZVFWFLSA-N 1 3 290.426 3.666 20 0 CHADHO CC(C)Oc1ccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000130122462 260394438 /nfs/dbraw/zinc/39/44/38/260394438.db2.gz MIIDCWDURZPSBY-HLLBOEOZSA-N 1 3 290.451 3.607 20 0 CHADHO CC(C)Oc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000130122462 260394440 /nfs/dbraw/zinc/39/44/40/260394440.db2.gz MIIDCWDURZPSBY-HLLBOEOZSA-N 1 3 290.451 3.607 20 0 CHADHO CC[NH+]1CCC(N[C@H]2CCc3ccc(C(C)C)cc32)CC1 ZINC000427866576 260868492 /nfs/dbraw/zinc/86/84/92/260868492.db2.gz LZBFESGAWGDQOJ-IBGZPJMESA-N 1 3 286.463 3.871 20 0 CHADHO CCc1ccccc1CCN(C)[C@@H]1CC[N@@H+](CC)[C@@H](C)C1 ZINC000444647405 261056217 /nfs/dbraw/zinc/05/62/17/261056217.db2.gz FBIIKHMWDUPKJU-QFBILLFUSA-N 1 3 288.479 3.596 20 0 CHADHO CCc1ccccc1CCN(C)[C@@H]1CC[N@H+](CC)[C@@H](C)C1 ZINC000444647405 261056219 /nfs/dbraw/zinc/05/62/19/261056219.db2.gz FBIIKHMWDUPKJU-QFBILLFUSA-N 1 3 288.479 3.596 20 0 CHADHO C[C@H]1C[C@H]1C[NH2+]C1CCN(C(C)(C)CC(C)(C)C)CC1 ZINC000449078335 261151496 /nfs/dbraw/zinc/15/14/96/261151496.db2.gz LYNLQALNDWUPFH-GJZGRUSLSA-N 1 3 280.500 3.911 20 0 CHADHO C[C@H]1C[C@H]1CNC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449078335 261151497 /nfs/dbraw/zinc/15/14/97/261151497.db2.gz LYNLQALNDWUPFH-GJZGRUSLSA-N 1 3 280.500 3.911 20 0 CHADHO C[C@H]1CC[C@@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc21 ZINC000249059467 261238992 /nfs/dbraw/zinc/23/89/92/261238992.db2.gz ZQCLAHPYVPZRTG-YBHGAXQMSA-N 1 3 284.447 3.840 20 0 CHADHO C[C@H]1CC[C@@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc21 ZINC000249059467 261238995 /nfs/dbraw/zinc/23/89/95/261238995.db2.gz ZQCLAHPYVPZRTG-YBHGAXQMSA-N 1 3 284.447 3.840 20 0 CHADHO C[C@H](Cc1ccc(F)cc1)[NH2+]CCCN1CCCC[C@@H]1C ZINC000221815701 262300324 /nfs/dbraw/zinc/30/03/24/262300324.db2.gz IOPBIXIKLGPBAE-CVEARBPZSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@H](Cc1ccc(F)cc1)NCCC[N@@H+]1CCCC[C@@H]1C ZINC000221815701 262300325 /nfs/dbraw/zinc/30/03/25/262300325.db2.gz IOPBIXIKLGPBAE-CVEARBPZSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@H](Cc1ccc(F)cc1)NCCC[N@H+]1CCCC[C@@H]1C ZINC000221815701 262300326 /nfs/dbraw/zinc/30/03/26/262300326.db2.gz IOPBIXIKLGPBAE-CVEARBPZSA-N 1 3 292.442 3.611 20 0 CHADHO Cc1ccc(C)c([C@@H](C)[NH2+]CCCN(C)C(C)C)c1 ZINC000221913111 262322714 /nfs/dbraw/zinc/32/27/14/262322714.db2.gz BBKKOXWXOJTICW-MRXNPFEDSA-N 1 3 262.441 3.684 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](c2ccc(C)cc2)C2CCC2)C1 ZINC000187023616 262335243 /nfs/dbraw/zinc/33/52/43/262335243.db2.gz FRANYLXMAQJEJF-QFBILLFUSA-N 1 3 286.463 3.768 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@@H](c2ccc(C)cc2)C2CCC2)C1 ZINC000187023616 262335244 /nfs/dbraw/zinc/33/52/44/262335244.db2.gz FRANYLXMAQJEJF-QFBILLFUSA-N 1 3 286.463 3.768 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@@H](c2ccc(C)cc2)C2CCC2)C1 ZINC000187023616 262335245 /nfs/dbraw/zinc/33/52/45/262335245.db2.gz FRANYLXMAQJEJF-QFBILLFUSA-N 1 3 286.463 3.768 20 0 CHADHO CC[C@@H](C[N@H+](CC)[C@@H]1CCCNCC1)c1ccccc1 ZINC000414714099 263034135 /nfs/dbraw/zinc/03/41/35/263034135.db2.gz LUIILGCXPVTZQD-FUHWJXTLSA-N 1 3 274.452 3.644 20 0 CHADHO CC[C@@H](C[N@@H+](CC)[C@@H]1CCCNCC1)c1ccccc1 ZINC000414714099 263034136 /nfs/dbraw/zinc/03/41/36/263034136.db2.gz LUIILGCXPVTZQD-FUHWJXTLSA-N 1 3 274.452 3.644 20 0 CHADHO CC(C)[C@H]([NH3+])CN[C@H]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000414805984 263051748 /nfs/dbraw/zinc/05/17/48/263051748.db2.gz ZAJBFMFBWCTOKX-XHSDSOJGSA-N 1 3 280.843 3.549 20 0 CHADHO Cc1ccc(C)c(CNCc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000414804916 263051927 /nfs/dbraw/zinc/05/19/27/263051927.db2.gz FMYULUXZCLSMKM-OAHLLOKOSA-N 1 3 268.404 3.613 20 0 CHADHO NC[C@@H]1CCC[C@H]1[NH2+]C1CCC(c2ccc(F)cc2)CC1 ZINC000414812590 263053420 /nfs/dbraw/zinc/05/34/20/263053420.db2.gz XMTZEOYXNWATKR-QZOMQWOVSA-N 1 3 290.426 3.569 20 0 CHADHO Cc1ccc(CC[C@@H](C)NCC2([NH3+])CCCCC2)cc1 ZINC000414837918 263057219 /nfs/dbraw/zinc/05/72/19/263057219.db2.gz HKPXWJCXMWQOEC-MRXNPFEDSA-N 1 3 274.452 3.567 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2c2ccccc2Cl)CCN1 ZINC000414946376 263155253 /nfs/dbraw/zinc/15/52/53/263155253.db2.gz JMBJDJNTWGAHOH-LGWLGOQQSA-N 1 3 292.854 3.706 20 0 CHADHO C[C@@H]1C[C@H](N[C@H]2CCC[C@H]2c2ccccc2Cl)CC[NH2+]1 ZINC000414946376 263155254 /nfs/dbraw/zinc/15/52/54/263155254.db2.gz JMBJDJNTWGAHOH-LGWLGOQQSA-N 1 3 292.854 3.706 20 0 CHADHO Cc1ccccc1-c1cccc(C[NH2+][C@@H]2CCNC[C@H]2C)c1 ZINC000414966367 263169530 /nfs/dbraw/zinc/16/95/30/263169530.db2.gz WNYNWNJSMFKRQN-OXQOHEQNSA-N 1 3 294.442 3.750 20 0 CHADHO [NH3+][C@H]1CCC[C@@H](CNCc2csc(Cl)c2Cl)C1 ZINC000415002928 263204246 /nfs/dbraw/zinc/20/42/46/263204246.db2.gz MQWJCZWDXGRKHI-SCZZXKLOSA-N 1 3 293.263 3.662 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](CNCc2csc(Cl)c2Cl)C1 ZINC000415002930 263204282 /nfs/dbraw/zinc/20/42/82/263204282.db2.gz MQWJCZWDXGRKHI-WCBMZHEXSA-N 1 3 293.263 3.662 20 0 CHADHO Cc1oc2ccccc2c1CN1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000415060912 263259032 /nfs/dbraw/zinc/25/90/32/263259032.db2.gz ZKSRWCQSJOPLOL-MAUKXSAKSA-N 1 3 298.430 3.705 20 0 CHADHO Cc1ccc(CN[C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000415059121 263259041 /nfs/dbraw/zinc/25/90/41/263259041.db2.gz ULHXRPKSKJIODB-SFHVURJKSA-N 1 3 268.404 3.565 20 0 CHADHO c1ccc(C[C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CCCNCC2)cc1 ZINC000415072787 263262819 /nfs/dbraw/zinc/26/28/19/263262819.db2.gz ABNUNEMCOOWFNE-OTWHNJEPSA-N 1 3 286.463 3.520 20 0 CHADHO [NH3+]C[C@H](NCc1cc2ccccc2s1)C1CCCC1 ZINC000415073892 263264373 /nfs/dbraw/zinc/26/43/73/263264373.db2.gz ZZNSYHHHMLDOKY-HNNXBMFYSA-N 1 3 274.433 3.508 20 0 CHADHO C[C@@H](C[C@@H]1CCC[NH2+]1)NCCc1csc2ccccc12 ZINC000415090738 263272761 /nfs/dbraw/zinc/27/27/61/263272761.db2.gz ZKPHAYJELKZCKO-ZFWWWQNUSA-N 1 3 288.460 3.564 20 0 CHADHO Cc1ccccc1CN[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415094675 263272944 /nfs/dbraw/zinc/27/29/44/263272944.db2.gz XQDRYMQOCZPIJB-RBUKOAKNSA-N 1 3 280.415 3.578 20 0 CHADHO CC[NH+](CC)Cc1cccc(CN[C@H]2CC[C@@H]2SC)c1 ZINC000425359415 264141112 /nfs/dbraw/zinc/14/11/12/264141112.db2.gz PZLJFFSZNSBDDL-IRXDYDNUSA-N 1 3 292.492 3.512 20 0 CHADHO CC1(C)CC[C@H](NC[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc21 ZINC000314691655 265178234 /nfs/dbraw/zinc/17/82/34/265178234.db2.gz LSLWAVKKQCMVFL-BEFAXECRSA-N 1 3 298.474 3.873 20 0 CHADHO CC1(C)CC[C@H](NC[C@H]2CC[N@H+](C3CC3)C2)c2ccccc21 ZINC000314691655 265178235 /nfs/dbraw/zinc/17/82/35/265178235.db2.gz LSLWAVKKQCMVFL-BEFAXECRSA-N 1 3 298.474 3.873 20 0 CHADHO c1ccc(CCC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCCN2)cc1 ZINC000093488387 265181906 /nfs/dbraw/zinc/18/19/06/265181906.db2.gz WXXZLLQXQZBJPW-CEXWTWQISA-N 1 3 286.463 3.520 20 0 CHADHO c1ccc(CCCN[C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000093488387 265181911 /nfs/dbraw/zinc/18/19/11/265181911.db2.gz WXXZLLQXQZBJPW-CEXWTWQISA-N 1 3 286.463 3.520 20 0 CHADHO C[N@H+](CCCN[C@@H]1CC(C)(C)OC1(C)C)C1CCCCC1 ZINC000094423980 265242587 /nfs/dbraw/zinc/24/25/87/265242587.db2.gz PEQDHFIBLIEMKH-MRXNPFEDSA-N 1 3 296.499 3.577 20 0 CHADHO C[N@@H+](CCCN[C@@H]1CC(C)(C)OC1(C)C)C1CCCCC1 ZINC000094423980 265242590 /nfs/dbraw/zinc/24/25/90/265242590.db2.gz PEQDHFIBLIEMKH-MRXNPFEDSA-N 1 3 296.499 3.577 20 0 CHADHO CCc1ccc(CN[C@@H](CCC[NH3+])c2ccccc2)s1 ZINC000519111706 265323208 /nfs/dbraw/zinc/32/32/08/265323208.db2.gz TZGJGSYYIBDIMG-KRWDZBQOSA-N 1 3 288.460 3.880 20 0 CHADHO C[C@H](NCc1ccc(C[NH+](C)C)cc1)c1ccccc1 ZINC000119547738 267345202 /nfs/dbraw/zinc/34/52/02/267345202.db2.gz LGAXCSKHSLNQKI-HNNXBMFYSA-N 1 3 268.404 3.599 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](NC2(c3ccc(Cl)cc3)CCC2)C1 ZINC000580095171 327698365 /nfs/dbraw/zinc/69/83/65/327698365.db2.gz KIFMCNMVSCFTJH-CABCVRRESA-N 1 3 278.827 3.579 20 0 CHADHO CN1CCC[C@@H]1CC[N@@H+]1CCC[C@H]1c1ccccc1Cl ZINC000534019861 328033160 /nfs/dbraw/zinc/03/31/60/328033160.db2.gz LTGOTTGCWSGMFB-PBHICJAKSA-N 1 3 292.854 3.961 20 0 CHADHO CN1CCC[C@@H]1CC[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC000534019861 328033162 /nfs/dbraw/zinc/03/31/62/328033162.db2.gz LTGOTTGCWSGMFB-PBHICJAKSA-N 1 3 292.854 3.961 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000129435935 328051411 /nfs/dbraw/zinc/05/14/11/328051411.db2.gz IFNYFGRWWCXWPU-VKJFTORMSA-N 1 3 274.452 3.943 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000129435935 328051413 /nfs/dbraw/zinc/05/14/13/328051413.db2.gz IFNYFGRWWCXWPU-VKJFTORMSA-N 1 3 274.452 3.943 20 0 CHADHO CC[N@@H+]1CC[C@H](NCc2cc3ccccc3s2)[C@H](C)C1 ZINC000571304575 328101173 /nfs/dbraw/zinc/10/11/73/328101173.db2.gz SMMXWYZKPIEGMN-CJNGLKHVSA-N 1 3 288.460 3.721 20 0 CHADHO CC[N@H+]1CC[C@H](NCc2cc3ccccc3s2)[C@H](C)C1 ZINC000571304575 328101175 /nfs/dbraw/zinc/10/11/75/328101175.db2.gz SMMXWYZKPIEGMN-CJNGLKHVSA-N 1 3 288.460 3.721 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+]CCCC2CCCCC2)C1 ZINC000395225067 329284697 /nfs/dbraw/zinc/28/46/97/329284697.db2.gz PKLKUNXGCMLUIX-KRWDZBQOSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@@H](N[C@@H](C)CC[NH+](C)C)c1ccc2ccccc2c1 ZINC000049553119 328371593 /nfs/dbraw/zinc/37/15/93/328371593.db2.gz JDANMSWZDBQRLH-LSDHHAIUSA-N 1 3 270.420 3.831 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@@H](C)CC[NH+](C)C)cc1 ZINC000049553480 328371801 /nfs/dbraw/zinc/37/18/01/328371801.db2.gz NWPKQORRRYSYKB-GJZGRUSLSA-N 1 3 262.441 3.801 20 0 CHADHO C[C@@H]([NH2+]CC[C@H]1CCCCN1C)c1cccc(Cl)c1 ZINC000049856218 328380397 /nfs/dbraw/zinc/38/03/97/328380397.db2.gz CXKZMWZXURBDKU-CZUORRHYSA-N 1 3 280.843 3.865 20 0 CHADHO Cc1ccsc1[C@@H](C)[NH2+]C[C@@H](C)CN1CCCCC1 ZINC000070091860 328386741 /nfs/dbraw/zinc/38/67/41/328386741.db2.gz PIKHIAGYVFTMAA-UKRRQHHQSA-N 1 3 280.481 3.829 20 0 CHADHO CC[C@@H]([NH2+]Cc1ccc(CN(C)C)cc1)C(C)(C)C ZINC000563741447 328499237 /nfs/dbraw/zinc/49/92/37/328499237.db2.gz UDWNUPLRJKKHGJ-MRXNPFEDSA-N 1 3 262.441 3.663 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](N[C@H]2CCCc3sc(Cl)cc32)C1 ZINC000576240739 327025768 /nfs/dbraw/zinc/02/57/68/327025768.db2.gz HSLJHDLITUWRSV-FOGDFJRCSA-N 1 3 284.856 3.638 20 0 CHADHO CC(C)[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCN(C(C)C)C2)C[C@H]1C ZINC000584186659 327062650 /nfs/dbraw/zinc/06/26/50/327062650.db2.gz OZXWPWLTQFWENM-OWSLCNJRSA-N 1 3 280.500 3.767 20 0 CHADHO CC[NH+](CC)CC1CCN(C/C=C\c2ccccc2)CC1 ZINC000506861637 332781418 /nfs/dbraw/zinc/78/14/18/332781418.db2.gz MBXXCASBNOKXLJ-FLIBITNWSA-N 1 3 286.463 3.754 20 0 CHADHO CCCCOc1ccc(CNCc2ccc(C[NH3+])cc2)cc1 ZINC000569340453 327098583 /nfs/dbraw/zinc/09/85/83/327098583.db2.gz MMVNYVZIAYSOHG-UHFFFAOYSA-N 1 3 298.430 3.614 20 0 CHADHO CC1(C)CCC(N[C@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC000132126130 327185549 /nfs/dbraw/zinc/18/55/49/327185549.db2.gz SYWKDEYDXSYBNV-CVEARBPZSA-N 1 3 258.409 3.690 20 0 CHADHO CC1=CC[C@H](NCCC[NH+](C(C)C)C(C)C)CC1 ZINC000559919796 327271650 /nfs/dbraw/zinc/27/16/50/327271650.db2.gz STFDEXWUEYGEQF-INIZCTEOSA-N 1 3 252.446 3.584 20 0 CHADHO CC1=CC[C@H]([NH2+]CCCN(C(C)C)C(C)C)CC1 ZINC000559919796 327271652 /nfs/dbraw/zinc/27/16/52/327271652.db2.gz STFDEXWUEYGEQF-INIZCTEOSA-N 1 3 252.446 3.584 20 0 CHADHO CC(C)[C@@H]1C[C@@H](C[NH2+][C@@H]2CCC[C@@H](N)C2)c2ccccc21 ZINC000566484064 327393914 /nfs/dbraw/zinc/39/39/14/327393914.db2.gz ZOQFEMXJGAFIBW-MKSNKDDYSA-N 1 3 286.463 3.773 20 0 CHADHO C[C@@H](CCN1CC[C@H](C[NH+]2CCCC2)C1)c1ccccc1 ZINC000193992309 329064400 /nfs/dbraw/zinc/06/44/00/329064400.db2.gz IEOLZAIFFRFSIG-ZWKOTPCHSA-N 1 3 286.463 3.598 20 0 CHADHO C[C@@H](CC[N@@H+]1CC[C@H](CN2CCCC2)C1)c1ccccc1 ZINC000193992309 329064402 /nfs/dbraw/zinc/06/44/02/329064402.db2.gz IEOLZAIFFRFSIG-ZWKOTPCHSA-N 1 3 286.463 3.598 20 0 CHADHO C[C@@H](CC[N@H+]1CC[C@H](CN2CCCC2)C1)c1ccccc1 ZINC000193992309 329064403 /nfs/dbraw/zinc/06/44/03/329064403.db2.gz IEOLZAIFFRFSIG-ZWKOTPCHSA-N 1 3 286.463 3.598 20 0 CHADHO CCCN1CC[C@@H](C[NH2+]CC[C@@H](C)c2ccccc2)C1 ZINC000194261395 329080318 /nfs/dbraw/zinc/08/03/18/329080318.db2.gz UVQNXENBKAEVQT-SJORKVTESA-N 1 3 274.452 3.502 20 0 CHADHO C[C@@H]([NH2+]CC1CCN(Cc2cccs2)CC1)C1CCC1 ZINC000178221809 329194659 /nfs/dbraw/zinc/19/46/59/329194659.db2.gz BFMOXAIOXBKMFF-CQSZACIVSA-N 1 3 292.492 3.738 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1C[N@@H+]1CC[C@@H](C2CCN(C)CC2)C1 ZINC000584378548 329307058 /nfs/dbraw/zinc/30/70/58/329307058.db2.gz NYFLATXQIJMOKJ-UHOSZYNNSA-N 1 3 290.495 3.643 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1C[N@H+]1CC[C@@H](C2CCN(C)CC2)C1 ZINC000584378548 329307059 /nfs/dbraw/zinc/30/70/59/329307059.db2.gz NYFLATXQIJMOKJ-UHOSZYNNSA-N 1 3 290.495 3.643 20 0 CHADHO C[C@H](NCCC1CC[NH2+]CC1)c1ccc(F)cc1Cl ZINC000420403492 329764175 /nfs/dbraw/zinc/76/41/75/329764175.db2.gz KZMZLHUGVGVTQE-NSHDSACASA-N 1 3 284.806 3.519 20 0 CHADHO C[NH+](C)Cc1ccc(CNCc2cccc(C3CC3)c2)cc1 ZINC000421336922 329813574 /nfs/dbraw/zinc/81/35/74/329813574.db2.gz XNEWJUZYBXRUKN-UHFFFAOYSA-N 1 3 294.442 3.915 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N[C@@H](C)c1ccncc1Cl ZINC000421805875 330081066 /nfs/dbraw/zinc/08/10/66/330081066.db2.gz YBDHBCLMFMUJQA-KBPBESRZSA-N 1 3 297.874 3.896 20 0 CHADHO C[C@H](NCCCCC[NH+]1CCCC1)c1ccncc1Cl ZINC000421865174 330098896 /nfs/dbraw/zinc/09/88/96/330098896.db2.gz ZETZDQOFCLTEHB-AWEZNQCLSA-N 1 3 295.858 3.652 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H]1CCC[C@@H](C(C)C)C1 ZINC000422712564 330151361 /nfs/dbraw/zinc/15/13/61/330151361.db2.gz IOCDNTOOJSOMOT-NUEKZKHPSA-N 1 3 289.467 3.714 20 0 CHADHO CC[C@@H](C[NH2+][C@H](C)c1ccc(CN)nc1C)c1ccccc1 ZINC000422707544 330151400 /nfs/dbraw/zinc/15/14/00/330151400.db2.gz AIJYGMAVGHETOS-ZBFHGGJFSA-N 1 3 297.446 3.693 20 0 CHADHO CC[C@H](C[NH2+][C@@H](C)c1ccc(CN)nc1C)c1ccccc1 ZINC000422707542 330151427 /nfs/dbraw/zinc/15/14/27/330151427.db2.gz AIJYGMAVGHETOS-GOEBONIOSA-N 1 3 297.446 3.693 20 0 CHADHO CC[C@H](C[NH2+][C@H](C)c1ccc(CN)nc1C)c1ccccc1 ZINC000422707539 330151443 /nfs/dbraw/zinc/15/14/43/330151443.db2.gz AIJYGMAVGHETOS-GDBMZVCRSA-N 1 3 297.446 3.693 20 0 CHADHO C[C@H]1CCNCC[C@@H]1[NH2+]CC(C)(C)c1ccc(Cl)cc1 ZINC000422730223 330152317 /nfs/dbraw/zinc/15/23/17/330152317.db2.gz JHLCUNHINPXINZ-BBRMVZONSA-N 1 3 294.870 3.595 20 0 CHADHO C[C@@H]([NH2+][C@H](CC1CCCCC1)C(C)(C)C)C1CNC1 ZINC000422748447 330153131 /nfs/dbraw/zinc/15/31/31/330153131.db2.gz UQQBFADPKWSVBZ-CZUORRHYSA-N 1 3 266.473 3.569 20 0 CHADHO Fc1ccc([C@H](N[C@H]2CCC[NH2+]CC2)C2CCCC2)cc1 ZINC000422775393 330154650 /nfs/dbraw/zinc/15/46/50/330154650.db2.gz BMFPKOCKNXDYBM-ZWKOTPCHSA-N 1 3 290.426 3.789 20 0 CHADHO c1ccc([C@H](N[C@@H]2CCC[NH2+]CC2)C2CCCC2)cc1 ZINC000422782774 330154900 /nfs/dbraw/zinc/15/49/00/330154900.db2.gz MHBUOGXEZQYWAH-MSOLQXFVSA-N 1 3 272.436 3.650 20 0 CHADHO [NH3+][C@@H]1C[C@H](N[C@@H]2CC[C@@H]3CCC[C@@H]3C2)c2ccccc21 ZINC000422795439 330155595 /nfs/dbraw/zinc/15/55/95/330155595.db2.gz VOOJUKYMQNXDAZ-HFGWPOCOSA-N 1 3 270.420 3.690 20 0 CHADHO C[C@@H](N)C[C@@H](C)[NH2+]CCCc1ccc(Cl)cc1Cl ZINC000422817880 330156155 /nfs/dbraw/zinc/15/61/55/330156155.db2.gz FDFCHVYCAALBPF-GHMZBOCLSA-N 1 3 289.250 3.641 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCCCc1ccc(Cl)cc1Cl ZINC000422817880 330156156 /nfs/dbraw/zinc/15/61/56/330156156.db2.gz FDFCHVYCAALBPF-GHMZBOCLSA-N 1 3 289.250 3.641 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]CCCc1ccc(Cl)cc1Cl ZINC000422817883 330156230 /nfs/dbraw/zinc/15/62/30/330156230.db2.gz FDFCHVYCAALBPF-WDEREUQCSA-N 1 3 289.250 3.641 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCCCc1ccc(Cl)cc1Cl ZINC000422817883 330156231 /nfs/dbraw/zinc/15/62/31/330156231.db2.gz FDFCHVYCAALBPF-WDEREUQCSA-N 1 3 289.250 3.641 20 0 CHADHO c1ccc(C2(CN[C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)CC2)cc1 ZINC000422814832 330156263 /nfs/dbraw/zinc/15/62/63/330156263.db2.gz WFAZWHDBOXHPQF-IPMKNSEASA-N 1 3 298.474 3.619 20 0 CHADHO C[C@@H]1CCNCC[C@H]1[NH2+]CC(C)(C)c1cccc(Cl)c1 ZINC000422819898 330156714 /nfs/dbraw/zinc/15/67/14/330156714.db2.gz JHANSNCQWRHQGE-CZUORRHYSA-N 1 3 294.870 3.595 20 0 CHADHO C[C@@H](N[C@@H](C)C[C@H](C)[NH3+])c1ccc(-c2cccnc2)cc1 ZINC000422831988 330156988 /nfs/dbraw/zinc/15/69/88/330156988.db2.gz XDLISNUFIKMQEG-SOUVJXGZSA-N 1 3 283.419 3.525 20 0 CHADHO Cc1ccccc1[C@@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)C(C)(C)C ZINC000422840940 330157071 /nfs/dbraw/zinc/15/70/71/330157071.db2.gz UWYNGUGGHPEVOY-IXEWLPCDSA-N 1 3 286.463 3.955 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](c1ccc(F)cc1)C1CCCC1 ZINC000422789588 330157408 /nfs/dbraw/zinc/15/74/08/330157408.db2.gz UIZNLZHECHVKLH-OGHNNQOOSA-N 1 3 278.415 3.772 20 0 CHADHO CC(C)(C[NH2+][C@H]1CCC[C@@H]1CN)Cc1cccc(Cl)c1 ZINC000422872564 330158408 /nfs/dbraw/zinc/15/84/08/330158408.db2.gz HOWQBFQYVOKHBA-ZBFHGGJFSA-N 1 3 294.870 3.626 20 0 CHADHO Fc1cccc([C@H](N[C@H]2CCC[NH2+]CC2)C2CCCC2)c1 ZINC000422879354 330158825 /nfs/dbraw/zinc/15/88/25/330158825.db2.gz VETIXEKFLCLOBT-ZWKOTPCHSA-N 1 3 290.426 3.789 20 0 CHADHO C[C@@H](N)C[C@@H](C)[NH2+]CC(C)(C)Cc1cccc(Cl)c1 ZINC000422880672 330158860 /nfs/dbraw/zinc/15/88/60/330158860.db2.gz XKYBGLQFOUUQFA-CHWSQXEVSA-N 1 3 282.859 3.624 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCCc1cccc(-c2ccccc2)c1 ZINC000422883660 330159091 /nfs/dbraw/zinc/15/90/91/330159091.db2.gz CPYIZQBCEBCGQF-HOTGVXAUSA-N 1 3 282.431 3.612 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]CCc1cccc(-c2ccccc2)c1 ZINC000422883660 330159093 /nfs/dbraw/zinc/15/90/93/330159093.db2.gz CPYIZQBCEBCGQF-HOTGVXAUSA-N 1 3 282.431 3.612 20 0 CHADHO Cc1ccccc1C1(CN[C@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC000422901428 330162169 /nfs/dbraw/zinc/16/21/69/330162169.db2.gz KTRPITIBBBDHJZ-OALUTQOASA-N 1 3 292.426 3.761 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@H]1NCCc1ccc2ccccc2c1 ZINC000422950983 330163990 /nfs/dbraw/zinc/16/39/90/330163990.db2.gz ZHDZWLVNSQIWHU-RTBURBONSA-N 1 3 282.431 3.632 20 0 CHADHO c1ccc([C@H]2C[C@H](N[C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)C2)cc1 ZINC000422968665 330164502 /nfs/dbraw/zinc/16/45/02/330164502.db2.gz RTRBKUSCIKASKP-LASHMREHSA-N 1 3 298.474 3.833 20 0 CHADHO CS[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCCN1)C(C)(C)C ZINC000423036771 330166410 /nfs/dbraw/zinc/16/64/10/330166410.db2.gz UTEQPIYJNOWZDF-CAOSSQGBSA-N 1 3 298.540 3.665 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]C1CCC(c2ccc(F)cc2)CC1 ZINC000423037482 330166447 /nfs/dbraw/zinc/16/64/47/330166447.db2.gz WBCMTTXIAXOEFL-DVAZGXKRSA-N 1 3 278.415 3.567 20 0 CHADHO CC[C@H](CC(F)(F)F)N[C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000423037585 330166586 /nfs/dbraw/zinc/16/65/86/330166586.db2.gz MZTXQBGSVDGBEU-UPJWGTAASA-N 1 3 280.378 3.618 20 0 CHADHO CC(C)c1cccc(CN[C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)c1 ZINC000423056984 330167774 /nfs/dbraw/zinc/16/77/74/330167774.db2.gz YPEMSHDHBSKSRX-IPMKNSEASA-N 1 3 286.463 3.820 20 0 CHADHO C[C@@H]1CCNCC[C@@H]1[NH2+][C@H]1CCC[C@H](c2ccccc2)C1 ZINC000423069860 330168197 /nfs/dbraw/zinc/16/81/97/330168197.db2.gz FDNFZEZMJKKEPH-BVBHFADKSA-N 1 3 286.463 3.691 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCC[C@H](c2ccccc2)C1 ZINC000423077674 330168533 /nfs/dbraw/zinc/16/85/33/330168533.db2.gz MPHRVNFJYXNYLX-VJANTYMQSA-N 1 3 286.463 3.820 20 0 CHADHO CSc1ccc(CCN[C@@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000423094924 330169480 /nfs/dbraw/zinc/16/94/80/330169480.db2.gz KZNIJBJCTRZLSC-ZWKOTPCHSA-N 1 3 298.455 3.685 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[C@@H](c2cccc(F)c2)C1 ZINC000423092882 330169575 /nfs/dbraw/zinc/16/95/75/330169575.db2.gz DTQOHWNRDXBDIJ-ATLSCFEFSA-N 1 3 290.426 3.569 20 0 CHADHO NC[C@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423099402 330170070 /nfs/dbraw/zinc/17/00/70/330170070.db2.gz UCXFKMOWZMYLLY-MUIFIZLQSA-N 1 3 292.854 3.693 20 0 CHADHO NC[C@@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423099403 330170255 /nfs/dbraw/zinc/17/02/55/330170255.db2.gz UCXFKMOWZMYLLY-NXNVCVFFSA-N 1 3 292.854 3.693 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423105646 330170538 /nfs/dbraw/zinc/17/05/38/330170538.db2.gz ZDNWGOWSTUXPQM-OTRWWLKZSA-N 1 3 292.854 3.693 20 0 CHADHO C[C@@H](C[C@H]1CCCCC[NH2+]1)NCC1(C(F)(F)F)CCC1 ZINC000423111255 330170740 /nfs/dbraw/zinc/17/07/40/330170740.db2.gz QKRYYFVEYOGQFD-QWHCGFSZSA-N 1 3 292.389 3.619 20 0 CHADHO Cc1ccccc1[C@H]1C[C@H](N[C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000423111947 330170862 /nfs/dbraw/zinc/17/08/62/330170862.db2.gz WZKCZGDHRMDRJS-CVYSASLGSA-N 1 3 298.474 3.751 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NC[C@@H]2C[C@H]2c2ccccc2)c2ccccc21 ZINC000423127992 330171633 /nfs/dbraw/zinc/17/16/33/330171633.db2.gz CTGYCMXSMAKNAX-WQANXHIZSA-N 1 3 278.399 3.525 20 0 CHADHO C[C@@H](N[C@@H](C)c1cccc(C2CC2)c1)[C@@H]1CCC[NH2+]C1 ZINC000423143149 330172462 /nfs/dbraw/zinc/17/24/62/330172462.db2.gz CLXYQJSJSOYTMV-PMUMKWKESA-N 1 3 272.436 3.603 20 0 CHADHO CC(C)=CCC[C@H](C)N[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423150605 330172845 /nfs/dbraw/zinc/17/28/45/330172845.db2.gz BLKSXMAKTMGSFD-RRQGHBQHSA-N 1 3 258.409 3.856 20 0 CHADHO CC[C@@H]1CCCC[C@@H]1C[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000423166533 330174143 /nfs/dbraw/zinc/17/41/43/330174143.db2.gz ZKKFDOHFQYFMAO-FVQBIDKESA-N 1 3 289.467 3.716 20 0 CHADHO C[C@H](C[C@H]1CCCCC[NH2+]1)N1CCC[C@]2(CCSC2)C1 ZINC000423167812 330174244 /nfs/dbraw/zinc/17/42/44/330174244.db2.gz XGUJSAUTOQCHAR-ZACQAIPSSA-N 1 3 296.524 3.516 20 0 CHADHO C[C@H](C[C@@H]1CCCCC[NH2+]1)N1CCC[C@]2(CCSC2)C1 ZINC000423167810 330174303 /nfs/dbraw/zinc/17/43/03/330174303.db2.gz XGUJSAUTOQCHAR-IKGGRYGDSA-N 1 3 296.524 3.516 20 0 CHADHO Clc1cccc([C@H]2CCC[C@H]([NH2+]C3CCNCC3)C2)c1 ZINC000423171159 330174496 /nfs/dbraw/zinc/17/44/96/330174496.db2.gz ZNNQMAWIYKTMJY-YOEHRIQHSA-N 1 3 292.854 3.708 20 0 CHADHO CC1(C)[C@H](NCC2([NH3+])CCCCC2)C[C@H]1c1ccccc1 ZINC000423176624 330175211 /nfs/dbraw/zinc/17/52/11/330175211.db2.gz HJXWXYMTBCWIRB-DLBZAZTESA-N 1 3 286.463 3.820 20 0 CHADHO CC1(C)[C@@H](NCC2([NH3+])CCCCC2)C[C@H]1c1ccccc1 ZINC000423176626 330175239 /nfs/dbraw/zinc/17/52/39/330175239.db2.gz HJXWXYMTBCWIRB-IRXDYDNUSA-N 1 3 286.463 3.820 20 0 CHADHO Cc1ccccc1C[C@@H](NCC1([NH3+])CCCCC1)C1CC1 ZINC000423179912 330175319 /nfs/dbraw/zinc/17/53/19/330175319.db2.gz MYXCESJMGDHLKG-GOSISDBHSA-N 1 3 286.463 3.567 20 0 CHADHO COc1ccc([C@@H](CCC(C)C)[NH2+]C2CCNCC2)cc1 ZINC000423190928 330176016 /nfs/dbraw/zinc/17/60/16/330176016.db2.gz SYMVOXNWAWOLCG-GOSISDBHSA-N 1 3 290.451 3.514 20 0 CHADHO c1ccc([C@H](NC[C@@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC000423210043 330177711 /nfs/dbraw/zinc/17/77/11/330177711.db2.gz JMCOXPDMVFPEIC-QAPCUYQASA-N 1 3 272.436 3.507 20 0 CHADHO c1ccc([C@H]([NH2+]C[C@@H]2CCCNC2)C2CCCC2)cc1 ZINC000423210043 330177712 /nfs/dbraw/zinc/17/77/12/330177712.db2.gz JMCOXPDMVFPEIC-QAPCUYQASA-N 1 3 272.436 3.507 20 0 CHADHO C[C@@H](NC[C@@H]1CCC[NH2+]C1)c1cc2ccccc2s1 ZINC000423217451 330178645 /nfs/dbraw/zinc/17/86/45/330178645.db2.gz UFSAIZFZFCULQD-CHWSQXEVSA-N 1 3 274.433 3.552 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCCNC1)c1cc2ccccc2s1 ZINC000423217451 330178647 /nfs/dbraw/zinc/17/86/47/330178647.db2.gz UFSAIZFZFCULQD-CHWSQXEVSA-N 1 3 274.433 3.552 20 0 CHADHO CCc1ccc([C@H](CC)N[C@H](C)[C@H]2CCC[NH2+]C2)cc1 ZINC000423221915 330179659 /nfs/dbraw/zinc/17/96/59/330179659.db2.gz YRQZVBQNPKEVNM-JLSDUUJJSA-N 1 3 274.452 3.678 20 0 CHADHO CCc1ccc([C@H](CC)[NH2+][C@H](C)[C@H]2CCCNC2)cc1 ZINC000423221915 330179661 /nfs/dbraw/zinc/17/96/61/330179661.db2.gz YRQZVBQNPKEVNM-JLSDUUJJSA-N 1 3 274.452 3.678 20 0 CHADHO C[C@H](N)CC[NH2+][C@@H]1CCC[C@@H](c2cccc(Cl)c2)C1 ZINC000423222642 330179761 /nfs/dbraw/zinc/17/97/61/330179761.db2.gz BYQQXPIOWAKZFS-JGGQBBKZSA-N 1 3 280.843 3.693 20 0 CHADHO CC(C)Oc1ccc([C@@H](C)NCC[C@H](C)[NH3+])cc1Cl ZINC000423227889 330180343 /nfs/dbraw/zinc/18/03/43/330180343.db2.gz XJYDKKACGZZJBQ-NWDGAFQWSA-N 1 3 284.831 3.515 20 0 CHADHO Cc1ccccc1[C@H](NCC[C@H](C)[NH3+])C1CCCC1 ZINC000423226593 330180428 /nfs/dbraw/zinc/18/04/28/330180428.db2.gz RKAAASMYKBJFGA-WMLDXEAASA-N 1 3 260.425 3.553 20 0 CHADHO C[NH2+]C[C@@H](C)CN[C@@H]1CCCc2c3ccccc3sc21 ZINC000423276715 330185082 /nfs/dbraw/zinc/18/50/82/330185082.db2.gz OWLWLMQGZFMGGA-IUODEOHRSA-N 1 3 288.460 3.724 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H]2CCCc3sccc32)cc1 ZINC000423290262 330186677 /nfs/dbraw/zinc/18/66/77/330186677.db2.gz CODVEGOKIYATDP-WBMJQRKESA-N 1 3 286.444 3.935 20 0 CHADHO COc1ccsc1[C@@H](C)NCc1ccc([C@H](C)[NH3+])cc1 ZINC000423291533 330187220 /nfs/dbraw/zinc/18/72/20/330187220.db2.gz ISUOFWWAGSTTAZ-NWDGAFQWSA-N 1 3 290.432 3.627 20 0 CHADHO CO[C@H](c1ccccc1)[C@@H](C)NCc1ccc([C@@H](C)[NH3+])cc1 ZINC000423292410 330187434 /nfs/dbraw/zinc/18/74/34/330187434.db2.gz MWPFYBGHDQRWFI-CLCXKQKWSA-N 1 3 298.430 3.572 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H](c2ccccc2)C2CC2)cc1 ZINC000423293414 330187862 /nfs/dbraw/zinc/18/78/62/330187862.db2.gz RHMHAMLCFWAYGL-AUUYWEPGSA-N 1 3 280.415 3.947 20 0 CHADHO CCC[C@H](NC[C@@H](C)C[NH3+])c1cccc(C(F)(F)F)c1 ZINC000423296097 330188227 /nfs/dbraw/zinc/18/82/27/330188227.db2.gz GCZZXACNSLVYMZ-FZMZJTMJSA-N 1 3 288.357 3.731 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H]2CCCc3ccc(O)cc32)cc1 ZINC000423295170 330188390 /nfs/dbraw/zinc/18/83/90/330188390.db2.gz WHDIJLGFUAVOIL-YJYMSZOUSA-N 1 3 296.414 3.579 20 0 CHADHO C[C@H](C[NH3+])CN[C@H](c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000423296955 330188518 /nfs/dbraw/zinc/18/85/18/330188518.db2.gz ICBGMYYTDOLVPJ-OTYXRUKQSA-N 1 3 287.234 3.629 20 0 CHADHO C[C@@H](NC[C@@H](C)C[NH3+])c1cccc(-c2ccccc2)c1 ZINC000423297731 330188538 /nfs/dbraw/zinc/18/85/38/330188538.db2.gz LMZWXIAUGLCXGX-LSDHHAIUSA-N 1 3 268.404 3.599 20 0 CHADHO COc1ccccc1-c1ccc([C@H](C)NC[C@@H](C)C[NH3+])cc1 ZINC000423302556 330188907 /nfs/dbraw/zinc/18/89/07/330188907.db2.gz VRRMRUMTLBJTBT-GJZGRUSLSA-N 1 3 298.430 3.608 20 0 CHADHO CC[C@H](NC[C@H](C)C[NH3+])c1ccc(Cl)c(Cl)c1 ZINC000423300889 330188965 /nfs/dbraw/zinc/18/89/65/330188965.db2.gz SJZFLKZXFBVBAQ-RNCFNFMXSA-N 1 3 275.223 3.629 20 0 CHADHO Cc1ccsc1[C@@H](Cc1ccccc1)NC[C@@H](C)C[NH3+] ZINC000423303064 330189000 /nfs/dbraw/zinc/18/90/00/330189000.db2.gz WMFPCHHDOXFEQD-XJKSGUPXSA-N 1 3 288.460 3.525 20 0 CHADHO Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]C[C@@H](C)CN ZINC000423303064 330189001 /nfs/dbraw/zinc/18/90/01/330189001.db2.gz WMFPCHHDOXFEQD-XJKSGUPXSA-N 1 3 288.460 3.525 20 0 CHADHO C[C@H](C[NH3+])CN[C@H](C)c1ccc(-c2ccccc2)s1 ZINC000423302656 330189100 /nfs/dbraw/zinc/18/91/00/330189100.db2.gz HQWRJLNPLCOLBO-CHWSQXEVSA-N 1 3 274.433 3.661 20 0 CHADHO C[C@H](C[NH3+])CN[C@@H](C)c1cccc(OCc2ccccc2)c1 ZINC000423304623 330189240 /nfs/dbraw/zinc/18/92/40/330189240.db2.gz ZGSBGIQXMZWCFK-CVEARBPZSA-N 1 3 298.430 3.511 20 0 CHADHO C[C@H](CN)C[NH2+][C@H]1CCC[C@@H](c2cccc(Cl)c2)C1 ZINC000423309523 330189384 /nfs/dbraw/zinc/18/93/84/330189384.db2.gz PYFCOOKGWWTKCQ-XPKDYRNWSA-N 1 3 280.843 3.551 20 0 CHADHO C[C@H](CN)C[NH2+][C@H]1CCC[C@H](c2cccc(Cl)c2)C1 ZINC000423309520 330189438 /nfs/dbraw/zinc/18/94/38/330189438.db2.gz PYFCOOKGWWTKCQ-INWMFGNUSA-N 1 3 280.843 3.551 20 0 CHADHO CC[C@H]([NH2+]C[C@H](N)C1CC1)c1ccc(Cl)c(Cl)c1 ZINC000423312260 330189510 /nfs/dbraw/zinc/18/95/10/330189510.db2.gz DBCHQZOMPMEGQW-KBPBESRZSA-N 1 3 287.234 3.771 20 0 CHADHO C[C@H]([NH2+]C[C@@H](N)C1CC1)c1cccc(-c2ccccc2)c1 ZINC000423329658 330191103 /nfs/dbraw/zinc/19/11/03/330191103.db2.gz TVXKNCLCSNHFHP-IFXJQAMLSA-N 1 3 280.415 3.742 20 0 CHADHO CCc1c2cc(C)ccc2oc1[C@@H](C)NCC1=CC[NH2+]CC1 ZINC000423331801 330191317 /nfs/dbraw/zinc/19/13/17/330191317.db2.gz CXWYTZKWTLENCG-CQSZACIVSA-N 1 3 298.430 3.874 20 0 CHADHO Cc1cccc([C@H](NCCCC[NH3+])c2cccc(F)c2)c1 ZINC000423334952 330191568 /nfs/dbraw/zinc/19/15/68/330191568.db2.gz SXUMMNBXKYUEHF-SFHVURJKSA-N 1 3 286.394 3.552 20 0 CHADHO CC(C)[C@H](CCc1ccccc1)[NH2+]C[C@]1(C)CCCNC1 ZINC000423338855 330191709 /nfs/dbraw/zinc/19/17/09/330191709.db2.gz UZSFKSFDVGBHHD-RBUKOAKNSA-N 1 3 288.479 3.623 20 0 CHADHO C[C@@H](NCC1=CC[NH2+]CC1)c1cc(Cl)cc(Cl)c1 ZINC000423344491 330192392 /nfs/dbraw/zinc/19/23/92/330192392.db2.gz MXFGKFFNTCZJHS-SNVBAGLBSA-N 1 3 285.218 3.564 20 0 CHADHO C[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CNC3)CC(C)(C)C1 ZINC000423354838 330193127 /nfs/dbraw/zinc/19/31/27/330193127.db2.gz HDMNZDGLKTUBLH-GUYCJALGSA-N 1 3 272.436 3.594 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000423361351 330193752 /nfs/dbraw/zinc/19/37/52/330193752.db2.gz AFHDZWLJJITMOE-QCPWZWHMSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2CCCCc3ccc(Cl)cc32)CCN1 ZINC000423363524 330194041 /nfs/dbraw/zinc/19/40/41/330194041.db2.gz AMXIAZOBJMZCIM-VMGRFDJRSA-N 1 3 292.854 3.838 20 0 CHADHO C[C@H](NCC[C@H]1CCC[NH2+]1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423364499 330194422 /nfs/dbraw/zinc/19/44/22/330194422.db2.gz OPZPOFNFZBENBH-QNWHQSFQSA-N 1 3 298.883 3.625 20 0 CHADHO c1cc(C[NH2+][C@@H]2CCCCC23CCCC3)cc2c1CNC2 ZINC000423366778 330194765 /nfs/dbraw/zinc/19/47/65/330194765.db2.gz CHDZSTLQXNXBCC-GOSISDBHSA-N 1 3 284.447 3.882 20 0 CHADHO CC(C)[C@H](N[C@@H]1CCC[C@@H]([NH3+])C1)c1ccc(F)c(F)c1 ZINC000423370968 330195002 /nfs/dbraw/zinc/19/50/02/330195002.db2.gz GEVCXDGLTVQRHS-IOASZLSFSA-N 1 3 282.378 3.521 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423403892 330196348 /nfs/dbraw/zinc/19/63/48/330196348.db2.gz SHQLBOMZYTWZEO-JLZZUVOBSA-N 1 3 292.854 3.769 20 0 CHADHO CC(C)Sc1ccc([C@H](C)[NH2+][C@@H]2CCNC[C@@H]2C)cc1 ZINC000423405926 330196678 /nfs/dbraw/zinc/19/66/78/330196678.db2.gz UJMACRNPQSLPMS-GRDNDAEWSA-N 1 3 292.492 3.836 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000423409988 330197332 /nfs/dbraw/zinc/19/73/32/330197332.db2.gz ZHYGMLYCGAJGNP-UOJCXKCYSA-N 1 3 292.854 3.564 20 0 CHADHO CC(C)c1nc([C@H](C)NC[C@H]2CC[C@H](C[NH3+])CC2)cs1 ZINC000423426919 330198357 /nfs/dbraw/zinc/19/83/57/330198357.db2.gz PSMFPLPNTWFSPU-IHRRRGAJSA-N 1 3 295.496 3.682 20 0 CHADHO CC[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccsc1 ZINC000423375814 330198595 /nfs/dbraw/zinc/19/85/95/330198595.db2.gz IXJDNSVFOIJFNB-MRXNPFEDSA-N 1 3 272.417 3.592 20 0 CHADHO CCc1ccc([C@H](N[C@H]2CC[NH2+][C@@H](C)C2)C(C)C)cc1 ZINC000423378618 330198864 /nfs/dbraw/zinc/19/88/64/330198864.db2.gz MIEAGSSLVZDOHO-JCGIZDLHSA-N 1 3 274.452 3.676 20 0 CHADHO CCc1ccc([C@H]([NH2+][C@H]2CCN[C@@H](C)C2)C(C)C)cc1 ZINC000423378618 330198865 /nfs/dbraw/zinc/19/88/65/330198865.db2.gz MIEAGSSLVZDOHO-JCGIZDLHSA-N 1 3 274.452 3.676 20 0 CHADHO C[C@H]1CC(C)(C)CC[C@H]1[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423381973 330199196 /nfs/dbraw/zinc/19/91/96/330199196.db2.gz JQIXWSXGMMZJCB-SUMWQHHRSA-N 1 3 272.436 3.594 20 0 CHADHO CC[C@H](N[C@@H]1CCC[C@@H]([NH3+])C1)c1ccc(Cl)s1 ZINC000423384289 330199634 /nfs/dbraw/zinc/19/96/34/330199634.db2.gz KSFAKOUBOQIYCX-MXWKQRLJSA-N 1 3 272.845 3.712 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423388663 330199937 /nfs/dbraw/zinc/19/99/37/330199937.db2.gz UNHGCUUDRHENTE-RXGFPQBGSA-N 1 3 298.883 3.624 20 0 CHADHO C[C@H](N[C@@H]1CC[NH2+][C@H](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423388663 330199939 /nfs/dbraw/zinc/19/99/39/330199939.db2.gz UNHGCUUDRHENTE-RXGFPQBGSA-N 1 3 298.883 3.624 20 0 CHADHO CC(C)[C@H](CSc1ccccc1)N[C@@H]1CCC[C@H]([NH3+])C1 ZINC000423391107 330200176 /nfs/dbraw/zinc/20/01/76/330200176.db2.gz PIBGTSCQBMEPIE-UXLLHSPISA-N 1 3 292.492 3.663 20 0 CHADHO CC(C)[C@H](CSc1ccccc1)[NH2+][C@@H]1CCC[C@H](N)C1 ZINC000423391107 330200177 /nfs/dbraw/zinc/20/01/77/330200177.db2.gz PIBGTSCQBMEPIE-UXLLHSPISA-N 1 3 292.492 3.663 20 0 CHADHO C[C@@H]1C[C@H](N[C@H](c2ccccc2)C2CCCC2)CC[NH2+]1 ZINC000423395951 330200894 /nfs/dbraw/zinc/20/08/94/330200894.db2.gz TXAWYDTTXCSTKV-ZTFGCOKTSA-N 1 3 272.436 3.648 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2)C2CCCC2)CCN1 ZINC000423395951 330200896 /nfs/dbraw/zinc/20/08/96/330200896.db2.gz TXAWYDTTXCSTKV-ZTFGCOKTSA-N 1 3 272.436 3.648 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000423395781 330200910 /nfs/dbraw/zinc/20/09/10/330200910.db2.gz NNPGYIZWRAJCSY-XYPHTWIQSA-N 1 3 292.442 3.891 20 0 CHADHO Cc1nc(C(C)(C)C)sc1[C@H](C)N[C@H]1CCC[C@H]([NH3+])C1 ZINC000423395097 330200926 /nfs/dbraw/zinc/20/09/26/330200926.db2.gz RRGSBHDTGNMNCM-DRZSPHRISA-N 1 3 295.496 3.670 20 0 CHADHO C[C@H](CCC[NH3+])N[C@H](C)c1csc(-c2ccccc2)n1 ZINC000423446298 330202363 /nfs/dbraw/zinc/20/23/63/330202363.db2.gz CMRNIIDZHGQJNH-CHWSQXEVSA-N 1 3 289.448 3.588 20 0 CHADHO CC[C@H](N)C[NH2+][C@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423465617 330204372 /nfs/dbraw/zinc/20/43/72/330204372.db2.gz MURSPONCDUXHSO-LSDHHAIUSA-N 1 3 266.816 3.508 20 0 CHADHO C[C@H](NCCC[C@@H]1CCC[NH2+]1)c1ccc(F)cc1Cl ZINC000423475457 330205712 /nfs/dbraw/zinc/20/57/12/330205712.db2.gz HZHPXPCSJHBGAH-WCQYABFASA-N 1 3 284.806 3.662 20 0 CHADHO C[C@@H](N[C@@H](CCC[NH3+])c1ccccc1)c1ccsc1 ZINC000423498301 330208216 /nfs/dbraw/zinc/20/82/16/330208216.db2.gz HXSFSUSZPIRMGW-CJNGLKHVSA-N 1 3 274.433 3.879 20 0 CHADHO COc1cccc([C@@H](C)N[C@H](CCC[NH3+])c2ccccc2)c1 ZINC000423501705 330208518 /nfs/dbraw/zinc/20/85/18/330208518.db2.gz LMYSCLQMTWJAKN-DNVCBOLYSA-N 1 3 298.430 3.826 20 0 CHADHO Cc1ccnc([C@H](C)N[C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000423501352 330208612 /nfs/dbraw/zinc/20/86/12/330208612.db2.gz CRKHJYQYLJMZFB-RDJZCZTQSA-N 1 3 283.419 3.521 20 0 CHADHO [NH3+]CCC[C@H](N[C@H]1CCc2ccc(F)cc21)c1ccccc1 ZINC000423507721 330209207 /nfs/dbraw/zinc/20/92/07/330209207.db2.gz QHDTXCSJRKUZQB-OALUTQOASA-N 1 3 298.405 3.883 20 0 CHADHO CC(C)C[C@@H]([NH2+]CCCNC1CC1)c1cccs1 ZINC000423517238 330209830 /nfs/dbraw/zinc/20/98/30/330209830.db2.gz BIECQEVWZAZDKI-CQSZACIVSA-N 1 3 266.454 3.567 20 0 CHADHO c1csc([C@@H](NCCC[NH2+]C2CC2)C2CCCC2)c1 ZINC000423531630 330210375 /nfs/dbraw/zinc/21/03/75/330210375.db2.gz SZLFYZLWGMAJDF-INIZCTEOSA-N 1 3 278.465 3.711 20 0 CHADHO c1csc([C@@H]([NH2+]CCCNC2CC2)C2CCCC2)c1 ZINC000423531630 330210377 /nfs/dbraw/zinc/21/03/77/330210377.db2.gz SZLFYZLWGMAJDF-INIZCTEOSA-N 1 3 278.465 3.711 20 0 CHADHO COc1ccc([C@H](C)[NH2+][C@@H]2CCCCNC2)c2ccccc12 ZINC000423570798 330212051 /nfs/dbraw/zinc/21/20/51/330212051.db2.gz XDBHTORJVSRSIG-LSDHHAIUSA-N 1 3 298.430 3.641 20 0 CHADHO C[C@@H](C[NH2+]C1CCC(C)(C)CC1)CN1CCCCC1 ZINC000079627449 330252772 /nfs/dbraw/zinc/25/27/72/330252772.db2.gz IHYYUOHUABMQOX-HNNXBMFYSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@H]([NH2+]CC[C@@H]1CCCCN1C)c1cc2ccccc2o1 ZINC000527505097 330255069 /nfs/dbraw/zinc/25/50/69/330255069.db2.gz HDHCIEANHCUMIE-HOCLYGCPSA-N 1 3 286.419 3.958 20 0 CHADHO CCC(F)(F)C(C)(C)C[NH2+]C1CCN(CC(C)C)CC1 ZINC000527634582 330267248 /nfs/dbraw/zinc/26/72/48/330267248.db2.gz AQPLSHMMNAIUFS-UHFFFAOYSA-N 1 3 290.442 3.768 20 0 CHADHO CCC(F)(F)C(C)(C)CNC1CC[NH+](CC(C)C)CC1 ZINC000527634582 330267249 /nfs/dbraw/zinc/26/72/49/330267249.db2.gz AQPLSHMMNAIUFS-UHFFFAOYSA-N 1 3 290.442 3.768 20 0 CHADHO CC(C)c1cccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC000527864594 330285438 /nfs/dbraw/zinc/28/54/38/330285438.db2.gz JLSOBHCONSWPNG-RLFYNMQTSA-N 1 3 274.452 3.943 20 0 CHADHO CC(C)c1cccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC000527864594 330285439 /nfs/dbraw/zinc/28/54/39/330285439.db2.gz JLSOBHCONSWPNG-RLFYNMQTSA-N 1 3 274.452 3.943 20 0 CHADHO C[C@H]1CCCC[C@@H]1N1CCC([NH2+]CC2CC=CC2)CC1 ZINC000527947303 330294337 /nfs/dbraw/zinc/29/43/37/330294337.db2.gz YAZDJDHGQZOWKM-YJBOKZPZSA-N 1 3 276.468 3.585 20 0 CHADHO C[C@@H](NC[C@H]1CCC[N@H+](C)C1)c1ccc2c(c1)CCCC2 ZINC000044534235 330329755 /nfs/dbraw/zinc/32/97/55/330329755.db2.gz FBYWFVDSHKSONJ-HZPDHXFCSA-N 1 3 286.463 3.558 20 0 CHADHO C[C@@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccc2c(c1)CCCC2 ZINC000044534235 330329756 /nfs/dbraw/zinc/32/97/56/330329756.db2.gz FBYWFVDSHKSONJ-HZPDHXFCSA-N 1 3 286.463 3.558 20 0 CHADHO Cc1cc(C)c([C@H](C)NC[C@H]2CCC[N@H+](C)C2)cc1C ZINC000044534203 330329813 /nfs/dbraw/zinc/32/98/13/330329813.db2.gz BZCDDUFVZXAZQB-DLBZAZTESA-N 1 3 274.452 3.604 20 0 CHADHO Cc1cc(C)c([C@H](C)NC[C@H]2CCC[N@@H+](C)C2)cc1C ZINC000044534203 330329814 /nfs/dbraw/zinc/32/98/14/330329814.db2.gz BZCDDUFVZXAZQB-DLBZAZTESA-N 1 3 274.452 3.604 20 0 CHADHO CC(C)(C)CC(C)(C)[NH+]1CCC(N[C@@H]2CC23CC3)CC1 ZINC000424329768 330341969 /nfs/dbraw/zinc/34/19/69/330341969.db2.gz SHJGBIXIKSMSKH-OAHLLOKOSA-N 1 3 278.484 3.808 20 0 CHADHO CC(C)(C)CC(C)(C)[NH+]1CCC(N[C@H]2CC23CC3)CC1 ZINC000424329767 330342030 /nfs/dbraw/zinc/34/20/30/330342030.db2.gz SHJGBIXIKSMSKH-HNNXBMFYSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@H](CCc1ccc(Cl)s1)N[C@@H]1CCCC[C@H]1[NH3+] ZINC000424366794 330347928 /nfs/dbraw/zinc/34/79/28/330347928.db2.gz JRASXLYROXFZLM-RAIGVLPGSA-N 1 3 286.872 3.582 20 0 CHADHO C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C2CCCC2)C1 ZINC000120096304 330384407 /nfs/dbraw/zinc/38/44/07/330384407.db2.gz VVGVLJFAHWKENS-CVEARBPZSA-N 1 3 264.457 3.515 20 0 CHADHO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C2CCCC2)C1 ZINC000120096304 330384408 /nfs/dbraw/zinc/38/44/08/330384408.db2.gz VVGVLJFAHWKENS-CVEARBPZSA-N 1 3 264.457 3.515 20 0 CHADHO C[C@@H]1CCCCN1C[C@@H]1CCC[N@@H+](C2CCCC2)C1 ZINC000120096304 330384409 /nfs/dbraw/zinc/38/44/09/330384409.db2.gz VVGVLJFAHWKENS-CVEARBPZSA-N 1 3 264.457 3.515 20 0 CHADHO C[C@@H]1CCCCN1C[C@@H]1CCC[N@H+](C2CCCC2)C1 ZINC000120096304 330384410 /nfs/dbraw/zinc/38/44/10/330384410.db2.gz VVGVLJFAHWKENS-CVEARBPZSA-N 1 3 264.457 3.515 20 0 CHADHO C[C@@H]1CC[C@H](N[C@@H]2C[C@H](C)[N@@H+](C)C[C@@H]2C)c2ccccc21 ZINC000090796133 330396366 /nfs/dbraw/zinc/39/63/66/330396366.db2.gz WWORSJKFUUTNEC-BHCCHWJASA-N 1 3 286.463 3.943 20 0 CHADHO C[C@@H]1CC[C@H](N[C@@H]2C[C@H](C)[N@H+](C)C[C@@H]2C)c2ccccc21 ZINC000090796133 330396367 /nfs/dbraw/zinc/39/63/67/330396367.db2.gz WWORSJKFUUTNEC-BHCCHWJASA-N 1 3 286.463 3.943 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000436315527 330675641 /nfs/dbraw/zinc/67/56/41/330675641.db2.gz PTLYYVSDQLWZBM-YDZRNGNQSA-N 1 3 286.463 3.785 20 0 CHADHO C[C@@H](C[NH2+]CC(C)(C)CN1CCCC1)c1ccccc1 ZINC000446787952 330854191 /nfs/dbraw/zinc/85/41/91/330854191.db2.gz ZRRBUMPKSRDXKI-INIZCTEOSA-N 1 3 274.452 3.502 20 0 CHADHO CCc1ccc2nccc(N3CCC[C@@H]([NH+](C)C)CC3)c2c1 ZINC000450488755 330983301 /nfs/dbraw/zinc/98/33/01/330983301.db2.gz PCXNIOXFUCKGFK-MRXNPFEDSA-N 1 3 297.446 3.718 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+][C@H]1CCCC[C@H]1CC(F)(F)F ZINC000451300733 331023751 /nfs/dbraw/zinc/02/37/51/331023751.db2.gz VSGIEBCEKQWDKH-MJBXVCDLSA-N 1 3 292.389 3.572 20 0 CHADHO CCC[C@@H]([NH2+]C[C@@H]1CCN(CCC)C1)C(C)(C)C ZINC000453086557 331087867 /nfs/dbraw/zinc/08/78/67/331087867.db2.gz HZQQKHDVCGYYHF-LSDHHAIUSA-N 1 3 254.462 3.523 20 0 CHADHO CCC[C@@H]([NH2+]C1CCN(C2CCCC2)CC1)C1CCC1 ZINC000453139187 331093250 /nfs/dbraw/zinc/09/32/50/331093250.db2.gz RKZPTLMEIDUXGQ-GOSISDBHSA-N 1 3 278.484 3.952 20 0 CHADHO CCC1([NH2+]C2CCN([C@@H]3CCC[C@@H](C)C3)CC2)CC1 ZINC000453277545 331110161 /nfs/dbraw/zinc/11/01/61/331110161.db2.gz DKRRQWZYQNGAJV-GDBMZVCRSA-N 1 3 264.457 3.562 20 0 CHADHO CCC1(NC2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)CC1 ZINC000453277545 331110162 /nfs/dbraw/zinc/11/01/62/331110162.db2.gz DKRRQWZYQNGAJV-GDBMZVCRSA-N 1 3 264.457 3.562 20 0 CHADHO CCC1([NH2+]C2CCN([C@H]3CCC[C@@H](C)C3)CC2)CC1 ZINC000453277548 331110277 /nfs/dbraw/zinc/11/02/77/331110277.db2.gz DKRRQWZYQNGAJV-ZBFHGGJFSA-N 1 3 264.457 3.562 20 0 CHADHO CCC1(NC2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)CC1 ZINC000453277548 331110278 /nfs/dbraw/zinc/11/02/78/331110278.db2.gz DKRRQWZYQNGAJV-ZBFHGGJFSA-N 1 3 264.457 3.562 20 0 CHADHO C[C@H](NCCCC[N@H+](C)C1CC1)c1ccccc1Cl ZINC000453409338 331129728 /nfs/dbraw/zinc/12/97/28/331129728.db2.gz GEVOKXHCIMYTJE-ZDUSSCGKSA-N 1 3 280.843 3.865 20 0 CHADHO C[C@H](NCCCC[N@@H+](C)C1CC1)c1ccccc1Cl ZINC000453409338 331129729 /nfs/dbraw/zinc/12/97/29/331129729.db2.gz GEVOKXHCIMYTJE-ZDUSSCGKSA-N 1 3 280.843 3.865 20 0 CHADHO CN(C)Cc1ccc(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)cc1 ZINC000459381356 331279184 /nfs/dbraw/zinc/27/91/84/331279184.db2.gz RMVFOHBSHWIADR-PMACEKPBSA-N 1 3 294.442 3.642 20 0 CHADHO C[C@@H]([NH2+]C1CC2(CCC2)C1)[C@@H]1CCCN(C2CCC2)C1 ZINC000459472707 331283435 /nfs/dbraw/zinc/28/34/35/331283435.db2.gz WDGAOJPEIDTPCU-HUUCEWRRSA-N 1 3 276.468 3.562 20 0 CHADHO C[C@H]([NH2+]C1CC2(CCC2)C1)[C@@H]1CCCN(C2CCC2)C1 ZINC000459472710 331283473 /nfs/dbraw/zinc/28/34/73/331283473.db2.gz WDGAOJPEIDTPCU-LSDHHAIUSA-N 1 3 276.468 3.562 20 0 CHADHO CC(C)C1CC(NCCC[NH+](C(C)C)C(C)C)C1 ZINC000488445808 332009617 /nfs/dbraw/zinc/00/96/17/332009617.db2.gz JKIVEJUQUWXIDT-UHFFFAOYSA-N 1 3 254.462 3.520 20 0 CHADHO CC(C)C1CC([NH2+][C@@H](C)[C@H]2CCCN(C3CCC3)C2)C1 ZINC000488509291 332014625 /nfs/dbraw/zinc/01/46/25/332014625.db2.gz VNICXEPIQCPGOD-JUVOFCAFSA-N 1 3 278.484 3.664 20 0 CHADHO CC(C)[C@H]1CCCN1CCC[N@@H+]1CCC[C@H]1C(C)C ZINC000488722388 332022576 /nfs/dbraw/zinc/02/25/76/332022576.db2.gz GSJNYQBQBQQZBG-CALCHBBNSA-N 1 3 266.473 3.617 20 0 CHADHO CC(C)[C@H]1CCCN1CCC[N@H+]1CCC[C@H]1C(C)C ZINC000488722388 332022577 /nfs/dbraw/zinc/02/25/77/332022577.db2.gz GSJNYQBQBQQZBG-CALCHBBNSA-N 1 3 266.473 3.617 20 0 CHADHO CC(C)[C@H]1CCC[N@H+]1CCCN1CCC[C@H]1C(C)C ZINC000488722388 332022578 /nfs/dbraw/zinc/02/25/78/332022578.db2.gz GSJNYQBQBQQZBG-CALCHBBNSA-N 1 3 266.473 3.617 20 0 CHADHO CC(C)[C@H]1CCC[N@@H+]1CCCN1CCC[C@H]1C(C)C ZINC000488722388 332022579 /nfs/dbraw/zinc/02/25/79/332022579.db2.gz GSJNYQBQBQQZBG-CALCHBBNSA-N 1 3 266.473 3.617 20 0 CHADHO CC(C)=CCN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000248825479 334318455 /nfs/dbraw/zinc/31/84/55/334318455.db2.gz GAMTZDKQQDQSDI-REPLKXPHSA-N 1 3 284.447 3.738 20 0 CHADHO CC(C)=CCN[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000248825479 334318456 /nfs/dbraw/zinc/31/84/56/334318456.db2.gz GAMTZDKQQDQSDI-REPLKXPHSA-N 1 3 284.447 3.738 20 0 CHADHO CC(C)(C)C[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000309887799 333051003 /nfs/dbraw/zinc/05/10/03/333051003.db2.gz AEGLPDWWRKNWED-GOSISDBHSA-N 1 3 288.479 3.924 20 0 CHADHO C[NH+](C)CCC1CCN(Cc2cc3ccccc3o2)CC1 ZINC000178537254 333074884 /nfs/dbraw/zinc/07/48/84/333074884.db2.gz LHDAVQLAZVSWTF-UHFFFAOYSA-N 1 3 286.419 3.597 20 0 CHADHO N[C@H]1CCC[C@@H]([NH2+]CC(c2ccccc2)c2ccccc2)C1 ZINC000516877608 333085042 /nfs/dbraw/zinc/08/50/42/333085042.db2.gz IWHIKLZSZOTARG-RBUKOAKNSA-N 1 3 294.442 3.678 20 0 CHADHO CC[C@H](NC1CC[NH+](C(C)C)CC1)c1cccc(C)c1 ZINC000336841322 335120652 /nfs/dbraw/zinc/12/06/52/335120652.db2.gz RMAJJOGJYUUGBQ-SFHVURJKSA-N 1 3 274.452 3.909 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@@H](C)C2CCCCCC2)C1 ZINC000517439399 333099469 /nfs/dbraw/zinc/09/94/69/333099469.db2.gz WVHFOVUHAAVWAL-HOTGVXAUSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)c1cccc2ccccc21 ZINC000222905578 333201993 /nfs/dbraw/zinc/20/19/93/333201993.db2.gz HDGPVFWLXOQYNH-IMJJTQAJSA-N 1 3 268.404 3.760 20 0 CHADHO CCCc1ccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000222930578 333202333 /nfs/dbraw/zinc/20/23/33/333202333.db2.gz QFXNHEVRGWYZHL-RLFYNMQTSA-N 1 3 274.452 3.772 20 0 CHADHO CCCc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000222930578 333202335 /nfs/dbraw/zinc/20/23/35/333202335.db2.gz QFXNHEVRGWYZHL-RLFYNMQTSA-N 1 3 274.452 3.772 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H](CC2CC2)c2ccccc2)C1 ZINC000575850825 335123542 /nfs/dbraw/zinc/12/35/42/335123542.db2.gz OUJIQYLUJKPCQI-MJGOQNOKSA-N 1 3 286.463 3.849 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H](CC2CC2)c2ccccc2)C1 ZINC000575850825 335123543 /nfs/dbraw/zinc/12/35/43/335123543.db2.gz OUJIQYLUJKPCQI-MJGOQNOKSA-N 1 3 286.463 3.849 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H](CC2CC2)c2ccccc2)C1 ZINC000575850825 335123544 /nfs/dbraw/zinc/12/35/44/335123544.db2.gz OUJIQYLUJKPCQI-MJGOQNOKSA-N 1 3 286.463 3.849 20 0 CHADHO CCCCN1CCC([NH2+]C/C(C)=C/c2ccccc2)CC1 ZINC000192675095 333237640 /nfs/dbraw/zinc/23/76/40/333237640.db2.gz TWNAKZPVXAHVIR-BMRADRMJSA-N 1 3 286.463 3.944 20 0 CHADHO Clc1ccc(CNCCCCC[NH+]2CCCCC2)o1 ZINC000522213643 333265000 /nfs/dbraw/zinc/26/50/00/333265000.db2.gz WDVJXFJMYGCUSK-UHFFFAOYSA-N 1 3 284.831 3.679 20 0 CHADHO Cc1cc(C)cc(CN[C@H](CC[NH+](C)C)C(C)(C)C)c1 ZINC000522557785 333290149 /nfs/dbraw/zinc/29/01/49/333290149.db2.gz GMTFLHRGRBCWMT-QGZVFWFLSA-N 1 3 276.468 3.759 20 0 CHADHO C/C(=C/c1ccccc1)C[NH2+]C1CCN(CC(C)C)CC1 ZINC000522622300 333292610 /nfs/dbraw/zinc/29/26/10/333292610.db2.gz HHGYTZSVAUHIKM-LGMDPLHJSA-N 1 3 286.463 3.800 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](N[C@H]2CCSc3ccc(Cl)cc32)C1 ZINC000250016224 333301246 /nfs/dbraw/zinc/30/12/46/333301246.db2.gz JUWYTVCXPPRVCT-BZPMIXESSA-N 1 3 296.867 3.736 20 0 CHADHO [NH3+]C[C@@H]1CCC[C@@H]1N[C@H]1CCSc2ccc(Cl)cc21 ZINC000250041951 333301793 /nfs/dbraw/zinc/30/17/93/333301793.db2.gz YCFNZGPQHDLEKD-BPNCWPANSA-N 1 3 296.867 3.594 20 0 CHADHO CCc1ccc(CN[C@@H](CC[NH+](C)C)C(C)(C)C)cc1 ZINC000523864093 333348613 /nfs/dbraw/zinc/34/86/13/333348613.db2.gz HMZWYKYCFODIOM-KRWDZBQOSA-N 1 3 276.468 3.705 20 0 CHADHO CC1=C[C@H](C)C[C@@H](C[NH2+]C2CCN(C(C)(C)C)CC2)C1 ZINC000235383694 333368618 /nfs/dbraw/zinc/36/86/18/333368618.db2.gz UXSGJARHUHTGEU-GOEBONIOSA-N 1 3 278.484 3.831 20 0 CHADHO CC[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1cc(C)ccc1C ZINC000530224575 333528956 /nfs/dbraw/zinc/52/89/56/333528956.db2.gz RBPCEXJPXOWWCS-ZOBUZTSGSA-N 1 3 260.425 3.614 20 0 CHADHO CCC[C@H](CC)[NH2+][C@H](C)c1ccc(OCCN(C)C)cc1 ZINC000537989719 333569296 /nfs/dbraw/zinc/56/92/96/333569296.db2.gz CMHFBZQTNQOWPF-WBVHZDCISA-N 1 3 292.467 3.856 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC(C)(C)C1=CCCC1 ZINC000576146632 335160188 /nfs/dbraw/zinc/16/01/88/335160188.db2.gz ZQCVARUZHPVWHV-ZDUSSCGKSA-N 1 3 287.451 3.636 20 0 CHADHO Cc1cccc(C)c1[C@H](C)NC1CC[NH+](C(C)C)CC1 ZINC000546228533 334020855 /nfs/dbraw/zinc/02/08/55/334020855.db2.gz WSGGJPMUJSIBDE-INIZCTEOSA-N 1 3 274.452 3.827 20 0 CHADHO CCCC[N@H+](C)CC1CCN(Cc2occc2C)CC1 ZINC000134166740 334082683 /nfs/dbraw/zinc/08/26/83/334082683.db2.gz SFFVXFIMQOVRMU-UHFFFAOYSA-N 1 3 278.440 3.532 20 0 CHADHO CCCC[N@@H+](C)CC1CCN(Cc2occc2C)CC1 ZINC000134166740 334082684 /nfs/dbraw/zinc/08/26/84/334082684.db2.gz SFFVXFIMQOVRMU-UHFFFAOYSA-N 1 3 278.440 3.532 20 0 CHADHO COc1cccc([C@@H](C)[N@H+](C)CC[C@@H]2CCCCN2C)c1 ZINC000079465000 334155027 /nfs/dbraw/zinc/15/50/27/334155027.db2.gz GVYUFSDKAQNGDD-WBVHZDCISA-N 1 3 290.451 3.562 20 0 CHADHO COc1cccc([C@@H](C)[N@@H+](C)CC[C@@H]2CCCCN2C)c1 ZINC000079465000 334155028 /nfs/dbraw/zinc/15/50/28/334155028.db2.gz GVYUFSDKAQNGDD-WBVHZDCISA-N 1 3 290.451 3.562 20 0 CHADHO C[NH+]1CCC([C@H]2CCN(Cc3cccc(Cl)c3)C2)CC1 ZINC000550199907 334215745 /nfs/dbraw/zinc/21/57/45/334215745.db2.gz WYTBRWQHGJFIFX-INIZCTEOSA-N 1 3 292.854 3.504 20 0 CHADHO Cc1cc(C)c(CN(C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1C ZINC000245748853 334217313 /nfs/dbraw/zinc/21/73/13/334217313.db2.gz NKUYYGHEQJMJIO-FUHWJXTLSA-N 1 3 274.452 3.526 20 0 CHADHO Cc1cc(C)c(CN(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1C ZINC000245748853 334217314 /nfs/dbraw/zinc/21/73/14/334217314.db2.gz NKUYYGHEQJMJIO-FUHWJXTLSA-N 1 3 274.452 3.526 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)c1cccc(C2CC2)c1)CN1CCCC1 ZINC000551008505 334236201 /nfs/dbraw/zinc/23/62/01/334236201.db2.gz WNQMQZCHZUBNFJ-HOTGVXAUSA-N 1 3 286.463 3.947 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H](c2ccccc2)C2CC2)C1 ZINC000246145936 334236469 /nfs/dbraw/zinc/23/64/69/334236469.db2.gz SLBAPKIMAPXUNV-VQIMIIECSA-N 1 3 286.463 3.848 20 0 CHADHO CC(C)[N@@H+]1CCC[C@H](CN[C@H](c2ccccc2)C2CC2)C1 ZINC000246145936 334236471 /nfs/dbraw/zinc/23/64/71/334236471.db2.gz SLBAPKIMAPXUNV-VQIMIIECSA-N 1 3 286.463 3.848 20 0 CHADHO CC(C)[N@H+]1CCC[C@H](CN[C@H](c2ccccc2)C2CC2)C1 ZINC000246145936 334236472 /nfs/dbraw/zinc/23/64/72/334236472.db2.gz SLBAPKIMAPXUNV-VQIMIIECSA-N 1 3 286.463 3.848 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H](c2ccccc2)C2CC2)C1 ZINC000246145927 334236547 /nfs/dbraw/zinc/23/65/47/334236547.db2.gz SLBAPKIMAPXUNV-QFBILLFUSA-N 1 3 286.463 3.848 20 0 CHADHO CC(C)[N@@H+]1CCC[C@@H](CN[C@H](c2ccccc2)C2CC2)C1 ZINC000246145927 334236548 /nfs/dbraw/zinc/23/65/48/334236548.db2.gz SLBAPKIMAPXUNV-QFBILLFUSA-N 1 3 286.463 3.848 20 0 CHADHO CC(C)[N@H+]1CCC[C@@H](CN[C@H](c2ccccc2)C2CC2)C1 ZINC000246145927 334236549 /nfs/dbraw/zinc/23/65/49/334236549.db2.gz SLBAPKIMAPXUNV-QFBILLFUSA-N 1 3 286.463 3.848 20 0 CHADHO CCC[C@H](C)[C@H](CC)[NH2+]C[C@H]1CCN(CCC)C1 ZINC000247097449 334275625 /nfs/dbraw/zinc/27/56/25/334275625.db2.gz PVDFKXUILUNPKZ-XHSDSOJGSA-N 1 3 254.462 3.523 20 0 CHADHO Cc1sccc1CN1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000551948320 334267358 /nfs/dbraw/zinc/26/73/58/334267358.db2.gz SRSDGZUUCUFUKB-UHFFFAOYSA-N 1 3 280.481 3.609 20 0 CHADHO Cc1sccc1CN1CCC(C[N@H+](C)C(C)C)CC1 ZINC000551948320 334267360 /nfs/dbraw/zinc/26/73/60/334267360.db2.gz SRSDGZUUCUFUKB-UHFFFAOYSA-N 1 3 280.481 3.609 20 0 CHADHO CC(C)c1ccc(CN[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@H]32)cc1 ZINC000552247721 334308270 /nfs/dbraw/zinc/30/82/70/334308270.db2.gz YGDQLFSZYRNRKZ-IPMKNSEASA-N 1 3 286.463 3.772 20 0 CHADHO CC(C)c1ccc(CN[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@H]32)cc1 ZINC000552247721 334308272 /nfs/dbraw/zinc/30/82/72/334308272.db2.gz YGDQLFSZYRNRKZ-IPMKNSEASA-N 1 3 286.463 3.772 20 0 CHADHO CC(C)Cc1cccc([C@H](C)[NH2+]CC2=CCN(C)CC2)c1 ZINC000552276013 334311582 /nfs/dbraw/zinc/31/15/82/334311582.db2.gz HYKVXNXADSBAAP-INIZCTEOSA-N 1 3 286.463 3.798 20 0 CHADHO CC(C)Cc1cccc([C@@H](C)[NH2+]CC2=CCN(C)CC2)c1 ZINC000552276014 334311624 /nfs/dbraw/zinc/31/16/24/334311624.db2.gz HYKVXNXADSBAAP-MRXNPFEDSA-N 1 3 286.463 3.798 20 0 CHADHO CC[NH+](CC)C[C@H]1CCN(CC[C@H](C)c2ccccc2)C1 ZINC000248830182 334319080 /nfs/dbraw/zinc/31/90/80/334319080.db2.gz HDFOYQUGVGNRRS-ZWKOTPCHSA-N 1 3 288.479 3.844 20 0 CHADHO CCN(CC)C[C@H]1CC[N@H+](CC[C@H](C)c2ccccc2)C1 ZINC000248830182 334319081 /nfs/dbraw/zinc/31/90/81/334319081.db2.gz HDFOYQUGVGNRRS-ZWKOTPCHSA-N 1 3 288.479 3.844 20 0 CHADHO CCN(CC)C[C@H]1CC[N@@H+](CC[C@H](C)c2ccccc2)C1 ZINC000248830182 334319083 /nfs/dbraw/zinc/31/90/83/334319083.db2.gz HDFOYQUGVGNRRS-ZWKOTPCHSA-N 1 3 288.479 3.844 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](CC)c2cccc(F)c2)C1 ZINC000249194660 334329779 /nfs/dbraw/zinc/32/97/79/334329779.db2.gz QBFSEBPVEQRNBC-WMLDXEAASA-N 1 3 278.415 3.598 20 0 CHADHO CC(C)(C)[C@H](N[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000250695672 334348734 /nfs/dbraw/zinc/34/87/34/334348734.db2.gz LXFPMWHMQPAMNU-FGTMMUONSA-N 1 3 286.463 3.990 20 0 CHADHO CC(C)(C)[C@H](N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000250695672 334348735 /nfs/dbraw/zinc/34/87/35/334348735.db2.gz LXFPMWHMQPAMNU-FGTMMUONSA-N 1 3 286.463 3.990 20 0 CHADHO CC[C@H](N[C@@H](C)C[C@H]1CCC[NH2+]1)c1ccc(C)cc1 ZINC000251076689 334355857 /nfs/dbraw/zinc/35/58/57/334355857.db2.gz KTTKQOQWKCOAIZ-UAGQMJEPSA-N 1 3 260.425 3.566 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@@H]1CC[C@H](C)c2ccccc21 ZINC000251588996 334364941 /nfs/dbraw/zinc/36/49/41/334364941.db2.gz CGADDBONSWXZFN-JJRVBVJISA-N 1 3 260.425 3.555 20 0 CHADHO C[C@H]1C[C@H]([NH2+]C2CC(C)(C)NC(C)(C)C2)C[C@@H](C)C1 ZINC000252139540 334374671 /nfs/dbraw/zinc/37/46/71/334374671.db2.gz MZXORTOHFKIPCV-WDNDVIMCSA-N 1 3 266.473 3.710 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)[N@@H+]1C[C@@H](CN)C[C@H]1C ZINC000252697236 334385621 /nfs/dbraw/zinc/38/56/21/334385621.db2.gz GEKLZVNQBKDHPD-RBSFLKMASA-N 1 3 268.404 3.570 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)[N@H+]1C[C@@H](CN)C[C@H]1C ZINC000252697236 334385622 /nfs/dbraw/zinc/38/56/22/334385622.db2.gz GEKLZVNQBKDHPD-RBSFLKMASA-N 1 3 268.404 3.570 20 0 CHADHO C[C@@H]1CC[C@H](N[C@@H]2C[C@H]([NH3+])c3ccccc32)C[C@H]1C ZINC000252783416 334392822 /nfs/dbraw/zinc/39/28/22/334392822.db2.gz NWTWGZOFAMPNCJ-ZWNONLRRSA-N 1 3 258.409 3.546 20 0 CHADHO C[C@@H]([NH2+]C1CCN(C2CCCCC2)CC1)C(C)(C)C ZINC000163283617 334812384 /nfs/dbraw/zinc/81/23/84/334812384.db2.gz ONBFPMTXBCBXNF-CQSZACIVSA-N 1 3 266.473 3.808 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3N[C@H](C)CC[NH+](C)C ZINC000580672821 335320405 /nfs/dbraw/zinc/32/04/05/335320405.db2.gz OTPHRRANBUXWRA-RDTXWAMCSA-N 1 3 299.462 3.784 20 0 CHADHO N[C@@H]1CCC[C@@H]([NH2+]C2(Cc3ccc(Cl)cc3)CCC2)C1 ZINC000577232258 335327851 /nfs/dbraw/zinc/32/78/51/335327851.db2.gz YCMSTZVPJQPFKW-HZPDHXFCSA-N 1 3 292.854 3.665 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](NC2(Cc3ccc(Cl)cc3)CCC2)C1 ZINC000577232258 335327853 /nfs/dbraw/zinc/32/78/53/335327853.db2.gz YCMSTZVPJQPFKW-HZPDHXFCSA-N 1 3 292.854 3.665 20 0 CHADHO CC(C)[C@H]1C[C@@H](N[C@H](C)[C@H]2CCC[NH2+]C2)c2ccccc21 ZINC000577274102 335333049 /nfs/dbraw/zinc/33/30/49/335333049.db2.gz BRWQXPMFISCLDO-WTLGNFPFSA-N 1 3 286.463 3.849 20 0 CHADHO CC(C)[NH+](CCCNC[C@H](C)c1ccccc1)C(C)C ZINC000580932620 335985550 /nfs/dbraw/zinc/98/55/50/335985550.db2.gz QPKSHTTWSVIMOR-KRWDZBQOSA-N 1 3 276.468 3.889 20 0 CHADHO CC1CC([NH2+]C[C@H]2CCCCN(Cc3ccccc3)C2)C1 ZINC000381991425 336079716 /nfs/dbraw/zinc/07/97/16/336079716.db2.gz PDZWIMZQXICSLW-CUYAVPTFSA-N 1 3 286.463 3.677 20 0 CHADHO CSCC1CCC(N[C@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC000385349144 336144515 /nfs/dbraw/zinc/14/45/15/336144515.db2.gz ZYXHZAQVXMZDOF-YCUKKYJWSA-N 1 3 290.476 3.643 20 0 CHADHO C[C@H](c1cccc2ccccc21)N1CC[C@@H]2[NH2+]CC[C@@H]2C1 ZINC000386687380 336177276 /nfs/dbraw/zinc/17/72/76/336177276.db2.gz KNQOGGBYOBBQSR-OGWOLHLISA-N 1 3 280.415 3.585 20 0 CHADHO CC[N@H+](CC[C@@H]1CCCN1C)Cc1cccc(Cl)c1 ZINC000340373360 521158629 /nfs/dbraw/zinc/15/86/29/521158629.db2.gz MTTULIUQVJZACM-INIZCTEOSA-N 1 3 280.843 3.646 20 0 CHADHO CC[N@@H+](CC[C@@H]1CCCN1C)Cc1cccc(Cl)c1 ZINC000340373360 521158638 /nfs/dbraw/zinc/15/86/38/521158638.db2.gz MTTULIUQVJZACM-INIZCTEOSA-N 1 3 280.843 3.646 20 0 CHADHO CC(C)(C)[C@H](N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000127865869 518967024 /nfs/dbraw/zinc/96/70/24/518967024.db2.gz LXFPMWHMQPAMNU-KZNAEPCWSA-N 1 3 286.463 3.990 20 0 CHADHO CC(C)(C)[C@H](N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000127865869 518967036 /nfs/dbraw/zinc/96/70/36/518967036.db2.gz LXFPMWHMQPAMNU-KZNAEPCWSA-N 1 3 286.463 3.990 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CC[C@@H]([NH3+])[C@@H](C)C2)cc1 ZINC000227057416 519839882 /nfs/dbraw/zinc/83/98/82/519839882.db2.gz XTZFYPMPALEZND-GRDNDAEWSA-N 1 3 260.425 3.540 20 0 CHADHO CCC[C@@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccccc1 ZINC000037649493 520777004 /nfs/dbraw/zinc/77/70/04/520777004.db2.gz FWZMQBHBZBPWAT-MAUKXSAKSA-N 1 3 272.436 3.602 20 0 CHADHO CCC[C@@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccccc1 ZINC000037649493 520777011 /nfs/dbraw/zinc/77/70/11/520777011.db2.gz FWZMQBHBZBPWAT-MAUKXSAKSA-N 1 3 272.436 3.602 20 0 CHADHO CCSc1cccc(CN(C)[C@@H]2CC[N@H+](C)C[C@H]2C)c1 ZINC000290354470 521756786 /nfs/dbraw/zinc/75/67/86/521756786.db2.gz GIAODDJZMFAWTG-RHSMWYFYSA-N 1 3 292.492 3.571 20 0 CHADHO CCSc1cccc(CN(C)[C@@H]2CC[N@@H+](C)C[C@H]2C)c1 ZINC000290354470 521756791 /nfs/dbraw/zinc/75/67/91/521756791.db2.gz GIAODDJZMFAWTG-RHSMWYFYSA-N 1 3 292.492 3.571 20 0 CHADHO CN(CCCCC[N@H+](C)Cc1ccco1)Cc1ccco1 ZINC000077247290 522726316 /nfs/dbraw/zinc/72/63/16/522726316.db2.gz DKHPTQMWILAMKV-UHFFFAOYSA-N 1 3 290.407 3.607 20 0 CHADHO CN(CCCCC[N@@H+](C)Cc1ccco1)Cc1ccco1 ZINC000077247290 522726322 /nfs/dbraw/zinc/72/63/22/522726322.db2.gz DKHPTQMWILAMKV-UHFFFAOYSA-N 1 3 290.407 3.607 20 0 CHADHO CN(Cc1ccccc1-c1ccccc1)C[C@]1(C)CC[NH2+]C1 ZINC000262064507 523356179 /nfs/dbraw/zinc/35/61/79/523356179.db2.gz RLQJQDZWILAZIW-HXUWFJFHSA-N 1 3 294.442 3.785 20 0 CHADHO C[C@H]([NH3+])[C@@H]1CCCN([C@@H](C)c2ccc3ccccc3c2)C1 ZINC000226331172 524845801 /nfs/dbraw/zinc/84/58/01/524845801.db2.gz MLSPGLUPEYHFHD-YZVOILCLSA-N 1 3 282.431 3.960 20 0 CHADHO COc1ccc([C@@H](C)[NH2+]C2CCN(C(C)(C)C)CC2)cc1 ZINC000037786199 525145648 /nfs/dbraw/zinc/14/56/48/525145648.db2.gz YVAYKNXSENNHSR-CQSZACIVSA-N 1 3 290.451 3.609 20 0 CHADHO C[C@H]([NH2+]CC1=CCN(C)CC1)[C@@H](C)c1ccc(Cl)cc1 ZINC000280310614 525322941 /nfs/dbraw/zinc/32/29/41/525322941.db2.gz ORONSHGJNBYESD-KGLIPLIRSA-N 1 3 292.854 3.684 20 0 CHADHO C[C@@H]1C[C@H](NCc2ccc(C3CCC3)cc2)CC[N@@H+]1C ZINC000277285137 525441860 /nfs/dbraw/zinc/44/18/60/525441860.db2.gz SXKRIDXUQYEIAK-RDTXWAMCSA-N 1 3 272.436 3.526 20 0 CHADHO C[C@@H]1C[C@H](NCc2ccc(C3CCC3)cc2)CC[N@H+]1C ZINC000277285137 525441867 /nfs/dbraw/zinc/44/18/67/525441867.db2.gz SXKRIDXUQYEIAK-RDTXWAMCSA-N 1 3 272.436 3.526 20 0 CHADHO Cc1ccc([C@@H](C)NCCCC[N@@H+]2CCCC[C@@H]2C)o1 ZINC000157895200 525726070 /nfs/dbraw/zinc/72/60/70/525726070.db2.gz JKMCDQOPGSZGCJ-GOEBONIOSA-N 1 3 278.440 3.893 20 0 CHADHO Cc1ccc([C@@H](C)NCCCC[N@H+]2CCCC[C@@H]2C)o1 ZINC000157895200 525726082 /nfs/dbraw/zinc/72/60/82/525726082.db2.gz JKMCDQOPGSZGCJ-GOEBONIOSA-N 1 3 278.440 3.893 20 0 CHADHO Cc1ccc([C@H](NC[C@@H]2CC[N@@H+](C3CC3)C2)C2CC2)cc1 ZINC000037648847 525970220 /nfs/dbraw/zinc/97/02/20/525970220.db2.gz UODNGVXQSFUFQB-KXBFYZLASA-N 1 3 284.447 3.520 20 0 CHADHO Cc1ccc([C@H](NC[C@@H]2CC[N@H+](C3CC3)C2)C2CC2)cc1 ZINC000037648847 525970229 /nfs/dbraw/zinc/97/02/29/525970229.db2.gz UODNGVXQSFUFQB-KXBFYZLASA-N 1 3 284.447 3.520 20 0 CHADHO c1cc2cccc(C[NH2+]C3CCN(C4CCCC4)CC3)c2[nH]1 ZINC000236630910 526447684 /nfs/dbraw/zinc/44/76/84/526447684.db2.gz VVSPOJWWMTVUGX-UHFFFAOYSA-N 1 3 297.446 3.665 20 0 CHADHO [NH3+]C[C@@H]1CCC[C@H]1N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000227122348 527216344 /nfs/dbraw/zinc/21/63/44/527216344.db2.gz YCFNZGPQHDLEKD-ZLKJLUDKSA-N 1 3 296.867 3.594 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2cccc3cccnc32)C[C@H]1C ZINC000353746942 527756278 /nfs/dbraw/zinc/75/62/78/527756278.db2.gz LXSSLXJKRPCUDC-CRAIPNDOSA-N 1 3 297.446 3.539 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2cccc3cccnc32)C[C@H]1C ZINC000353746942 527756284 /nfs/dbraw/zinc/75/62/84/527756284.db2.gz LXSSLXJKRPCUDC-CRAIPNDOSA-N 1 3 297.446 3.539 20 0 CHADHO CC[C@@H](CC(F)F)C[N@H+](CCCN)CC1CCCC1 ZINC000662271893 1117823068 /nfs/dbraw/zinc/82/30/68/1117823068.db2.gz AYXOAPRFWKRZQM-ZDUSSCGKSA-N 1 3 276.415 3.509 20 0 CHADHO CC[C@@H](CC(F)F)C[N@@H+](CCCN)CC1CCCC1 ZINC000662271893 1117823073 /nfs/dbraw/zinc/82/30/73/1117823073.db2.gz AYXOAPRFWKRZQM-ZDUSSCGKSA-N 1 3 276.415 3.509 20 0 CHADHO CCN(C)C[C@@H]1CC[N@H+](CCC2C[C@H](C)C[C@@H](C)C2)C1 ZINC001167575544 1119086028 /nfs/dbraw/zinc/08/60/28/1119086028.db2.gz CSHYGTYEQXZZPG-NUJGCVRESA-N 1 3 280.500 3.722 20 0 CHADHO CCN(C)C[C@@H]1CC[N@@H+](CCC2C[C@H](C)C[C@@H](C)C2)C1 ZINC001167575544 1119086031 /nfs/dbraw/zinc/08/60/31/1119086031.db2.gz CSHYGTYEQXZZPG-NUJGCVRESA-N 1 3 280.500 3.722 20 0 CHADHO CN(C)CC(C)(C)C[NH2+][C@@H]1CCSc2ccc(F)cc21 ZINC000132099457 1125498792 /nfs/dbraw/zinc/49/87/92/1125498792.db2.gz XRVCLISFGUNGEG-CQSZACIVSA-N 1 3 296.455 3.540 20 0 CHADHO CN(C)CC(C)(C)C[NH2+][C@H]1CCSc2ccc(F)cc21 ZINC000132099670 1125498959 /nfs/dbraw/zinc/49/89/59/1125498959.db2.gz XRVCLISFGUNGEG-AWEZNQCLSA-N 1 3 296.455 3.540 20 0 CHADHO CC(C)=CCC[C@H](C)[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663467859 1120981915 /nfs/dbraw/zinc/98/19/15/1120981915.db2.gz IIMJNEXYMLJVTI-FUHWJXTLSA-N 1 3 278.484 3.833 20 0 CHADHO C[C@H]1CCC[C@H]([NH+]2CCC(NCCC(C)(C)F)CC2)C1 ZINC000658193024 1121212481 /nfs/dbraw/zinc/21/24/81/1121212481.db2.gz RUGNLKFROZKVML-HOCLYGCPSA-N 1 3 284.463 3.757 20 0 CHADHO C[C@H]1CCC[C@H](N2CCC([NH2+]CCC(C)(C)F)CC2)C1 ZINC000658193024 1121212483 /nfs/dbraw/zinc/21/24/83/1121212483.db2.gz RUGNLKFROZKVML-HOCLYGCPSA-N 1 3 284.463 3.757 20 0 CHADHO CC[C@H](F)CN1CCC(CC[N@H+](CC)CC2CC2)CC1 ZINC000440799574 1123039744 /nfs/dbraw/zinc/03/97/44/1123039744.db2.gz UICSWLSMLNODJT-KRWDZBQOSA-N 1 3 284.463 3.569 20 0 CHADHO CC[C@H](F)CN1CCC(CC[N@@H+](CC)CC2CC2)CC1 ZINC000440799574 1123039747 /nfs/dbraw/zinc/03/97/47/1123039747.db2.gz UICSWLSMLNODJT-KRWDZBQOSA-N 1 3 284.463 3.569 20 0 CHADHO CCC[C@H](C)C[N@H+]1CCCC[C@@H]1C[C@@H]1CCCN1C ZINC001201552089 1123119042 /nfs/dbraw/zinc/11/90/42/1123119042.db2.gz JHHGDKFQBZZRMM-YESZJQIVSA-N 1 3 266.473 3.761 20 0 CHADHO CC(C)c1nc([C@@H](C)NC2CCC([NH+](C)C)CC2)cs1 ZINC000428458274 1124128249 /nfs/dbraw/zinc/12/82/49/1124128249.db2.gz YCXLVWNXSWILIV-IYXRBSQSSA-N 1 3 295.496 3.790 20 0 CHADHO CN1C(C)(C)CC([NH+]2CC3(C2)CCCCC3)CC1(C)C ZINC001171643476 1132081083 /nfs/dbraw/zinc/08/10/83/1132081083.db2.gz UZPSLJHPOMWHHJ-UHFFFAOYSA-N 1 3 278.484 3.904 20 0 CHADHO C[NH+]1C(C)(C)CC(N2CC3(C2)CCCCC3)CC1(C)C ZINC001171643476 1132081089 /nfs/dbraw/zinc/08/10/89/1132081089.db2.gz UZPSLJHPOMWHHJ-UHFFFAOYSA-N 1 3 278.484 3.904 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccc(Cl)s1)C2 ZINC001172101620 1132123756 /nfs/dbraw/zinc/12/37/56/1132123756.db2.gz GGMLSWMQDUZZEF-ZSBIGDGJSA-N 1 3 284.856 3.506 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCc1ccc(SC(F)(F)F)cc1 ZINC000843127104 1132496965 /nfs/dbraw/zinc/49/69/65/1132496965.db2.gz CGLIKZSMJMDMLN-ZJUUUORDSA-N 1 3 292.370 3.514 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001205902586 1133629194 /nfs/dbraw/zinc/62/91/94/1133629194.db2.gz KSIXHALIWPXQDF-FEFZKZJHSA-N 1 3 266.473 3.962 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001205902586 1133629198 /nfs/dbraw/zinc/62/91/98/1133629198.db2.gz KSIXHALIWPXQDF-FEFZKZJHSA-N 1 3 266.473 3.962 20 0 CHADHO C/C(=C/c1ccc(Cl)cc1)CNC[C@@H]1CCC[N@@H+](C)C1 ZINC000532802402 1125583014 /nfs/dbraw/zinc/58/30/14/1125583014.db2.gz IFVMATPREAFGIY-DNXIFWLFSA-N 1 3 292.854 3.675 20 0 CHADHO C/C(=C/c1ccc(Cl)cc1)CNC[C@@H]1CCC[N@H+](C)C1 ZINC000532802402 1125583017 /nfs/dbraw/zinc/58/30/17/1125583017.db2.gz IFVMATPREAFGIY-DNXIFWLFSA-N 1 3 292.854 3.675 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@@H]2N(C)C[C@]2(C)CC[NH2+]C2)cc1 ZINC000261703438 1125739794 /nfs/dbraw/zinc/73/97/94/1125739794.db2.gz CPYUYGOSZALLJI-GBESFXJTSA-N 1 3 286.463 3.563 20 0 CHADHO Cc1ccccc1[C@@H](C(C)C)N(C)C[C@@]1(C)CC[NH2+]C1 ZINC000261994340 1125749409 /nfs/dbraw/zinc/74/94/09/1125749409.db2.gz KPJNOLFIMGJWAZ-MSOLQXFVSA-N 1 3 274.452 3.624 20 0 CHADHO C[C@@H](CN(C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc(Cl)c1 ZINC000261985159 1125749430 /nfs/dbraw/zinc/74/94/30/1125749430.db2.gz RWFQJNVJOOFUAT-QIXHYMPYSA-N 1 3 292.854 3.658 20 0 CHADHO CC(C)C1([NH2+]C2CCN([C@@H]3CCCC[C@H]3C)CC2)CC1 ZINC000645494365 1129500160 /nfs/dbraw/zinc/50/01/60/1129500160.db2.gz HXXUGWLZKVHJAC-NVXWUHKLSA-N 1 3 278.484 3.808 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CCC(C)([NH3+])CC2)cc1 ZINC000647924309 1129587847 /nfs/dbraw/zinc/58/78/47/1129587847.db2.gz XDCBKVAKRGSDFS-AWEZNQCLSA-N 1 3 260.425 3.684 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]CCC2CCCCC2)C1 ZINC000483313231 1126780424 /nfs/dbraw/zinc/78/04/24/1126780424.db2.gz JGIPSXMMMAPCJA-QGZVFWFLSA-N 1 3 266.473 3.667 20 0 CHADHO Cc1ccc(C)c([C@H](C)[NH2+][C@H]2CCC[C@@H](N(C)C)C2)c1 ZINC000484483300 1126818888 /nfs/dbraw/zinc/81/88/88/1126818888.db2.gz GAKUNFOUFMYQEL-YESZJQIVSA-N 1 3 274.452 3.827 20 0 CHADHO CCc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H](N(C)C)C2)s1 ZINC000484473658 1126820287 /nfs/dbraw/zinc/82/02/87/1126820287.db2.gz MVJFKIRBPXWDJB-IHRRRGAJSA-N 1 3 280.481 3.834 20 0 CHADHO CC(C)c1nc(CC[NH2+]C[C@H](N)CCC(C)(C)C)cs1 ZINC000904366402 1126850786 /nfs/dbraw/zinc/85/07/86/1126850786.db2.gz JRPVLKAFYHIGFK-CYBMUJFWSA-N 1 3 297.512 3.552 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CCC[C@H](CN)C1 ZINC001235672465 1130764028 /nfs/dbraw/zinc/76/40/28/1130764028.db2.gz DZVQKTNOUSIODZ-MJSXRHKHSA-N 1 3 252.446 3.574 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CCC[C@H](CN)C1 ZINC001235672465 1130764031 /nfs/dbraw/zinc/76/40/31/1130764031.db2.gz DZVQKTNOUSIODZ-MJSXRHKHSA-N 1 3 252.446 3.574 20 0 CHADHO CC/C=C\CCCCCCN1CCC[C@H](C[NH3+])C1 ZINC001235672465 1130764035 /nfs/dbraw/zinc/76/40/35/1130764035.db2.gz DZVQKTNOUSIODZ-MJSXRHKHSA-N 1 3 252.446 3.574 20 0 CHADHO Cc1cc([C@H](N[C@@H]2CC[N@H+](C)[C@H](C)C2)C2CC2)ccc1F ZINC000271540232 1127089745 /nfs/dbraw/zinc/08/97/45/1127089745.db2.gz QSXOZFJPAXQQGG-MZMPZRCHSA-N 1 3 290.426 3.658 20 0 CHADHO Cc1cc([C@H](N[C@@H]2CC[N@@H+](C)[C@H](C)C2)C2CC2)ccc1F ZINC000271540232 1127089749 /nfs/dbraw/zinc/08/97/49/1127089749.db2.gz QSXOZFJPAXQQGG-MZMPZRCHSA-N 1 3 290.426 3.658 20 0 CHADHO C[N@@H+]1CC[C@H]2[C@@H](CCCN2Cc2ccc(C(F)F)cc2)C1 ZINC000572648017 1127223310 /nfs/dbraw/zinc/22/33/10/1127223310.db2.gz LCROCQZMZDBQLA-HOTGVXAUSA-N 1 3 294.389 3.540 20 0 CHADHO C[N@H+]1CC[C@H]2[C@@H](CCCN2Cc2ccc(C(F)F)cc2)C1 ZINC000572648017 1127223313 /nfs/dbraw/zinc/22/33/13/1127223313.db2.gz LCROCQZMZDBQLA-HOTGVXAUSA-N 1 3 294.389 3.540 20 0 CHADHO C[NH+](C)Cc1cccc(CNCc2ccc3occc3c2)c1 ZINC000285441225 1127228806 /nfs/dbraw/zinc/22/88/06/1127228806.db2.gz LKODTRUAWMPWDV-UHFFFAOYSA-N 1 3 294.398 3.784 20 0 CHADHO Cc1ccncc1CNCc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000354189340 1127298177 /nfs/dbraw/zinc/29/81/77/1127298177.db2.gz LXSJRRJFNBLPOU-UHFFFAOYSA-N 1 3 297.446 3.520 20 0 CHADHO Cc1ccncc1CNCc1cccc(C[N@H+](C)C(C)C)c1 ZINC000354189340 1127298179 /nfs/dbraw/zinc/29/81/79/1127298179.db2.gz LXSJRRJFNBLPOU-UHFFFAOYSA-N 1 3 297.446 3.520 20 0 CHADHO Cc1cc(C)c([C@@H](C)NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1C ZINC000295876240 1129219425 /nfs/dbraw/zinc/21/94/25/1129219425.db2.gz GQFVXIQCNAINIE-CSNJMZFVSA-N 1 3 286.463 3.888 20 0 CHADHO Cc1cc(C)c([C@@H](C)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1C ZINC000295876240 1129219428 /nfs/dbraw/zinc/21/94/28/1129219428.db2.gz GQFVXIQCNAINIE-CSNJMZFVSA-N 1 3 286.463 3.888 20 0 CHADHO CC(C)[C@H]([NH2+]CCCN1CCCC1)c1ccc(F)c(F)c1 ZINC000543774283 1127438416 /nfs/dbraw/zinc/43/84/16/1127438416.db2.gz OOHSXFMLEDSVOT-KRWDZBQOSA-N 1 3 296.405 3.737 20 0 CHADHO C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1ccc(F)c(Cl)c1 ZINC000296044770 1129221111 /nfs/dbraw/zinc/22/11/11/1129221111.db2.gz UQVKJDSQSKMKND-NDNKKMJESA-N 1 3 296.817 3.755 20 0 CHADHO CCN(C)C[C@@H]1CC[N@H+](C[C@H](C)CCc2ccccc2)C1 ZINC000539405106 1127921563 /nfs/dbraw/zinc/92/15/63/1127921563.db2.gz NAVCOJMDDVHJBN-MJGOQNOKSA-N 1 3 288.479 3.529 20 0 CHADHO CCN(C)C[C@@H]1CC[N@@H+](C[C@H](C)CCc2ccccc2)C1 ZINC000539405106 1127921566 /nfs/dbraw/zinc/92/15/66/1127921566.db2.gz NAVCOJMDDVHJBN-MJGOQNOKSA-N 1 3 288.479 3.529 20 0 CHADHO CCc1ccc(CN2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000539895816 1127952044 /nfs/dbraw/zinc/95/20/44/1127952044.db2.gz XNLIIBRCDHBQDC-UYAOXDASSA-N 1 3 298.474 3.698 20 0 CHADHO CCc1ccc(CN2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000539895816 1127952047 /nfs/dbraw/zinc/95/20/47/1127952047.db2.gz XNLIIBRCDHBQDC-UYAOXDASSA-N 1 3 298.474 3.698 20 0 CHADHO Clc1cccc2c1CCC[C@@H]2[NH2+]CCCN1CCCC1 ZINC000541749777 1128037760 /nfs/dbraw/zinc/03/77/60/1128037760.db2.gz SKHREAXIHOQSOS-KRWDZBQOSA-N 1 3 292.854 3.793 20 0 CHADHO CCC[N@H+](Cc1cc2ccccc2s1)C1CCNCC1 ZINC000470021689 1128062507 /nfs/dbraw/zinc/06/25/07/1128062507.db2.gz AEDPBFBFFXTKJV-UHFFFAOYSA-N 1 3 288.460 3.865 20 0 CHADHO CCC[N@@H+](Cc1cc2ccccc2s1)C1CCNCC1 ZINC000470021689 1128062511 /nfs/dbraw/zinc/06/25/11/1128062511.db2.gz AEDPBFBFFXTKJV-UHFFFAOYSA-N 1 3 288.460 3.865 20 0 CHADHO CCCN(Cc1cc2ccccc2s1)C1CC[NH2+]CC1 ZINC000470021689 1128062515 /nfs/dbraw/zinc/06/25/15/1128062515.db2.gz AEDPBFBFFXTKJV-UHFFFAOYSA-N 1 3 288.460 3.865 20 0 CHADHO CCCC[C@@H](CC)CC[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000557097220 1128091783 /nfs/dbraw/zinc/09/17/83/1128091783.db2.gz JERUDVZUEWCMNY-IAGOWNOFSA-N 1 3 268.489 3.913 20 0 CHADHO CCCOc1ccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000222929250 1128179634 /nfs/dbraw/zinc/17/96/34/1128179634.db2.gz IEQWRASUGHPXSM-YQQAZPJKSA-N 1 3 290.451 3.609 20 0 CHADHO CCCOc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000222929250 1128179637 /nfs/dbraw/zinc/17/96/37/1128179637.db2.gz IEQWRASUGHPXSM-YQQAZPJKSA-N 1 3 290.451 3.609 20 0 CHADHO CCCCCC[C@@H](C)N1CCN(c2cc[nH+]cc2)CC1 ZINC001257363386 1128275179 /nfs/dbraw/zinc/27/51/79/1128275179.db2.gz NGHIMSBYANSIDP-MRXNPFEDSA-N 1 3 275.440 3.563 20 0 CHADHO CCCCCC[C@@H](C)[NH+]1CCN(c2ccncc2)CC1 ZINC001257363386 1128275183 /nfs/dbraw/zinc/27/51/83/1128275183.db2.gz NGHIMSBYANSIDP-MRXNPFEDSA-N 1 3 275.440 3.563 20 0 CHADHO CC(C)CCC[C@H](C)[NH2+][C@H]1CCC[C@@H](N(C)C)C1 ZINC000715232776 1128290155 /nfs/dbraw/zinc/29/01/55/1128290155.db2.gz AIQQNSVLOXTGOO-HRCADAONSA-N 1 3 254.462 3.664 20 0 CHADHO CCCCCC[C@H](C)[NH+]1C[C@@H]2CN(CCC)C[C@H]2C1 ZINC001257372896 1128285022 /nfs/dbraw/zinc/28/50/22/1128285022.db2.gz QQUBSJXBQODEEY-ULQDDVLXSA-N 1 3 266.473 3.619 20 0 CHADHO Cc1ccc([C@@H](NC2CC[NH+](C(C)C)CC2)C2CC2)cc1 ZINC000037236729 1128425306 /nfs/dbraw/zinc/42/53/06/1128425306.db2.gz AAUUAXDSSNLEKX-LJQANCHMSA-N 1 3 286.463 3.909 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2cc(C)c(C)cc2C)C1 ZINC000037644188 1128433897 /nfs/dbraw/zinc/43/38/97/1128433897.db2.gz TXXDJRJBDZNRTP-IRXDYDNUSA-N 1 3 274.452 3.604 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@@H](C)c2cc(C)c(C)cc2C)C1 ZINC000037644188 1128433898 /nfs/dbraw/zinc/43/38/98/1128433898.db2.gz TXXDJRJBDZNRTP-IRXDYDNUSA-N 1 3 274.452 3.604 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@@H](C)c2cc(C)c(C)cc2C)C1 ZINC000037644188 1128433900 /nfs/dbraw/zinc/43/39/00/1128433900.db2.gz TXXDJRJBDZNRTP-IRXDYDNUSA-N 1 3 274.452 3.604 20 0 CHADHO CC(C)[C@H](NC[C@@H](C)C[NH+]1CCCC1)c1ccccc1 ZINC000062078833 1128437220 /nfs/dbraw/zinc/43/72/20/1128437220.db2.gz NZARNNYHUSSJMF-AEFFLSMTSA-N 1 3 274.452 3.705 20 0 CHADHO CC(C)[C@H]([NH2+]C[C@@H](C)CN1CCCC1)c1ccccc1 ZINC000062078833 1128437221 /nfs/dbraw/zinc/43/72/21/1128437221.db2.gz NZARNNYHUSSJMF-AEFFLSMTSA-N 1 3 274.452 3.705 20 0 CHADHO CCC1CCC([NH2+]C[C@H](C)CN2CCCCC2)CC1 ZINC000037997615 1128438122 /nfs/dbraw/zinc/43/81/22/1128438122.db2.gz RSHAMUXFBFMUHH-GTPINHCMSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@@H](c1cc2ccccc2o1)[N@H+](C)CC[C@@H]1CCCN1C ZINC000124847876 1128446210 /nfs/dbraw/zinc/44/62/10/1128446210.db2.gz YFYOXQADFFOHCO-HOCLYGCPSA-N 1 3 286.419 3.910 20 0 CHADHO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)CC[C@@H]1CCCN1C ZINC000124847876 1128446211 /nfs/dbraw/zinc/44/62/11/1128446211.db2.gz YFYOXQADFFOHCO-HOCLYGCPSA-N 1 3 286.419 3.910 20 0 CHADHO CC(C)Cc1cccc([C@H](C)NC[C@@H]2CCC[N@H+](C)C2)c1 ZINC000563904462 1128484071 /nfs/dbraw/zinc/48/40/71/1128484071.db2.gz YYZPUCULLKLRSZ-WMZOPIPTSA-N 1 3 288.479 3.878 20 0 CHADHO CC(C)Cc1cccc([C@H](C)NC[C@@H]2CCC[N@@H+](C)C2)c1 ZINC000563904462 1128484073 /nfs/dbraw/zinc/48/40/73/1128484073.db2.gz YYZPUCULLKLRSZ-WMZOPIPTSA-N 1 3 288.479 3.878 20 0 CHADHO C[C@H](CN[C@@H](CC1CC1)c1ccccc1)C[NH+]1CCCC1 ZINC000566772586 1128551204 /nfs/dbraw/zinc/55/12/04/1128551204.db2.gz OQOSQFKUPZQLNB-APWZRJJASA-N 1 3 286.463 3.849 20 0 CHADHO C[C@H]1C[C@H]([NH2+]CC(C)(C)CN(C)C)c2ccsc2S1 ZINC000130163102 1128569743 /nfs/dbraw/zinc/56/97/43/1128569743.db2.gz HPLLKWWWQCKTSF-AAEUAGOBSA-N 1 3 298.521 3.851 20 0 CHADHO CCN1CCC[C@H](C[NH2+][C@H](C)c2cc3ccccc3o2)C1 ZINC000567718568 1128570115 /nfs/dbraw/zinc/57/01/15/1128570115.db2.gz GYAXLBMSWDYBOV-HUUCEWRRSA-N 1 3 286.419 3.815 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H]2CCCc3c(Cl)cccc32)C1 ZINC000568801506 1128592480 /nfs/dbraw/zinc/59/24/80/1128592480.db2.gz XQIQNLYGOLPVIP-GUYCJALGSA-N 1 3 292.854 3.649 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H]2CCCc3c(Cl)cccc32)C1 ZINC000568801506 1128592483 /nfs/dbraw/zinc/59/24/83/1128592483.db2.gz XQIQNLYGOLPVIP-GUYCJALGSA-N 1 3 292.854 3.649 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H]2CCCc3c(Cl)cccc32)C1 ZINC000568801506 1128592485 /nfs/dbraw/zinc/59/24/85/1128592485.db2.gz XQIQNLYGOLPVIP-GUYCJALGSA-N 1 3 292.854 3.649 20 0 CHADHO CC(C)(C[NH2+][C@H]1CC[C@H]1C(C)(C)C)CN1CCCC1 ZINC000571868516 1128639505 /nfs/dbraw/zinc/63/95/05/1128639505.db2.gz OCLRANONQXBTQB-CABCVRRESA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)[C@@H]1CC[C@H]1[NH2+]C1CCN(CC2CCCC2)CC1 ZINC000572906780 1128649309 /nfs/dbraw/zinc/64/93/09/1128649309.db2.gz IYZYRGDGCWOPPJ-ZWKOTPCHSA-N 1 3 278.484 3.665 20 0 CHADHO CN1CC2(C1)CC[NH+](Cc1ccc(F)c3ccccc13)CC2 ZINC001139891982 1117782631 /nfs/dbraw/zinc/78/26/31/1117782631.db2.gz IYKQPIVCOXGDOZ-UHFFFAOYSA-N 1 3 298.405 3.507 20 0 CHADHO c1ccc2c(c1)CCCC[C@H]2N[C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643545715 1117791282 /nfs/dbraw/zinc/79/12/82/1117791282.db2.gz BFYWVZVJRUVWFS-FUHWJXTLSA-N 1 3 284.447 3.718 20 0 CHADHO CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+][C@H]1CCNC2(CCC2)C1 ZINC000643546235 1117792059 /nfs/dbraw/zinc/79/20/59/1117792059.db2.gz KSAAYOISRASYLG-TWMKSMIVSA-N 1 3 278.484 3.712 20 0 CHADHO Cc1cccc(C[C@@H]([NH2+][C@@H]2CCNC3(CCC3)C2)C2CC2)c1 ZINC000643546031 1117792490 /nfs/dbraw/zinc/79/24/90/1117792490.db2.gz HFMBKHICEVFQEO-RTBURBONSA-N 1 3 298.474 3.580 20 0 CHADHO C1CC2(C1)C[C@@H]([NH2+][C@H]1CCCCC13CCCC3)CCN2 ZINC000643548152 1117799253 /nfs/dbraw/zinc/79/92/53/1117799253.db2.gz NCKVPRSXRYERRZ-HOTGVXAUSA-N 1 3 276.468 3.754 20 0 CHADHO C[C@H](CN1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1)C(C)(C)C ZINC000670265662 1117828898 /nfs/dbraw/zinc/82/88/98/1117828898.db2.gz PAEJAAUEDXDFKP-INMHGKMJSA-N 1 3 278.484 3.617 20 0 CHADHO C[C@H](CN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)C(C)(C)C ZINC000670265662 1117828905 /nfs/dbraw/zinc/82/89/05/1117828905.db2.gz PAEJAAUEDXDFKP-INMHGKMJSA-N 1 3 278.484 3.617 20 0 CHADHO CCC[NH+]1CCC(N[C@H](c2ccccc2)C2CCC2)CC1 ZINC000119224449 1117877074 /nfs/dbraw/zinc/87/70/74/1117877074.db2.gz FWXPGLSKWPVOCV-LJQANCHMSA-N 1 3 286.463 3.992 20 0 CHADHO CC(C)[C@@H](C[NH2+]C[C@@H]1CCCCN(C)C1)c1ccccc1 ZINC000623656804 1117885625 /nfs/dbraw/zinc/88/56/25/1117885625.db2.gz CELMSXRUZBHTOX-PKOBYXMFSA-N 1 3 288.479 3.748 20 0 CHADHO CC[C@H]([NH2+]C[C@@H]1CCN(CC)C1)c1cc(C)ccc1C ZINC000623867012 1117948283 /nfs/dbraw/zinc/94/82/83/1117948283.db2.gz NGDSZVUDBBOWDQ-WMZOPIPTSA-N 1 3 274.452 3.686 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+]C[C@@H](C)CCc2ccccc2)C1 ZINC000579388886 1128747443 /nfs/dbraw/zinc/74/74/43/1128747443.db2.gz OKHFYVKVBAVWPV-HKUYNNGSSA-N 1 3 288.479 3.575 20 0 CHADHO CSc1ccc([C@@H](C)[NH2+]C[C@H]2CCCCN(C)C2)cc1 ZINC000624120248 1117985105 /nfs/dbraw/zinc/98/51/05/1117985105.db2.gz UTSKGVBSRLKDJN-HUUCEWRRSA-N 1 3 292.492 3.791 20 0 CHADHO Cc1cccc([C@@H](C)NC[C@H]2CCCC[N@H+](C)C2)c1C ZINC000624120923 1117986002 /nfs/dbraw/zinc/98/60/02/1117986002.db2.gz KIGGADGZBYGEKK-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO Cc1cccc([C@@H](C)NC[C@H]2CCCC[N@@H+](C)C2)c1C ZINC000624120923 1117986007 /nfs/dbraw/zinc/98/60/07/1117986007.db2.gz KIGGADGZBYGEKK-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO Cc1cccc([C@@H](C)[NH2+]C[C@H]2CCCCN(C)C2)c1C ZINC000624120923 1117986008 /nfs/dbraw/zinc/98/60/08/1117986008.db2.gz KIGGADGZBYGEKK-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO CSc1ccc([C@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)cc1 ZINC000624120247 1117986316 /nfs/dbraw/zinc/98/63/16/1117986316.db2.gz UTSKGVBSRLKDJN-GJZGRUSLSA-N 1 3 292.492 3.791 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN(CCCc2ccc(C)cc2)C1 ZINC000181943606 1118010647 /nfs/dbraw/zinc/01/06/47/1118010647.db2.gz BNWVCFDFLXFDEN-LJQANCHMSA-N 1 3 288.479 3.591 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN(CCCc2ccc(C)cc2)C1 ZINC000181943606 1118010652 /nfs/dbraw/zinc/01/06/52/1118010652.db2.gz BNWVCFDFLXFDEN-LJQANCHMSA-N 1 3 288.479 3.591 20 0 CHADHO CCSc1ccc([C@H](C)[NH2+]CC[C@H]2CCCN2C)cc1 ZINC000182137926 1118015346 /nfs/dbraw/zinc/01/53/46/1118015346.db2.gz XTBNXEHWLCNQKA-GOEBONIOSA-N 1 3 292.492 3.934 20 0 CHADHO CC[C@@H](NC[C@H]1CC[N@H+](CC)C1)c1cccc(Cl)c1 ZINC000037644054 1118033157 /nfs/dbraw/zinc/03/31/57/1118033157.db2.gz VMJWEHDTNXYKHC-CZUORRHYSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@@H](NC[C@H]1CC[N@@H+](CC)C1)c1cccc(Cl)c1 ZINC000037644054 1118033163 /nfs/dbraw/zinc/03/31/63/1118033163.db2.gz VMJWEHDTNXYKHC-CZUORRHYSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@@H]([NH2+]C[C@H]1CCN(CC)C1)c1cccc(Cl)c1 ZINC000037644054 1118033167 /nfs/dbraw/zinc/03/31/67/1118033167.db2.gz VMJWEHDTNXYKHC-CZUORRHYSA-N 1 3 280.843 3.723 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H](C)CCC(C)(C)C)C1 ZINC000579620817 1128753232 /nfs/dbraw/zinc/75/32/32/1128753232.db2.gz CXMCFARMQMXPBY-HZPDHXFCSA-N 1 3 268.489 3.911 20 0 CHADHO C[C@@H]([NH2+]CCC1CCCC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000185725410 1118064027 /nfs/dbraw/zinc/06/40/27/1118064027.db2.gz UISUSVYPZZDNMI-NVXWUHKLSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@H](CSC(C)(C)C)[NH2+]CCCN1CCC(C)CC1 ZINC000764641206 1118103727 /nfs/dbraw/zinc/10/37/27/1118103727.db2.gz PLDYAWPEPZZQTO-OAHLLOKOSA-N 1 3 286.529 3.618 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@@H](C)c2cccc(C3CC3)c2)C1 ZINC000340188100 1118106098 /nfs/dbraw/zinc/10/60/98/1118106098.db2.gz DWYGJEZGKGYETG-GJZGRUSLSA-N 1 3 272.436 3.556 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@@H](C)c2cccc(C3CC3)c2)C1 ZINC000340188100 1118106099 /nfs/dbraw/zinc/10/60/99/1118106099.db2.gz DWYGJEZGKGYETG-GJZGRUSLSA-N 1 3 272.436 3.556 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2cccc(C3CC3)c2)C1 ZINC000340188100 1118106101 /nfs/dbraw/zinc/10/61/01/1118106101.db2.gz DWYGJEZGKGYETG-GJZGRUSLSA-N 1 3 272.436 3.556 20 0 CHADHO CCCCCC[C@@H](C)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000705966993 1118118021 /nfs/dbraw/zinc/11/80/21/1118118021.db2.gz KITSXIYUBBCBMN-CVEARBPZSA-N 1 3 254.462 3.667 20 0 CHADHO Cc1cccc2[nH]c(C[NH2+]C3C[C@H]4CCC[C@@H](C3)N4C)cc21 ZINC000144100832 1118139397 /nfs/dbraw/zinc/13/93/97/1118139397.db2.gz PRMPNQRARHPTNQ-ZXFUBFMLSA-N 1 3 297.446 3.581 20 0 CHADHO C[C@@H]1C[C@H](N[C@@H]2CCCc3c(Cl)cccc32)CC[N@@H+]1C ZINC000542662802 1118194756 /nfs/dbraw/zinc/19/47/56/1118194756.db2.gz LLAXWOFCNRUDHE-PBFPGSCMSA-N 1 3 292.854 3.790 20 0 CHADHO C[C@@H]1C[C@H](N[C@@H]2CCCc3c(Cl)cccc32)CC[N@H+]1C ZINC000542662802 1118194757 /nfs/dbraw/zinc/19/47/57/1118194757.db2.gz LLAXWOFCNRUDHE-PBFPGSCMSA-N 1 3 292.854 3.790 20 0 CHADHO C[NH+](C)CC[C@@H](NCc1ccc2cnccc2c1)C(C)(C)C ZINC000683773071 1118354444 /nfs/dbraw/zinc/35/44/44/1118354444.db2.gz VLOMVYDKQHCAHU-GOSISDBHSA-N 1 3 299.462 3.691 20 0 CHADHO CCCC[C@H](C)[C@H](C)[NH2+]CCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000580120647 1118383016 /nfs/dbraw/zinc/38/30/16/1118383016.db2.gz GLMNAHSZPIPTDC-MLHJIOFPSA-N 1 3 298.515 3.680 20 0 CHADHO C/C(=C/c1ccccc1)CN[C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000255297788 1118412223 /nfs/dbraw/zinc/41/22/23/1118412223.db2.gz HDMXZCGSHWDWFU-ARBVUSPFSA-N 1 3 272.436 3.552 20 0 CHADHO COc1cc(C)ccc1[C@@H](C)NCc1ccc([C@H](C)[NH3+])cc1 ZINC000565710360 1118477146 /nfs/dbraw/zinc/47/71/46/1118477146.db2.gz ITSLVMMYEHDXBT-LSDHHAIUSA-N 1 3 298.430 3.874 20 0 CHADHO CC[N@H+](CCCN1CCCC1)Cc1ccc2ncccc2c1 ZINC000349363020 1118534811 /nfs/dbraw/zinc/53/48/11/1118534811.db2.gz DODNONFSZIZPRF-UHFFFAOYSA-N 1 3 297.446 3.543 20 0 CHADHO CC[N@@H+](CCCN1CCCC1)Cc1ccc2ncccc2c1 ZINC000349363020 1118534815 /nfs/dbraw/zinc/53/48/15/1118534815.db2.gz DODNONFSZIZPRF-UHFFFAOYSA-N 1 3 297.446 3.543 20 0 CHADHO C[NH+](C)Cc1cccc(CN[C@@H]2CCc3ccc(F)cc32)c1 ZINC000123666029 1118556981 /nfs/dbraw/zinc/55/69/81/1118556981.db2.gz VTPDETIIOSUDLJ-LJQANCHMSA-N 1 3 298.405 3.664 20 0 CHADHO C[C@@H](NCCC[NH3+])c1ccc(O[C@H](C)c2ccccc2)cc1 ZINC000656786901 1118659073 /nfs/dbraw/zinc/65/90/73/1118659073.db2.gz DIZWRXNEPIFMTA-HZPDHXFCSA-N 1 3 298.430 3.826 20 0 CHADHO C[C@@H](NCCC[NH3+])c1ccc(O[C@@H](C)c2ccccc2)cc1 ZINC000656786899 1118659376 /nfs/dbraw/zinc/65/93/76/1118659376.db2.gz DIZWRXNEPIFMTA-CVEARBPZSA-N 1 3 298.430 3.826 20 0 CHADHO C[C@H](c1ccc(Cl)c(Cl)c1)N1CC[C@H](CC[NH3+])C1 ZINC000723691312 1118706719 /nfs/dbraw/zinc/70/67/19/1118706719.db2.gz MAGBJFWOEOBRSY-MNOVXSKESA-N 1 3 287.234 3.725 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+][C@@H]2CCC[C@H]2CCCF)C1 ZINC000510752886 1118807474 /nfs/dbraw/zinc/80/74/74/1118807474.db2.gz OCHDAKLUSZLKDA-FGTMMUONSA-N 1 3 298.490 3.862 20 0 CHADHO C[C@H](c1ccc(F)c(Cl)c1)N1CCC2(CC[NH2+]C2)CC1 ZINC000431012497 1118809880 /nfs/dbraw/zinc/80/98/80/1118809880.db2.gz FMAWMGMZMXXVLV-GFCCVEGCSA-N 1 3 296.817 3.616 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]C[C@H]2CCC[C@@H](C)C2)C1 ZINC000092565120 1118856378 /nfs/dbraw/zinc/85/63/78/1118856378.db2.gz DLFCCGNRGGPMMF-IKGGRYGDSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@H](C[NH2+]C1CC(C)(C)CC(C)(C)C1)CN1CCCC1 ZINC000129719756 1118885367 /nfs/dbraw/zinc/88/53/67/1118885367.db2.gz XLZHAAAPSFHHNX-OAHLLOKOSA-N 1 3 280.500 3.913 20 0 CHADHO C[C@@H]1C[C@@H]([N@H+](C[C@@H]2CCCNC2)C2CC2)CC(C)(C)C1 ZINC000226436736 1118928223 /nfs/dbraw/zinc/92/82/23/1118928223.db2.gz FEFUVGRQTHZHPI-BFYDXBDKSA-N 1 3 278.484 3.665 20 0 CHADHO C[C@@H]1C[C@@H]([N@@H+](C[C@@H]2CCCNC2)C2CC2)CC(C)(C)C1 ZINC000226436736 1118928224 /nfs/dbraw/zinc/92/82/24/1118928224.db2.gz FEFUVGRQTHZHPI-BFYDXBDKSA-N 1 3 278.484 3.665 20 0 CHADHO CC(C)(C[NH2+][C@@H]1CCC[C@H]1CCCF)CN1CCCC1 ZINC000511031376 1118962408 /nfs/dbraw/zinc/96/24/08/1118962408.db2.gz QLPWTPHEXWBCTF-JKSUJKDBSA-N 1 3 284.463 3.616 20 0 CHADHO CC[C@H](c1ccccc1)N(C)CC(C)(C)C[NH+](C)C ZINC001207282310 1119036483 /nfs/dbraw/zinc/03/64/83/1119036483.db2.gz HIMOXRHIZLOLEY-MRXNPFEDSA-N 1 3 262.441 3.657 20 0 CHADHO C[C@H](CC1CCCC1)[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663470223 1119155852 /nfs/dbraw/zinc/15/58/52/1119155852.db2.gz TTXJHVYICVPVLQ-QAPCUYQASA-N 1 3 278.484 3.667 20 0 CHADHO CC(C)(C)OCCC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000657637272 1119217970 /nfs/dbraw/zinc/21/79/70/1119217970.db2.gz DXFJEWKENFVTCM-UHFFFAOYSA-N 1 3 296.499 3.578 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+]C[C@H]1C[C@H]1c1ccccc1 ZINC000343090272 1119307159 /nfs/dbraw/zinc/30/71/59/1119307159.db2.gz DPSOSMPNGOVSSV-QRQLOZEOSA-N 1 3 286.463 3.644 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+]C[C@@H]1C[C@@H]1c1ccccc1 ZINC000343090271 1119307269 /nfs/dbraw/zinc/30/72/69/1119307269.db2.gz DPSOSMPNGOVSSV-NZSAHSFTSA-N 1 3 286.463 3.644 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@@H](C)c2cccc(C)c2C)C1 ZINC000151102617 1119396046 /nfs/dbraw/zinc/39/60/46/1119396046.db2.gz WBFDNUFEZKKSKL-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@@H](C)c2cccc(C)c2C)C1 ZINC000151102617 1119396047 /nfs/dbraw/zinc/39/60/47/1119396047.db2.gz WBFDNUFEZKKSKL-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccccc1[C@@H]1C[C@H]1N[C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000650742411 1119396988 /nfs/dbraw/zinc/39/69/88/1119396988.db2.gz XRCMONIFFTTZQS-LCWAXJCOSA-N 1 3 298.474 3.751 20 0 CHADHO Cc1ccc2nccc(N(C)C3C[C@H]4CC[C@@H](C3)[N@H+]4C)c2c1 ZINC000343365157 1119397984 /nfs/dbraw/zinc/39/79/84/1119397984.db2.gz LTYVJGYWPZTYTH-XYPWUTKMSA-N 1 3 295.430 3.605 20 0 CHADHO Cc1ccc2nccc(N(C)C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)c2c1 ZINC000343365157 1119397989 /nfs/dbraw/zinc/39/79/89/1119397989.db2.gz LTYVJGYWPZTYTH-XYPWUTKMSA-N 1 3 295.430 3.605 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@@H]1CC(C)(C)Cc2occc21 ZINC000650758388 1119415872 /nfs/dbraw/zinc/41/58/72/1119415872.db2.gz OJHNUANFZHEYCM-QGZVFWFLSA-N 1 3 298.430 3.802 20 0 CHADHO C([NH2+]C1CCN(C2CCCCC2)CC1)C1CCCCC1 ZINC000151853644 1119511682 /nfs/dbraw/zinc/51/16/82/1119511682.db2.gz ODIVUMAJRALDCE-UHFFFAOYSA-N 1 3 278.484 3.953 20 0 CHADHO C([NH2+]C1CCN(C2CCCCC2)CC1)C1(C2CC2)CC1 ZINC000090772971 1119549822 /nfs/dbraw/zinc/54/98/22/1119549822.db2.gz MKSHUYLGEYHIBG-UHFFFAOYSA-N 1 3 276.468 3.563 20 0 CHADHO CC(C)[C@@H](NCc1cccc(C[NH+](C)C)c1)c1cccnc1 ZINC000091281253 1119554969 /nfs/dbraw/zinc/55/49/69/1119554969.db2.gz YDYGEGSJAWXJHP-LJQANCHMSA-N 1 3 297.446 3.630 20 0 CHADHO CC[C@@H](N)C[NH2+][C@@H](C)c1ccc(OCc2ccccc2)cc1 ZINC000231439035 1119589180 /nfs/dbraw/zinc/58/91/80/1119589180.db2.gz PXFIUZYKQAQFJV-MAUKXSAKSA-N 1 3 298.430 3.654 20 0 CHADHO C[NH+]1CCC([C@H]2CCN(Cc3cscc3Cl)C2)CC1 ZINC000685462803 1119610531 /nfs/dbraw/zinc/61/05/31/1119610531.db2.gz HZOCEXHHINJCES-ZDUSSCGKSA-N 1 3 298.883 3.565 20 0 CHADHO CC[N@H+](CCCN1CCCC1)Cc1ccc2cnccc2c1 ZINC000685459720 1119612516 /nfs/dbraw/zinc/61/25/16/1119612516.db2.gz CCVDJODZIUUREO-UHFFFAOYSA-N 1 3 297.446 3.543 20 0 CHADHO CC[N@@H+](CCCN1CCCC1)Cc1ccc2cnccc2c1 ZINC000685459720 1119612518 /nfs/dbraw/zinc/61/25/18/1119612518.db2.gz CCVDJODZIUUREO-UHFFFAOYSA-N 1 3 297.446 3.543 20 0 CHADHO C[C@@H]([NH2+]CC[C@H](C)N1CCCCC1)C(C)(C)C(F)F ZINC000657973302 1119657473 /nfs/dbraw/zinc/65/74/73/1119657473.db2.gz PQJGHMIQGLMOSI-QWHCGFSZSA-N 1 3 276.415 3.520 20 0 CHADHO C[C@@H](Cc1cccs1)N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000658229264 1119706925 /nfs/dbraw/zinc/70/69/25/1119706925.db2.gz PYPGSUHNPDOHOH-LSDHHAIUSA-N 1 3 292.492 3.676 20 0 CHADHO C[C@@H](Cc1cccs1)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000658229264 1119706927 /nfs/dbraw/zinc/70/69/27/1119706927.db2.gz PYPGSUHNPDOHOH-LSDHHAIUSA-N 1 3 292.492 3.676 20 0 CHADHO CC(C)CCN1CCC([NH2+]CC[C@@]2(C)CC2(F)F)CC1 ZINC000926704273 1119830762 /nfs/dbraw/zinc/83/07/62/1119830762.db2.gz IIIFSMRYDNWAGT-HNNXBMFYSA-N 1 3 288.426 3.522 20 0 CHADHO Cc1ccc([C@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)C2CC2)cc1 ZINC000295051311 1119846647 /nfs/dbraw/zinc/84/66/47/1119846647.db2.gz PNRDDYGDRYSIMF-IPQPSQTFSA-N 1 3 284.447 3.661 20 0 CHADHO Cc1ccc([C@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)C2CC2)cc1 ZINC000295051311 1119846651 /nfs/dbraw/zinc/84/66/51/1119846651.db2.gz PNRDDYGDRYSIMF-IPQPSQTFSA-N 1 3 284.447 3.661 20 0 CHADHO CC1=C[C@H](C)C[C@@H](CN2CCC[C@H]([NH+]3CCCC3)C2)C1 ZINC000685834263 1119852947 /nfs/dbraw/zinc/85/29/47/1119852947.db2.gz BLLABQWKIFXTGD-JQHSSLGASA-N 1 3 276.468 3.539 20 0 CHADHO C[C@@H](N[C@H](C)c1cccc(C[NH+](C)C)c1)c1cccnc1 ZINC000924565010 1119861720 /nfs/dbraw/zinc/86/17/20/1119861720.db2.gz QVFQALKEHRMISB-HUUCEWRRSA-N 1 3 283.419 3.555 20 0 CHADHO COc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)c(C)c1 ZINC000414121598 1119906785 /nfs/dbraw/zinc/90/67/85/1119906785.db2.gz ZWYLPYZGQVRMQV-ARFHVFGLSA-N 1 3 290.451 3.527 20 0 CHADHO C[C@H](C[NH2+]C[C@@H]1CCCCN(C)C1)c1cccc(Cl)c1 ZINC000623657332 1120065110 /nfs/dbraw/zinc/06/51/10/1120065110.db2.gz NXGXUACVWBIDCO-CABCVRRESA-N 1 3 294.870 3.765 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H](N(C)C)C2)CC(C)(C)C1 ZINC000715539225 1120082188 /nfs/dbraw/zinc/08/21/88/1120082188.db2.gz BTYCYBAYJSYXPJ-FXUDXRNXSA-N 1 3 266.473 3.664 20 0 CHADHO CC(C)[NH+]1CCC(Nc2ccnc3ccccc32)CC1 ZINC000110117432 1120096319 /nfs/dbraw/zinc/09/63/19/1120096319.db2.gz KCDVOJXFYZGSMD-UHFFFAOYSA-N 1 3 269.392 3.520 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@H]2CCC[C@@H]2c2ccccc2)C1 ZINC000624122683 1120105278 /nfs/dbraw/zinc/10/52/78/1120105278.db2.gz YOEOFPCFBQMMFC-QRQLOZEOSA-N 1 3 286.463 3.644 20 0 CHADHO C[C@@H](c1cccc(F)c1)[N@H+](C)CC[C@H]1CCCCN1C ZINC000472774027 1120171549 /nfs/dbraw/zinc/17/15/49/1120171549.db2.gz RKJABCCTQNBIJL-WMLDXEAASA-N 1 3 278.415 3.693 20 0 CHADHO C[C@@H](c1cccc(F)c1)[N@@H+](C)CC[C@H]1CCCCN1C ZINC000472774027 1120171553 /nfs/dbraw/zinc/17/15/53/1120171553.db2.gz RKJABCCTQNBIJL-WMLDXEAASA-N 1 3 278.415 3.693 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H](C)C2CCC(F)(F)CC2)C1 ZINC000685455739 1120177981 /nfs/dbraw/zinc/17/79/81/1120177981.db2.gz ZMDNNSCJPUKUDJ-UONOGXRCSA-N 1 3 288.426 3.520 20 0 CHADHO C[C@@H](C[NH2+]CCCN1CCCC[C@@H]1C)c1ccccc1 ZINC000216028673 1120242456 /nfs/dbraw/zinc/24/24/56/1120242456.db2.gz UOYWQACWGYAADK-IRXDYDNUSA-N 1 3 274.452 3.644 20 0 CHADHO CN1CCC[C@@H]2C[N@H+](CC[C@H]3CCc4ccccc43)CC[C@H]21 ZINC000660009769 1120339071 /nfs/dbraw/zinc/33/90/71/1120339071.db2.gz ACHBPBQAQHRWLQ-QWFCFKBJSA-N 1 3 298.474 3.523 20 0 CHADHO CN1CCC[C@@H]2C[N@@H+](CC[C@H]3CCc4ccccc43)CC[C@H]21 ZINC000660009769 1120339076 /nfs/dbraw/zinc/33/90/76/1120339076.db2.gz ACHBPBQAQHRWLQ-QWFCFKBJSA-N 1 3 298.474 3.523 20 0 CHADHO N[C@@H]1C[C@H]([NH2+]CC2(C(F)(F)F)CCCC2)c2ccccc21 ZINC000629551980 1128915487 /nfs/dbraw/zinc/91/54/87/1128915487.db2.gz ZCALOSOFEMLKPB-KGLIPLIRSA-N 1 3 298.352 3.844 20 0 CHADHO C[C@H](N[C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(C2CC2)cc1 ZINC000417356890 1120435896 /nfs/dbraw/zinc/43/58/96/1120435896.db2.gz QNRJSGXHKSMEFO-SUNYJGFJSA-N 1 3 272.436 3.697 20 0 CHADHO C[C@H](N[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(C2CC2)cc1 ZINC000417356890 1120435899 /nfs/dbraw/zinc/43/58/99/1120435899.db2.gz QNRJSGXHKSMEFO-SUNYJGFJSA-N 1 3 272.436 3.697 20 0 CHADHO CN(C[C@@H]1CCC[N@H+](C)C1)[C@@H]1CCc2ccc(Cl)cc21 ZINC000543203718 1120462147 /nfs/dbraw/zinc/46/21/47/1120462147.db2.gz VPTKCGWFAKFUNC-CXAGYDPISA-N 1 3 292.854 3.601 20 0 CHADHO CN(C[C@@H]1CCC[N@@H+](C)C1)[C@@H]1CCc2ccc(Cl)cc21 ZINC000543203718 1120462149 /nfs/dbraw/zinc/46/21/49/1120462149.db2.gz VPTKCGWFAKFUNC-CXAGYDPISA-N 1 3 292.854 3.601 20 0 CHADHO Clc1ccc2c(c1)CC[C@H]2NC1CC[NH+](C2CC2)CC1 ZINC000119717357 1120480793 /nfs/dbraw/zinc/48/07/93/1120480793.db2.gz XNQNPFZLGWOELF-QGZVFWFLSA-N 1 3 290.838 3.544 20 0 CHADHO C[C@@H](c1ccc(Cl)cc1)[N@H+](C)CCCN1CCCC1 ZINC000499945001 1120559932 /nfs/dbraw/zinc/55/99/32/1120559932.db2.gz KEHDJRGUERNZQR-AWEZNQCLSA-N 1 3 280.843 3.819 20 0 CHADHO C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)CCCN1CCCC1 ZINC000499945001 1120559936 /nfs/dbraw/zinc/55/99/36/1120559936.db2.gz KEHDJRGUERNZQR-AWEZNQCLSA-N 1 3 280.843 3.819 20 0 CHADHO CSCC1CCC(N[C@H](c2ccccc2)[C@H](C)[NH3+])CC1 ZINC000925677801 1120565275 /nfs/dbraw/zinc/56/52/75/1120565275.db2.gz ABDBIJJNDPHOKG-DXCHVLGVSA-N 1 3 292.492 3.586 20 0 CHADHO CSCC1CCC(N[C@H](c2ccccc2)[C@@H](C)[NH3+])CC1 ZINC000925677807 1120565297 /nfs/dbraw/zinc/56/52/97/1120565297.db2.gz ABDBIJJNDPHOKG-LYSZQXJVSA-N 1 3 292.492 3.586 20 0 CHADHO CC1=CC[C@@H](CC[N@@H+]2CC[C@]3(C2)CCCCN3)C1(C)C ZINC001222421119 1120595365 /nfs/dbraw/zinc/59/53/65/1120595365.db2.gz IOLSTFLSWHAFFY-WMZOPIPTSA-N 1 3 276.468 3.587 20 0 CHADHO CC1=CC[C@@H](CC[N@H+]2CC[C@]3(C2)CCCCN3)C1(C)C ZINC001222421119 1120595369 /nfs/dbraw/zinc/59/53/69/1120595369.db2.gz IOLSTFLSWHAFFY-WMZOPIPTSA-N 1 3 276.468 3.587 20 0 CHADHO FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663466329 1120981041 /nfs/dbraw/zinc/98/10/41/1120981041.db2.gz RAQGFPNTGVEPIY-FGTMMUONSA-N 1 3 296.474 3.616 20 0 CHADHO C[C@@H]1Cc2ccccc2[C@H]1NC[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663467305 1120981461 /nfs/dbraw/zinc/98/14/61/1120981461.db2.gz DTSHZNQNHRDYSR-MDYRTPRTSA-N 1 3 298.474 3.632 20 0 CHADHO C[C@@H]1Cc2ccccc2[C@H]1NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663467305 1120981465 /nfs/dbraw/zinc/98/14/65/1120981465.db2.gz DTSHZNQNHRDYSR-MDYRTPRTSA-N 1 3 298.474 3.632 20 0 CHADHO C[C@@H]1Cc2ccccc2[C@H]1[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663467305 1120981468 /nfs/dbraw/zinc/98/14/68/1120981468.db2.gz DTSHZNQNHRDYSR-MDYRTPRTSA-N 1 3 298.474 3.632 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2NC[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663469087 1120983003 /nfs/dbraw/zinc/98/30/03/1120983003.db2.gz OEDLXFBKCQHKSW-XLIONFOSSA-N 1 3 298.474 3.776 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663469087 1120983004 /nfs/dbraw/zinc/98/30/04/1120983004.db2.gz OEDLXFBKCQHKSW-XLIONFOSSA-N 1 3 298.474 3.776 20 0 CHADHO Cc1oc2ccccc2c1CCN[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000344134126 1121098504 /nfs/dbraw/zinc/09/85/04/1121098504.db2.gz OUCLHONSGGSAJC-HOTGVXAUSA-N 1 3 298.430 3.500 20 0 CHADHO Cc1oc2ccccc2c1CCN[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000344134126 1121098514 /nfs/dbraw/zinc/09/85/14/1121098514.db2.gz OUCLHONSGGSAJC-HOTGVXAUSA-N 1 3 298.430 3.500 20 0 CHADHO CC[C@@H](NC[C@@H](C)C[NH+]1CCCC1)c1ccc(C)cc1 ZINC000062077489 1121186238 /nfs/dbraw/zinc/18/62/38/1121186238.db2.gz XNEAWNACSAJWIV-SJLPKXTDSA-N 1 3 274.452 3.768 20 0 CHADHO [NH3+][C@@H]1C[C@@H](N[C@@H]2CCSC3(CCC3)C2)c2ccccc21 ZINC000925857786 1121292954 /nfs/dbraw/zinc/29/29/54/1121292954.db2.gz IOSDUSWETHWPNJ-DAXOMENPSA-N 1 3 288.460 3.539 20 0 CHADHO CC[C@H](CN[C@H]1C[C@@H](C)c2ccccc21)[NH+]1CCCC1 ZINC000675642526 1121331485 /nfs/dbraw/zinc/33/14/85/1121331485.db2.gz PJNXTRHCIBXHDB-RKVPGOIHSA-N 1 3 272.436 3.699 20 0 CHADHO C[C@@H]1C[C@@H]1C[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000512642954 1121505035 /nfs/dbraw/zinc/50/50/35/1121505035.db2.gz UNTLLEZRMNUHEZ-RACLHMPKSA-N 1 3 298.474 3.533 20 0 CHADHO C[C@@H]1CCC[C@@H]([NH+]2CCC(N[C@@H]3CC34CCCC4)CC2)C1 ZINC000429425724 1121577571 /nfs/dbraw/zinc/57/75/71/1121577571.db2.gz LRRIZCCKVPJBNZ-KBAYOESNSA-N 1 3 290.495 3.952 20 0 CHADHO CC[N@@H+]1CCC[C@@H]1CNCc1cccc(-c2ccccc2)c1 ZINC000614325613 1121642292 /nfs/dbraw/zinc/64/22/92/1121642292.db2.gz WTEUNAFDCFJUAT-HXUWFJFHSA-N 1 3 294.442 3.928 20 0 CHADHO CC[N@H+]1CCC[C@@H]1CNCc1cccc(-c2ccccc2)c1 ZINC000614325613 1121642296 /nfs/dbraw/zinc/64/22/96/1121642296.db2.gz WTEUNAFDCFJUAT-HXUWFJFHSA-N 1 3 294.442 3.928 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN(C[C@@H](C)c2ccc(C)cc2)C1 ZINC001179855701 1121915976 /nfs/dbraw/zinc/91/59/76/1121915976.db2.gz ZXNCDWKHERAEGS-MSOLQXFVSA-N 1 3 288.479 3.762 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN(C[C@@H](C)c2ccc(C)cc2)C1 ZINC001179855701 1121915979 /nfs/dbraw/zinc/91/59/79/1121915979.db2.gz ZXNCDWKHERAEGS-MSOLQXFVSA-N 1 3 288.479 3.762 20 0 CHADHO CC(C)(F)C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000631660345 1129018210 /nfs/dbraw/zinc/01/82/10/1129018210.db2.gz VKWOSDIKEXTRFQ-BJWYYQGGSA-N 1 3 290.426 3.520 20 0 CHADHO C[C@H](Cc1ccc(F)cc1)[NH2+]CC[C@@H](C)N1CCCCC1 ZINC001180809128 1122018361 /nfs/dbraw/zinc/01/83/61/1122018361.db2.gz ARZAVLJDNFDUOO-HZPDHXFCSA-N 1 3 292.442 3.611 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+]Cc2cccc(C3CC3)c2)C1 ZINC000421367270 1122102534 /nfs/dbraw/zinc/10/25/34/1122102534.db2.gz SKUXMCOIZWMLRT-ZWKOTPCHSA-N 1 3 272.436 3.526 20 0 CHADHO c1ccc([C@H]2C[C@H]2C[NH2+]C2CCN(C3CCCC3)CC2)cc1 ZINC000502983288 1122161233 /nfs/dbraw/zinc/16/12/33/1122161233.db2.gz AVTKGJNEYDMLCU-FXAWDEMLSA-N 1 3 298.474 3.787 20 0 CHADHO CCC[C@@H](CCc1ccccc1)[NH2+]CC[C@@H](C)N(C)C ZINC001183105145 1122206946 /nfs/dbraw/zinc/20/69/46/1122206946.db2.gz ZEPIVJITDKOWFR-AEFFLSMTSA-N 1 3 276.468 3.718 20 0 CHADHO CC[C@@H]1CCC[C@@H]([NH2+][C@H](C)CCN(CC)CC)C1 ZINC001184418009 1122275397 /nfs/dbraw/zinc/27/53/97/1122275397.db2.gz JSXNDBVGUVCWED-BZUAXINKSA-N 1 3 254.462 3.665 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+]C[C@H]1C(C)=CCC[C@@H]1C ZINC001184418063 1122275939 /nfs/dbraw/zinc/27/59/39/1122275939.db2.gz KJIUUZUBFWHYAA-ULQDDVLXSA-N 1 3 266.473 3.689 20 0 CHADHO CSc1ccc([C@@H](C)NCc2ccc3c(c2)C[NH2+]C3)cc1 ZINC000423375852 1122287675 /nfs/dbraw/zinc/28/76/75/1122287675.db2.gz IXNAZISGVHJVOU-CYBMUJFWSA-N 1 3 298.455 3.863 20 0 CHADHO CC[C@H]([NH2+]CC[C@@H]1CCCCN1C)c1ccccc1OC ZINC000775077161 1122418094 /nfs/dbraw/zinc/41/80/94/1122418094.db2.gz KIRIHQRCAJANIJ-RDJZCZTQSA-N 1 3 290.451 3.610 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000436285496 1122530637 /nfs/dbraw/zinc/53/06/37/1122530637.db2.gz PVZDDYRWWAQGSV-BHIYHBOVSA-N 1 3 286.463 3.644 20 0 CHADHO CC[C@H](C)[C@H](C)[N@@H+]1CCC[C@H](CN2CCC(C)CC2)C1 ZINC001190652316 1122550661 /nfs/dbraw/zinc/55/06/61/1122550661.db2.gz ZOHACQNJSADUPV-OKZBNKHCSA-N 1 3 280.500 3.865 20 0 CHADHO CC[C@H](C)[C@H](C)[N@H+]1CCC[C@H](CN2CCC(C)CC2)C1 ZINC001190652316 1122550665 /nfs/dbraw/zinc/55/06/65/1122550665.db2.gz ZOHACQNJSADUPV-OKZBNKHCSA-N 1 3 280.500 3.865 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H]([NH2+]CCCN2CCCC2)C1 ZINC000437776270 1122655508 /nfs/dbraw/zinc/65/55/08/1122655508.db2.gz OYFUNVWVKMMFHO-OALUTQOASA-N 1 3 286.463 3.572 20 0 CHADHO CCCCOc1ccc([C@@H](C)[NH2+]C[C@H](C)CN(C)C)cc1 ZINC000425933766 1122663154 /nfs/dbraw/zinc/66/31/54/1122663154.db2.gz WRAGBAJVHMGVSA-JKSUJKDBSA-N 1 3 292.467 3.714 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)CCc1ccc(Cl)s1)CN(C)C ZINC000425947111 1122675367 /nfs/dbraw/zinc/67/53/67/1122675367.db2.gz ZHZDJWZZFBHIFA-RYUDHWBXSA-N 1 3 288.888 3.510 20 0 CHADHO Cc1ccc2cc([C@H](C)NCC3=CC[N@H+](C)CC3)oc2c1 ZINC000426061616 1122710559 /nfs/dbraw/zinc/71/05/59/1122710559.db2.gz KTFQWMLZSFJONH-AWEZNQCLSA-N 1 3 284.403 3.654 20 0 CHADHO Cc1ccc2cc([C@H](C)NCC3=CC[N@@H+](C)CC3)oc2c1 ZINC000426061616 1122710562 /nfs/dbraw/zinc/71/05/62/1122710562.db2.gz KTFQWMLZSFJONH-AWEZNQCLSA-N 1 3 284.403 3.654 20 0 CHADHO C[N@@H+]1CC[C@]2(C1)CCCN(Cc1cccc3ccccc31)C2 ZINC001194504857 1122780890 /nfs/dbraw/zinc/78/08/90/1122780890.db2.gz GGSSMZGIGDUJGN-FQEVSTJZSA-N 1 3 294.442 3.758 20 0 CHADHO C[N@H+]1CC[C@]2(C1)CCCN(Cc1cccc3ccccc31)C2 ZINC001194504857 1122780894 /nfs/dbraw/zinc/78/08/94/1122780894.db2.gz GGSSMZGIGDUJGN-FQEVSTJZSA-N 1 3 294.442 3.758 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCC(C)CC1)c1cc2ccccc2[nH]1 ZINC000775623096 1122827318 /nfs/dbraw/zinc/82/73/18/1122827318.db2.gz MBTSISTXFBCRKF-MRXNPFEDSA-N 1 3 299.462 3.941 20 0 CHADHO C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1)C1CCCC1 ZINC001167967083 1122845113 /nfs/dbraw/zinc/84/51/13/1122845113.db2.gz AVKAIDZKWONDKI-TZUVLKIQSA-N 1 3 276.468 3.560 20 0 CHADHO CCC1CC[NH+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001167985079 1122945435 /nfs/dbraw/zinc/94/54/35/1122945435.db2.gz VAQDFJCMYYQURB-JWTNVVGKSA-N 1 3 276.468 3.514 20 0 CHADHO c1cc(C[NH2+]C[C@H]2CCN(C3CC3)C2)cc(C2CCCC2)c1 ZINC001199198803 1123023357 /nfs/dbraw/zinc/02/33/57/1123023357.db2.gz TWKKOROFPBIWEF-QGZVFWFLSA-N 1 3 298.474 3.918 20 0 CHADHO C[C@H]([NH2+][C@@H](C)[C@H]1CCN(Cc2ccccc2)C1)c1ccoc1 ZINC000309915811 1129094925 /nfs/dbraw/zinc/09/49/25/1129094925.db2.gz OCBDZMTUQPHYNQ-BQFCYCMXSA-N 1 3 298.430 3.841 20 0 CHADHO C[C@H]1[C@H](C[NH3+])CCCN1Cc1cccc(C(C)(C)C)c1 ZINC001205912781 1123075558 /nfs/dbraw/zinc/07/55/58/1123075558.db2.gz CFTJHIMOPZXRKY-HOCLYGCPSA-N 1 3 274.452 3.543 20 0 CHADHO Cc1cccc(C)c1C[N@@H+](C)CC[C@@H]1CCCCN1C ZINC000441371333 1123082760 /nfs/dbraw/zinc/08/27/60/1123082760.db2.gz TVLZOJRLJIDNKJ-KRWDZBQOSA-N 1 3 274.452 3.610 20 0 CHADHO Cc1cccc(C)c1C[N@H+](C)CC[C@@H]1CCCCN1C ZINC000441371333 1123082765 /nfs/dbraw/zinc/08/27/65/1123082765.db2.gz TVLZOJRLJIDNKJ-KRWDZBQOSA-N 1 3 274.452 3.610 20 0 CHADHO CCC[C@H](C)C[N@@H+]1CCCC[C@@H]1C[C@@H]1CCCN1C ZINC001201552089 1123119040 /nfs/dbraw/zinc/11/90/40/1123119040.db2.gz JHHGDKFQBZZRMM-YESZJQIVSA-N 1 3 266.473 3.761 20 0 CHADHO C[C@@H](C[NH2+]C1C[C@H](C)C[C@@H](C)C1)CN1CCCCC1 ZINC000219618728 1123153424 /nfs/dbraw/zinc/15/34/24/1123153424.db2.gz MTBHSBFWTYXUQG-OAGGEKHMSA-N 1 3 266.473 3.523 20 0 CHADHO CCCN1CCC([N@H+](C)Cc2ccc(Cl)c(C)c2)CC1 ZINC000507813506 1123220482 /nfs/dbraw/zinc/22/04/82/1123220482.db2.gz PBTGJHMGWHLAOI-UHFFFAOYSA-N 1 3 294.870 3.955 20 0 CHADHO CCCN1CCC([N@@H+](C)Cc2ccc(Cl)c(C)c2)CC1 ZINC000507813506 1123220486 /nfs/dbraw/zinc/22/04/86/1123220486.db2.gz PBTGJHMGWHLAOI-UHFFFAOYSA-N 1 3 294.870 3.955 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCc1ccc(-c2cccs2)cc1 ZINC000665237535 1123238214 /nfs/dbraw/zinc/23/82/14/1123238214.db2.gz CUPFHCGOPZJVPC-QWHCGFSZSA-N 1 3 274.433 3.631 20 0 CHADHO Cc1ccc(CCN[C@H]2C[C@H]([NH3+])c3ccccc32)cc1C ZINC000665245283 1123251946 /nfs/dbraw/zinc/25/19/46/1123251946.db2.gz DJZLGFCVOVPHDN-OALUTQOASA-N 1 3 280.415 3.580 20 0 CHADHO CCSc1ccccc1[C@H](C)[NH2+]C[C@H]1CCN(CC)C1 ZINC000163250429 1129109622 /nfs/dbraw/zinc/10/96/22/1129109622.db2.gz AWYOBQLHXUPCPR-LSDHHAIUSA-N 1 3 292.492 3.791 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@H](C)c1cc2ccccc2s1 ZINC000665281970 1123313276 /nfs/dbraw/zinc/31/32/76/1123313276.db2.gz NOTXFVQQWCTDHG-TZMCWYRMSA-N 1 3 276.449 3.925 20 0 CHADHO Cc1cccc2c1[C@@H](C)C[C@H]2NCC[C@@H]([NH3+])C(C)C ZINC000665280667 1123313649 /nfs/dbraw/zinc/31/36/49/1123313649.db2.gz INWJGWNQCAJPJX-NUEKZKHPSA-N 1 3 260.425 3.506 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@H]1CCCc2c3ccccc3[nH]c21 ZINC000665282297 1123314865 /nfs/dbraw/zinc/31/48/65/1123314865.db2.gz VKCFFEBDGMOPCX-WBVHZDCISA-N 1 3 285.435 3.508 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]C2CCC(C(F)F)CC2)C1 ZINC000442782333 1123338144 /nfs/dbraw/zinc/33/81/44/1123338144.db2.gz PSQCGLONXGKBCW-WLYUNCDWSA-N 1 3 288.426 3.520 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1NCc1ccc2ccccc2c1 ZINC000157307686 1129126755 /nfs/dbraw/zinc/12/67/55/1129126755.db2.gz DDKLNRFRMRWSHR-SPYBWZPUSA-N 1 3 282.431 3.658 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1NCc1ccc2ccccc2c1 ZINC000157307686 1129126757 /nfs/dbraw/zinc/12/67/57/1129126757.db2.gz DDKLNRFRMRWSHR-SPYBWZPUSA-N 1 3 282.431 3.658 20 0 CHADHO CCCC[C@@H](CC)C[N@@H+]1CCC[C@H](N(C)C)CC1 ZINC000429524782 1123537989 /nfs/dbraw/zinc/53/79/89/1123537989.db2.gz AYNAHWMKXDBQGS-CVEARBPZSA-N 1 3 254.462 3.619 20 0 CHADHO CCCC[C@@H](CC)C[N@H+]1CCC[C@H](N(C)C)CC1 ZINC000429524782 1123537993 /nfs/dbraw/zinc/53/79/93/1123537993.db2.gz AYNAHWMKXDBQGS-CVEARBPZSA-N 1 3 254.462 3.619 20 0 CHADHO C[C@H]1CCN1[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168038975 1123559527 /nfs/dbraw/zinc/55/95/27/1123559527.db2.gz AQGNHSLKJBKQKB-CUSZFKRNSA-N 1 3 272.436 3.522 20 0 CHADHO C[C@H]1CCN1[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168038975 1123559532 /nfs/dbraw/zinc/55/95/32/1123559532.db2.gz AQGNHSLKJBKQKB-CUSZFKRNSA-N 1 3 272.436 3.522 20 0 CHADHO C[C@@H]1C[C@H](C[NH3+])CN1Cc1ccc(-c2ccccc2)s1 ZINC000469850690 1123657729 /nfs/dbraw/zinc/65/77/29/1123657729.db2.gz WNONLEOTHLBTMS-ZIAGYGMSSA-N 1 3 286.444 3.584 20 0 CHADHO CC(C)[C@H]([NH2+]CC[C@H](C)N1CCCCC1)c1cccnc1 ZINC000346855164 1123727377 /nfs/dbraw/zinc/72/73/77/1123727377.db2.gz CTCMVWWXABLMTO-WMZOPIPTSA-N 1 3 289.467 3.633 20 0 CHADHO C[C@@H](CC[NH2+][C@H]1CCCc2sccc21)N1CCCCC1 ZINC000346876267 1123728689 /nfs/dbraw/zinc/72/86/89/1123728689.db2.gz JQNPUHWXVALQHM-HOCLYGCPSA-N 1 3 292.492 3.980 20 0 CHADHO Cc1cccc([C@H](C)[NH2+]CCCN2CCC(C)CC2)c1 ZINC000037233703 1123766698 /nfs/dbraw/zinc/76/66/98/1123766698.db2.gz VKFLDESIVKIZLD-KRWDZBQOSA-N 1 3 274.452 3.768 20 0 CHADHO CCC(CC)(CN[C@H]1CC[N@@H+]2CCC[C@H]2C1)C(F)(F)F ZINC000865756297 1124011045 /nfs/dbraw/zinc/01/10/45/1124011045.db2.gz IYDDWGMDCFWNHQ-STQMWFEESA-N 1 3 292.389 3.572 20 0 CHADHO CCC(CC)(CN[C@H]1CC[N@H+]2CCC[C@H]2C1)C(F)(F)F ZINC000865756297 1124011050 /nfs/dbraw/zinc/01/10/50/1124011050.db2.gz IYDDWGMDCFWNHQ-STQMWFEESA-N 1 3 292.389 3.572 20 0 CHADHO Clc1ccc(C2([NH2+]CCCN3CCCCC3)CC2)cc1 ZINC000444613124 1124044811 /nfs/dbraw/zinc/04/48/11/1124044811.db2.gz UZIBTGUSVIXWSJ-UHFFFAOYSA-N 1 3 292.854 3.795 20 0 CHADHO CCc1ccc(C[N@H+](C)CC[C@@H]2CCCCN2C)cc1 ZINC000525271862 1124119413 /nfs/dbraw/zinc/11/94/13/1124119413.db2.gz HLMCGBYVPXHXAP-SFHVURJKSA-N 1 3 274.452 3.555 20 0 CHADHO CCc1ccc(C[N@@H+](C)CC[C@@H]2CCCCN2C)cc1 ZINC000525271862 1124119415 /nfs/dbraw/zinc/11/94/15/1124119415.db2.gz HLMCGBYVPXHXAP-SFHVURJKSA-N 1 3 274.452 3.555 20 0 CHADHO CC[C@@H](N[C@H]1CC[NH2+]CC(C)(C)C1)c1ccc(OC)cc1 ZINC000635012181 1129170466 /nfs/dbraw/zinc/17/04/66/1129170466.db2.gz RPNMNCHFUUZRLP-DOTOQJQBSA-N 1 3 290.451 3.514 20 0 CHADHO CCCN1CC[C@@H](C[NH2+]C2CCC(C(C)(C)C)CC2)C1 ZINC000525703534 1124458044 /nfs/dbraw/zinc/45/80/44/1124458044.db2.gz VSVIPIYWWXLIND-GTPINHCMSA-N 1 3 280.500 3.913 20 0 CHADHO C[C@@H]1CCC[C@H]([NH2+]CCCN2C[C@H](C)C[C@@H](C)C2)C1 ZINC000525694079 1124458427 /nfs/dbraw/zinc/45/84/27/1124458427.db2.gz LXOKJVAZKYQPBO-VQHPVUNQSA-N 1 3 266.473 3.523 20 0 CHADHO CCC[NH+]1CCC(CN[C@@H](C)c2cccnc2Cl)CC1 ZINC000122695136 1124525010 /nfs/dbraw/zinc/52/50/10/1124525010.db2.gz RIXJQBHPQYYLJW-ZDUSSCGKSA-N 1 3 295.858 3.508 20 0 CHADHO CC(C)CCC[NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000527354875 1124571014 /nfs/dbraw/zinc/57/10/14/1124571014.db2.gz BXCVHYBFSCWJIB-HZPDHXFCSA-N 1 3 266.473 3.665 20 0 CHADHO CC[N@@H+]1CC[C@H](N[C@H]2CCCc3c(F)cccc32)[C@H](C)C1 ZINC000449349854 1124697096 /nfs/dbraw/zinc/69/70/96/1124697096.db2.gz KNFVJMGQBVFWHY-BVGQSLNGSA-N 1 3 290.426 3.523 20 0 CHADHO CC[N@H+]1CC[C@H](N[C@H]2CCCc3c(F)cccc32)[C@H](C)C1 ZINC000449349854 1124697098 /nfs/dbraw/zinc/69/70/98/1124697098.db2.gz KNFVJMGQBVFWHY-BVGQSLNGSA-N 1 3 290.426 3.523 20 0 CHADHO C[C@@H]1CCCC[C@H]1[NH+]1CCC(NC2CC(C)(F)C2)CC1 ZINC000449374634 1124703891 /nfs/dbraw/zinc/70/38/91/1124703891.db2.gz BGVNNBARESHDKW-CRYBEJKASA-N 1 3 282.447 3.510 20 0 CHADHO Cc1ccc(C2(CN[C@H]3CC[N@@H+]4CCC[C@H]4C3)CC2)c(C)c1 ZINC000449378328 1124715520 /nfs/dbraw/zinc/71/55/20/1124715520.db2.gz QYYAWXDSAXUXHK-ROUUACIJSA-N 1 3 298.474 3.551 20 0 CHADHO Cc1ccc(C2(CN[C@H]3CC[N@H+]4CCC[C@H]4C3)CC2)c(C)c1 ZINC000449378328 1124715531 /nfs/dbraw/zinc/71/55/31/1124715531.db2.gz QYYAWXDSAXUXHK-ROUUACIJSA-N 1 3 298.474 3.551 20 0 CHADHO Cc1ccc(C2(CN[C@@H]3CC[N@@H+]4CCC[C@@H]4C3)CC2)c(C)c1 ZINC000449378327 1124716031 /nfs/dbraw/zinc/71/60/31/1124716031.db2.gz QYYAWXDSAXUXHK-QZTJIDSGSA-N 1 3 298.474 3.551 20 0 CHADHO Cc1ccc(C2(CN[C@@H]3CC[N@H+]4CCC[C@@H]4C3)CC2)c(C)c1 ZINC000449378327 1124716037 /nfs/dbraw/zinc/71/60/37/1124716037.db2.gz QYYAWXDSAXUXHK-QZTJIDSGSA-N 1 3 298.474 3.551 20 0 CHADHO CCc1ccc2nccc(N3CCC(C[NH+](C)C)CC3)c2c1 ZINC000450261050 1124962324 /nfs/dbraw/zinc/96/23/24/1124962324.db2.gz MCDDPRWABDFJPN-UHFFFAOYSA-N 1 3 297.446 3.575 20 0 CHADHO C(=C/c1ccccc1)\CCN1CC[C@H](C[NH+]2CCCC2)C1 ZINC000450429945 1125022219 /nfs/dbraw/zinc/02/22/19/1125022219.db2.gz OGFXQAUBXCEISO-OFCRBKOVSA-N 1 3 284.447 3.508 20 0 CHADHO CC(C)(C)c1ccc(CNC2CC[NH+](C3CC3)CC2)cc1 ZINC000035054349 1125301823 /nfs/dbraw/zinc/30/18/23/1125301823.db2.gz DXEOUOQXKGFATN-UHFFFAOYSA-N 1 3 286.463 3.701 20 0 CHADHO CSc1ccc(CNCCC2CC[NH+](C(C)C)CC2)o1 ZINC000883194791 1125376736 /nfs/dbraw/zinc/37/67/36/1125376736.db2.gz CUDWIDWUIBBMRD-UHFFFAOYSA-N 1 3 296.480 3.602 20 0 CHADHO C[NH2+]C[C@H]1CCCN([C@@H](C)c2c(C)cc(C)cc2C)C1 ZINC000040592956 1125388896 /nfs/dbraw/zinc/38/88/96/1125388896.db2.gz HGZNRVQOEGSORY-DLBZAZTESA-N 1 3 274.452 3.604 20 0 CHADHO CCCC1CCC([NH2+]C[C@H]2CCN(C(C)C)C2)CC1 ZINC000040622260 1125389116 /nfs/dbraw/zinc/38/91/16/1125389116.db2.gz NRMRCCBXMMZXAO-AQFXKWCLSA-N 1 3 266.473 3.665 20 0 CHADHO Cc1cccc([C@@H]2CCCN2CC[C@@H]2CCCC[NH2+]2)c1 ZINC001204849265 1125432564 /nfs/dbraw/zinc/43/25/64/1125432564.db2.gz ZAXJDYUCZQGDQI-ROUUACIJSA-N 1 3 272.436 3.664 20 0 CHADHO C[C@H]([NH2+]C(C)(C)CN[C@@H](C)[C@@H]1CC1(F)F)c1ccccc1 ZINC000638602033 1129263714 /nfs/dbraw/zinc/26/37/14/1129263714.db2.gz RHUUALXEPORNPT-YDHLFZDLSA-N 1 3 296.405 3.749 20 0 CHADHO Cc1cc(C)cc(-c2ccccc2CN2CCC([NH3+])CC2)c1 ZINC001239526398 1131365586 /nfs/dbraw/zinc/36/55/86/1131365586.db2.gz UGRBBVYIAMZVKF-UHFFFAOYSA-N 1 3 294.442 3.894 20 0 CHADHO CC[NH+](CC)CC1CCN(Cc2ccc(Cl)cc2)CC1 ZINC000642643613 1129422990 /nfs/dbraw/zinc/42/29/90/1129422990.db2.gz GONFMFCFAJRIBC-UHFFFAOYSA-N 1 3 294.870 3.894 20 0 CHADHO COc1ccc2cc([C@@H](C)N[C@@H]3CCC[NH2+]CC3)ccc2c1 ZINC000643521353 1129443845 /nfs/dbraw/zinc/44/38/45/1129443845.db2.gz AKHAMVZCMHAVNO-RDTXWAMCSA-N 1 3 298.430 3.641 20 0 CHADHO Clc1ccc2c(c1)[C@H](N[C@@H]1CCC[NH2+]CC1)CCCC2 ZINC000643522686 1129444582 /nfs/dbraw/zinc/44/45/82/1129444582.db2.gz RVDDNDWAKJORPK-NVXWUHKLSA-N 1 3 292.854 3.839 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCNC2(CCC2)C1)C1CCCCCC1 ZINC000643547453 1129445634 /nfs/dbraw/zinc/44/56/34/1129445634.db2.gz FSQJKSPFZKHXTH-GOEBONIOSA-N 1 3 264.457 3.610 20 0 CHADHO CC(C)C1([NH2+]C2CCN([C@H]3CCCC[C@@H]3C)CC2)CC1 ZINC000645494366 1129500043 /nfs/dbraw/zinc/50/00/43/1129500043.db2.gz HXXUGWLZKVHJAC-RDJZCZTQSA-N 1 3 278.484 3.808 20 0 CHADHO [NH3+]C[C@@H]1CCN(Cc2ccc(C3CCCCC3)cc2)C1 ZINC000647829724 1129585635 /nfs/dbraw/zinc/58/56/35/1129585635.db2.gz QXHKLSSFRPVFLD-INIZCTEOSA-N 1 3 272.436 3.515 20 0 CHADHO C[C@H](c1cc(F)ccc1F)N(C)CCCC1CC[NH2+]CC1 ZINC000647875686 1129587334 /nfs/dbraw/zinc/58/73/34/1129587334.db2.gz HTEGNRFRWGJWOT-CYBMUJFWSA-N 1 3 296.405 3.737 20 0 CHADHO CC(C)C[C@@H](Cc1ccccc1)[NH2+]CC[C@H]1CCCN1C ZINC001169058172 1129693808 /nfs/dbraw/zinc/69/38/08/1129693808.db2.gz DIIPOHIJPVOJEQ-RBUKOAKNSA-N 1 3 288.479 3.718 20 0 CHADHO CN1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccc3sccc3c1)C2 ZINC001169099146 1129696428 /nfs/dbraw/zinc/69/64/28/1129696428.db2.gz OCZJEEDFIJSCSJ-PHZGNYQRSA-N 1 3 286.444 3.616 20 0 CHADHO CC(C)=CCC/C(C)=C/C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)N2C ZINC001169100660 1129697678 /nfs/dbraw/zinc/69/76/78/1129697678.db2.gz KYEUYQCXJSFYLA-DCFXCVOLSA-N 1 3 276.468 3.894 20 0 CHADHO CC(C)=CCC/C(C)=C/CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169100660 1129697679 /nfs/dbraw/zinc/69/76/79/1129697679.db2.gz KYEUYQCXJSFYLA-DCFXCVOLSA-N 1 3 276.468 3.894 20 0 CHADHO CC(C)=CCC/C(C)=C/CN[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169100660 1129697681 /nfs/dbraw/zinc/69/76/81/1129697681.db2.gz KYEUYQCXJSFYLA-DCFXCVOLSA-N 1 3 276.468 3.894 20 0 CHADHO CS[C@@H]1CC[C@@H]1NC1CC[NH+](CC2CCCCC2)CC1 ZINC000766601975 1129701496 /nfs/dbraw/zinc/70/14/96/1129701496.db2.gz KPKVYVABESTBAW-DLBZAZTESA-N 1 3 296.524 3.515 20 0 CHADHO CS[C@@H]1CC[C@@H]1[NH2+]C1CCN(CC2CCCCC2)CC1 ZINC000766601975 1129701497 /nfs/dbraw/zinc/70/14/97/1129701497.db2.gz KPKVYVABESTBAW-DLBZAZTESA-N 1 3 296.524 3.515 20 0 CHADHO CC[NH+]1CCC(N[C@H](CC(C)C)c2ccc(F)cc2)CC1 ZINC001169229856 1129710540 /nfs/dbraw/zinc/71/05/40/1129710540.db2.gz HJALNXRWVBMBDI-GOSISDBHSA-N 1 3 292.442 3.987 20 0 CHADHO CCCCc1ccc(CNC2CC[NH+](CC)CC2)cc1 ZINC001169224662 1129710578 /nfs/dbraw/zinc/71/05/78/1129710578.db2.gz JKUGYPYSLRJMMJ-UHFFFAOYSA-N 1 3 274.452 3.603 20 0 CHADHO CC[NH+]1CCC(N[C@@H](CC2CC2)c2ccc(F)cc2)CC1 ZINC001169240436 1129712515 /nfs/dbraw/zinc/71/25/15/1129712515.db2.gz IJTNPLXTABVRKF-SFHVURJKSA-N 1 3 290.426 3.741 20 0 CHADHO CC(C)[C@H](NCc1ccc(C[NH3+])cc1F)c1ccccc1 ZINC000650753644 1129721595 /nfs/dbraw/zinc/72/15/95/1129721595.db2.gz RZGRIBOEDZJEJW-SFHVURJKSA-N 1 3 286.394 3.771 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@H](C)c1ccc(F)c(F)c1 ZINC000650758513 1129722118 /nfs/dbraw/zinc/72/21/18/1129722118.db2.gz RBTPGAIOMLYUDC-GFCCVEGCSA-N 1 3 290.357 3.535 20 0 CHADHO CC[N@@H+]1CC[C@@H](NCc2cccc3ccsc32)[C@H](C)C1 ZINC000651863664 1129750022 /nfs/dbraw/zinc/75/00/22/1129750022.db2.gz SKNVMJWBSZJXLW-CZUORRHYSA-N 1 3 288.460 3.721 20 0 CHADHO CC[N@H+]1CC[C@@H](NCc2cccc3ccsc32)[C@H](C)C1 ZINC000651863664 1129750025 /nfs/dbraw/zinc/75/00/25/1129750025.db2.gz SKNVMJWBSZJXLW-CZUORRHYSA-N 1 3 288.460 3.721 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N1CCCC(F)(F)[C@@H](F)C1 ZINC001258908249 1129845850 /nfs/dbraw/zinc/84/58/50/1129845850.db2.gz UANVWSBSUSGFOG-KBPBESRZSA-N 1 3 294.405 3.566 20 0 CHADHO CCCC[C@H](CC)COCCC[NH2+][C@@H]1CCN[C@@H](CC)C1 ZINC001246215027 1131403942 /nfs/dbraw/zinc/40/39/42/1131403942.db2.gz HUVYOVDOWGTARX-OKZBNKHCSA-N 1 3 298.515 3.730 20 0 CHADHO C[C@@H]1[C@@H]([NH+]2CCCC2)CCN1CC1CCC2(CC2)CC1 ZINC001170039622 1130008111 /nfs/dbraw/zinc/00/81/11/1130008111.db2.gz ONOAMIUTQDJSRZ-WBVHZDCISA-N 1 3 276.468 3.515 20 0 CHADHO C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@H]2C1)[C@H]1CCCN(C2CCC2)C1 ZINC000902948927 1130089499 /nfs/dbraw/zinc/08/94/99/1130089499.db2.gz YNPBXHZCXUDIMF-JCECYMMASA-N 1 3 290.495 3.808 20 0 CHADHO Cc1ccc(CCNC2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC2)c(C)c1 ZINC000903079293 1130109548 /nfs/dbraw/zinc/10/95/48/1130109548.db2.gz LJPPNZRFPUMKLY-CTXDPNEZSA-N 1 3 298.474 3.593 20 0 CHADHO Cc1ccc(CCNC2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)c(C)c1 ZINC000903079293 1130109551 /nfs/dbraw/zinc/10/95/51/1130109551.db2.gz LJPPNZRFPUMKLY-CTXDPNEZSA-N 1 3 298.474 3.593 20 0 CHADHO Cc1ccc(CN2CCCC[C@@H]2C[C@@H]2CCC[N@H+]2C)s1 ZINC001204033534 1130207240 /nfs/dbraw/zinc/20/72/40/1130207240.db2.gz FTUUJSPYOYPDNC-JKSUJKDBSA-N 1 3 292.492 3.895 20 0 CHADHO Cc1ccc(CN2CCCC[C@@H]2C[C@@H]2CCC[N@@H+]2C)s1 ZINC001204033534 1130207245 /nfs/dbraw/zinc/20/72/45/1130207245.db2.gz FTUUJSPYOYPDNC-JKSUJKDBSA-N 1 3 292.492 3.895 20 0 CHADHO Cc1ccc(C[N@H+]2CCCC[C@@H]2C[C@@H]2CCCN2C)s1 ZINC001204033534 1130207248 /nfs/dbraw/zinc/20/72/48/1130207248.db2.gz FTUUJSPYOYPDNC-JKSUJKDBSA-N 1 3 292.492 3.895 20 0 CHADHO Cc1ccc(C[N@@H+]2CCCC[C@@H]2C[C@@H]2CCCN2C)s1 ZINC001204033534 1130207254 /nfs/dbraw/zinc/20/72/54/1130207254.db2.gz FTUUJSPYOYPDNC-JKSUJKDBSA-N 1 3 292.492 3.895 20 0 CHADHO CCN(C)C1CC[NH+]([C@H](C)CCCC(C)C)CC1 ZINC001170090684 1130213425 /nfs/dbraw/zinc/21/34/25/1130213425.db2.gz NKDPDKOJNHXNDJ-OAHLLOKOSA-N 1 3 254.462 3.617 20 0 CHADHO CC[C@@H](NC[C@@H]([NH3+])CC(F)F)c1cccc2ccccc21 ZINC000903959999 1130213541 /nfs/dbraw/zinc/21/35/41/1130213541.db2.gz URDGGWKHLQTNFR-XJKSGUPXSA-N 1 3 292.373 3.863 20 0 CHADHO Cc1c(Cl)ccc(CN2CCC[C@H](C[NH3+])[C@H](C)C2)c1F ZINC001206036775 1130254261 /nfs/dbraw/zinc/25/42/61/1130254261.db2.gz PVYQVPFSPFEVNG-DGCLKSJQSA-N 1 3 298.833 3.594 20 0 CHADHO c1ccc2cc(CCN[C@@H]3CC[N@@H+]4CCC[C@@H]4C3)ccc2c1 ZINC000677237659 1130298155 /nfs/dbraw/zinc/29/81/55/1130298155.db2.gz MNCUIKFSQDPNGH-WOJBJXKFSA-N 1 3 294.442 3.599 20 0 CHADHO c1ccc2cc(CCN[C@@H]3CC[N@H+]4CCC[C@@H]4C3)ccc2c1 ZINC000677237659 1130298157 /nfs/dbraw/zinc/29/81/57/1130298157.db2.gz MNCUIKFSQDPNGH-WOJBJXKFSA-N 1 3 294.442 3.599 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2N[C@@H]1CC[N@H+](CC2CC2)C1 ZINC000678114370 1130350814 /nfs/dbraw/zinc/35/08/14/1130350814.db2.gz DNHIWLKOJDQTID-KYJSFNMBSA-N 1 3 284.447 3.617 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000678114370 1130350823 /nfs/dbraw/zinc/35/08/23/1130350823.db2.gz DNHIWLKOJDQTID-KYJSFNMBSA-N 1 3 284.447 3.617 20 0 CHADHO CC(C)c1ccc(CCN[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000678580367 1130430514 /nfs/dbraw/zinc/43/05/14/1130430514.db2.gz AAERCHQOVLGVDY-RTBURBONSA-N 1 3 286.463 3.569 20 0 CHADHO CC(C)c1ccc(CCN[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000678580367 1130430518 /nfs/dbraw/zinc/43/05/18/1130430518.db2.gz AAERCHQOVLGVDY-RTBURBONSA-N 1 3 286.463 3.569 20 0 CHADHO FC1(F)CC[C@H](NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000679071971 1130490943 /nfs/dbraw/zinc/49/09/43/1130490943.db2.gz NBDGIFLOQRLSQK-AWEZNQCLSA-N 1 3 286.410 3.561 20 0 CHADHO FC1(F)CC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000679071971 1130490945 /nfs/dbraw/zinc/49/09/45/1130490945.db2.gz NBDGIFLOQRLSQK-AWEZNQCLSA-N 1 3 286.410 3.561 20 0 CHADHO C[C@@H]([NH2+]CC1CCCCC1)[C@H]1CCCN(C2CCC2)C1 ZINC000679740032 1130554706 /nfs/dbraw/zinc/55/47/06/1130554706.db2.gz UALZJBJEAYUSSD-WBVHZDCISA-N 1 3 278.484 3.809 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2cccc3cnccc32)C[C@H]1C ZINC000679990319 1130568115 /nfs/dbraw/zinc/56/81/15/1130568115.db2.gz VEPYPQYFZSTHCC-CRAIPNDOSA-N 1 3 297.446 3.539 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2cccc3cnccc32)C[C@H]1C ZINC000679990319 1130568119 /nfs/dbraw/zinc/56/81/19/1130568119.db2.gz VEPYPQYFZSTHCC-CRAIPNDOSA-N 1 3 297.446 3.539 20 0 CHADHO CC(C)(CC[N@@H+]1CCCC12CCNCC2)c1ccccc1 ZINC001235139678 1130714413 /nfs/dbraw/zinc/71/44/13/1130714413.db2.gz CGNWONQHKGQYFE-UHFFFAOYSA-N 1 3 286.463 3.572 20 0 CHADHO CC(C)(CC[N@H+]1CCCC12CCNCC2)c1ccccc1 ZINC001235139678 1130714417 /nfs/dbraw/zinc/71/44/17/1130714417.db2.gz CGNWONQHKGQYFE-UHFFFAOYSA-N 1 3 286.463 3.572 20 0 CHADHO c1ccc(C2CC2)c(C[N@@H+]2CCCCC23CCNCC3)c1 ZINC001235189640 1130721154 /nfs/dbraw/zinc/72/11/54/1130721154.db2.gz OWGDSTSBCHFERR-UHFFFAOYSA-N 1 3 284.447 3.672 20 0 CHADHO c1ccc(C2CC2)c(C[N@H+]2CCCCC23CCNCC3)c1 ZINC001235189640 1130721159 /nfs/dbraw/zinc/72/11/59/1130721159.db2.gz OWGDSTSBCHFERR-UHFFFAOYSA-N 1 3 284.447 3.672 20 0 CHADHO c1ccc2c(c1)cccc2C[N@@H+]1CCCCC12CCNCC2 ZINC001235191402 1130723461 /nfs/dbraw/zinc/72/34/61/1130723461.db2.gz TUMIMFGPPBYTRZ-UHFFFAOYSA-N 1 3 294.442 3.948 20 0 CHADHO c1ccc2c(c1)cccc2C[N@H+]1CCCCC12CCNCC2 ZINC001235191402 1130723464 /nfs/dbraw/zinc/72/34/64/1130723464.db2.gz TUMIMFGPPBYTRZ-UHFFFAOYSA-N 1 3 294.442 3.948 20 0 CHADHO Clc1ccc(CN2CCC([C@H]3CCCC[NH2+]3)CC2)cc1 ZINC001235229288 1130724972 /nfs/dbraw/zinc/72/49/72/1130724972.db2.gz KVEMTHHBPWDPGO-QGZVFWFLSA-N 1 3 292.854 3.694 20 0 CHADHO Cc1ccc(-c2cccc(CN3C[C@@H]4C[C@H]3C[C@@H]4[NH3+])c2)cc1 ZINC001235254582 1130726876 /nfs/dbraw/zinc/72/68/76/1130726876.db2.gz KBPXRKIZCAIPPO-UFYCRDLUSA-N 1 3 292.426 3.584 20 0 CHADHO Cc1sc2ccccc2c1C[N@@H+]1C[C@H]2CCC[C@@]2(N)C1 ZINC001235246159 1130728431 /nfs/dbraw/zinc/72/84/31/1130728431.db2.gz VBGHOAAQUXFDGO-CXAGYDPISA-N 1 3 286.444 3.523 20 0 CHADHO Cc1sc2ccccc2c1C[N@H+]1C[C@H]2CCC[C@@]2(N)C1 ZINC001235246159 1130728434 /nfs/dbraw/zinc/72/84/34/1130728434.db2.gz VBGHOAAQUXFDGO-CXAGYDPISA-N 1 3 286.444 3.523 20 0 CHADHO [NH3+]C[C@H]1CCCN(Cc2ccc(C3CCCCC3)cc2)C1 ZINC001235676184 1130765494 /nfs/dbraw/zinc/76/54/94/1130765494.db2.gz NQKUJECLXFQWCF-QGZVFWFLSA-N 1 3 286.463 3.905 20 0 CHADHO Cc1c(Cl)ccc(CN(C)CCC2CC[NH2+]CC2)c1F ZINC001235717907 1130771164 /nfs/dbraw/zinc/77/11/64/1130771164.db2.gz PEWIDPVHSQTWDG-UHFFFAOYSA-N 1 3 298.833 3.609 20 0 CHADHO [NH3+]Cc1ccc(CN2CCC[C@H]2c2ccccc2F)cc1 ZINC001235718780 1130773095 /nfs/dbraw/zinc/77/30/95/1130773095.db2.gz NNRVQZLOAWQDMY-SFHVURJKSA-N 1 3 284.378 3.622 20 0 CHADHO [NH3+][C@H]1C[C@H]2CC[C@@H](C1)N2Cc1cccc(-c2ccccc2)c1 ZINC001235810802 1130782408 /nfs/dbraw/zinc/78/24/08/1130782408.db2.gz NWNBNDLBSDMXFG-ACDBMABISA-N 1 3 292.426 3.808 20 0 CHADHO C[C@H]1CC[C@@H](N)C[N@@H+]1Cc1cccc2c3ccccc3oc21 ZINC001235906826 1130803455 /nfs/dbraw/zinc/80/34/55/1130803455.db2.gz OVTLRNBVSYZYEZ-DZGCQCFKSA-N 1 3 294.398 3.898 20 0 CHADHO C[C@H]1CC[C@@H](N)C[N@H+]1Cc1cccc2c3ccccc3oc21 ZINC001235906826 1130803460 /nfs/dbraw/zinc/80/34/60/1130803460.db2.gz OVTLRNBVSYZYEZ-DZGCQCFKSA-N 1 3 294.398 3.898 20 0 CHADHO CC(C)c1ccc(C[C@H](C)C[N@@H+]2CCC[C@H]2CCN)cc1 ZINC001235925604 1130806576 /nfs/dbraw/zinc/80/65/76/1130806576.db2.gz XALPTXCISMRJLL-LPHOPBHVSA-N 1 3 288.479 3.802 20 0 CHADHO CC(C)c1ccc(C[C@H](C)C[N@H+]2CCC[C@H]2CCN)cc1 ZINC001235925604 1130806584 /nfs/dbraw/zinc/80/65/84/1130806584.db2.gz XALPTXCISMRJLL-LPHOPBHVSA-N 1 3 288.479 3.802 20 0 CHADHO Clc1ccc([C@@H]2CCN(CC[C@H]3CCCC[NH2+]3)C2)cc1 ZINC001235946722 1130813616 /nfs/dbraw/zinc/81/36/16/1130813616.db2.gz AGFBJVVVIJPTNZ-NVXWUHKLSA-N 1 3 292.854 3.662 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@H+](C)C[C@@H]1CCCNC1 ZINC001235952425 1130814008 /nfs/dbraw/zinc/81/40/08/1130814008.db2.gz XQNZIJOVSYBHRL-DLBZAZTESA-N 1 3 298.515 3.539 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@@H+](C)C[C@@H]1CCCNC1 ZINC001235952425 1130814015 /nfs/dbraw/zinc/81/40/15/1130814015.db2.gz XQNZIJOVSYBHRL-DLBZAZTESA-N 1 3 298.515 3.539 20 0 CHADHO [NH3+]Cc1ccccc1-c1cccc(CN2CCCCC2)c1F ZINC001236016217 1130831799 /nfs/dbraw/zinc/83/17/99/1130831799.db2.gz UPLBEOLJFPAQLY-UHFFFAOYSA-N 1 3 298.405 3.937 20 0 CHADHO Cc1sc2ccccc2c1C[N@@H+](C)[C@H]1CCCC[C@H]1N ZINC001236216186 1130891936 /nfs/dbraw/zinc/89/19/36/1130891936.db2.gz IWLHHYIYEQSDHY-CVEARBPZSA-N 1 3 288.460 3.911 20 0 CHADHO Cc1sc2ccccc2c1C[N@H+](C)[C@H]1CCCC[C@H]1N ZINC001236216186 1130891942 /nfs/dbraw/zinc/89/19/42/1130891942.db2.gz IWLHHYIYEQSDHY-CVEARBPZSA-N 1 3 288.460 3.911 20 0 CHADHO Cc1c2ccccc2sc1C[N@@H+](C)[C@@H]1CCCC[C@H]1N ZINC001236218190 1130892264 /nfs/dbraw/zinc/89/22/64/1130892264.db2.gz RNANEDGEKBVAPA-HUUCEWRRSA-N 1 3 288.460 3.911 20 0 CHADHO Cc1c2ccccc2sc1C[N@H+](C)[C@@H]1CCCC[C@H]1N ZINC001236218190 1130892271 /nfs/dbraw/zinc/89/22/71/1130892271.db2.gz RNANEDGEKBVAPA-HUUCEWRRSA-N 1 3 288.460 3.911 20 0 CHADHO [NH3+]Cc1cccc(-c2ccc(CN3CCCCC3)c(F)c2)c1 ZINC001236248193 1130905400 /nfs/dbraw/zinc/90/54/00/1130905400.db2.gz GHGQEWVFMDHXRG-UHFFFAOYSA-N 1 3 298.405 3.937 20 0 CHADHO c1ccc(C[N@@H+](CCC2CCCC2)C2CCNCC2)cc1 ZINC001236284965 1130910974 /nfs/dbraw/zinc/91/09/74/1130910974.db2.gz AQSYPRMBVZWSFW-UHFFFAOYSA-N 1 3 286.463 3.821 20 0 CHADHO c1ccc(C[N@H+](CCC2CCCC2)C2CCNCC2)cc1 ZINC001236284965 1130910977 /nfs/dbraw/zinc/91/09/77/1130910977.db2.gz AQSYPRMBVZWSFW-UHFFFAOYSA-N 1 3 286.463 3.821 20 0 CHADHO CCN(Cc1c(C)sc2ccccc21)C[C@H]1CC[NH2+]C1 ZINC001236410325 1130931821 /nfs/dbraw/zinc/93/18/21/1130931821.db2.gz YTZUUCWGUWVGPY-AWEZNQCLSA-N 1 3 288.460 3.641 20 0 CHADHO C[C@@H]1[C@@H](N)CCC[N@@H+]1Cc1ccccc1-c1ccccc1 ZINC001236422468 1130937279 /nfs/dbraw/zinc/93/72/79/1130937279.db2.gz WOIPWIVIHYAPOF-BEFAXECRSA-N 1 3 280.415 3.665 20 0 CHADHO C[C@@H]1[C@@H](N)CCC[N@H+]1Cc1ccccc1-c1ccccc1 ZINC001236422468 1130937282 /nfs/dbraw/zinc/93/72/82/1130937282.db2.gz WOIPWIVIHYAPOF-BEFAXECRSA-N 1 3 280.415 3.665 20 0 CHADHO C[C@H]1C[C@@H]1C[N@H+](Cc1ccc(Cl)cc1)C1CCNCC1 ZINC001236452563 1130945222 /nfs/dbraw/zinc/94/52/22/1130945222.db2.gz FVTIAFFBRZFKNZ-DZGCQCFKSA-N 1 3 292.854 3.550 20 0 CHADHO C[C@H]1C[C@@H]1C[N@@H+](Cc1ccc(Cl)cc1)C1CCNCC1 ZINC001236452563 1130945223 /nfs/dbraw/zinc/94/52/23/1130945223.db2.gz FVTIAFFBRZFKNZ-DZGCQCFKSA-N 1 3 292.854 3.550 20 0 CHADHO C[C@H]1C[C@@H]1CN(Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001236452563 1130945226 /nfs/dbraw/zinc/94/52/26/1130945226.db2.gz FVTIAFFBRZFKNZ-DZGCQCFKSA-N 1 3 292.854 3.550 20 0 CHADHO Cc1cc(CN(CC(C)(C)C)C2CC[NH2+]CC2)c(C)s1 ZINC001236458020 1130946507 /nfs/dbraw/zinc/94/65/07/1130946507.db2.gz POPUKGACSPIGQE-UHFFFAOYSA-N 1 3 294.508 3.965 20 0 CHADHO Cc1cc(C[N@H+](CC(C)(C)C)C2CCNCC2)c(C)s1 ZINC001236458020 1130946511 /nfs/dbraw/zinc/94/65/11/1130946511.db2.gz POPUKGACSPIGQE-UHFFFAOYSA-N 1 3 294.508 3.965 20 0 CHADHO Cc1cc(C[N@@H+](CC(C)(C)C)C2CCNCC2)c(C)s1 ZINC001236458020 1130946516 /nfs/dbraw/zinc/94/65/16/1130946516.db2.gz POPUKGACSPIGQE-UHFFFAOYSA-N 1 3 294.508 3.965 20 0 CHADHO CCCN(CCC[NH+](C)C)Cc1cccc2occc21 ZINC001236737017 1131003015 /nfs/dbraw/zinc/00/30/15/1131003015.db2.gz AOLXQYUJCUCEBC-UHFFFAOYSA-N 1 3 274.408 3.597 20 0 CHADHO CCCN(Cc1ccccc1C(C)C)C[C@@H]1CC[NH2+]C1 ZINC001236844191 1131022049 /nfs/dbraw/zinc/02/20/49/1131022049.db2.gz UVUYIZKMBVKDGW-MRXNPFEDSA-N 1 3 274.452 3.632 20 0 CHADHO CC(C)N(CC[C@@H]1CCCC[NH2+]1)[C@@H](C)c1ccccc1 ZINC001236859287 1131024369 /nfs/dbraw/zinc/02/43/69/1131024369.db2.gz JDCCFICYIKVUQZ-WMZOPIPTSA-N 1 3 274.452 3.990 20 0 CHADHO [NH3+]CC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(Cl)c1Cl ZINC001237081308 1131046282 /nfs/dbraw/zinc/04/62/82/1131046282.db2.gz KOBLTLGJZGTELJ-VGPLMAKISA-N 1 3 299.245 3.695 20 0 CHADHO C[NH+]1CCC2(CCCN(Cc3cc(Cl)cs3)C2)CC1 ZINC000798957135 1131064467 /nfs/dbraw/zinc/06/44/67/1131064467.db2.gz VWMMFEXXNPXKHX-UHFFFAOYSA-N 1 3 298.883 3.709 20 0 CHADHO CCC(CC)CN1Cc2ccccc2C12CC[NH2+]CC2 ZINC001237299249 1131078773 /nfs/dbraw/zinc/07/87/73/1131078773.db2.gz CBSQISYZQIESDW-UHFFFAOYSA-N 1 3 272.436 3.517 20 0 CHADHO C[NH+]1CCC2(CN(Cc3cccc4c(F)cccc34)C2)CC1 ZINC001237518677 1131109189 /nfs/dbraw/zinc/10/91/89/1131109189.db2.gz NJPZWAMJXFHXRR-UHFFFAOYSA-N 1 3 298.405 3.507 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc21 ZINC001237880967 1131147358 /nfs/dbraw/zinc/14/73/58/1131147358.db2.gz LGLCNLCQJBGDCY-HNNXBMFYSA-N 1 3 284.447 3.920 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+]3CCC[C@H](C)C3)cc21 ZINC001237880967 1131147361 /nfs/dbraw/zinc/14/73/61/1131147361.db2.gz LGLCNLCQJBGDCY-HNNXBMFYSA-N 1 3 284.447 3.920 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](C)c1csc2ccccc21 ZINC000817898122 1131186960 /nfs/dbraw/zinc/18/69/60/1131186960.db2.gz CYUKMSWKYSNANE-TUAOUCFPSA-N 1 3 262.422 3.678 20 0 CHADHO N[C@H]1C[C@H]([NH2+]CCSCc2ccccc2)c2ccccc21 ZINC000817896889 1131187266 /nfs/dbraw/zinc/18/72/66/1131187266.db2.gz YCHQXIQMODDGJN-ROUUACIJSA-N 1 3 298.455 3.654 20 0 CHADHO Cc1cc(F)ccc1[C@H](C)NCc1ccc2c(c1)C[NH2+]C2 ZINC000817969058 1131193565 /nfs/dbraw/zinc/19/35/65/1131193565.db2.gz QLGJYHWUHFAXNZ-ZDUSSCGKSA-N 1 3 284.378 3.588 20 0 CHADHO CCCC[C@@H]1C[C@@H]([NH2+][C@H](C)C2CCCCC2)CCN1 ZINC001246252801 1131433690 /nfs/dbraw/zinc/43/36/90/1131433690.db2.gz WRWUTVDZOOMBON-OIISXLGYSA-N 1 3 266.473 3.856 20 0 CHADHO CC[C@@H]1CC(N[C@@H]2CC23CCCCC3)C[C@@H](CC)[NH2+]1 ZINC001246333583 1131474368 /nfs/dbraw/zinc/47/43/68/1131474368.db2.gz KEIQKNZGPVZFFC-IIAWOOMASA-N 1 3 264.457 3.608 20 0 CHADHO CC[C@H](C)C1CCC([NH2+]C2C[C@@H](C)N[C@H](C)C2)CC1 ZINC001246340564 1131478715 /nfs/dbraw/zinc/47/87/15/1131478715.db2.gz VCMITRHWFDVUPE-ZJKXKIRJSA-N 1 3 266.473 3.710 20 0 CHADHO CCC(C)(C)C1CCC([NH2+][C@H](C(C)C)C2CNC2)CC1 ZINC001246513352 1131539008 /nfs/dbraw/zinc/53/90/08/1131539008.db2.gz DCZFYSARHUTYKF-OFLPRAFFSA-N 1 3 280.500 3.815 20 0 CHADHO CC[C@H]1C[C@@H]([N@@H+](Cc2ccccc2)CC(C)C)CCN1 ZINC001246556200 1131617966 /nfs/dbraw/zinc/61/79/66/1131617966.db2.gz BNDKSEIWRLINSC-ROUUACIJSA-N 1 3 274.452 3.675 20 0 CHADHO CC[C@H]1C[C@@H]([N@H+](Cc2ccccc2)CC(C)C)CCN1 ZINC001246556200 1131617969 /nfs/dbraw/zinc/61/79/69/1131617969.db2.gz BNDKSEIWRLINSC-ROUUACIJSA-N 1 3 274.452 3.675 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@@H+]2CCC[C@@](C)(F)CC2)CCN1 ZINC001246570881 1131646019 /nfs/dbraw/zinc/64/60/19/1131646019.db2.gz TZGZRIRJORJPKR-BZUAXINKSA-N 1 3 270.436 3.511 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@@](C)(F)CC2)CCN1 ZINC001246570881 1131646021 /nfs/dbraw/zinc/64/60/21/1131646021.db2.gz TZGZRIRJORJPKR-BZUAXINKSA-N 1 3 270.436 3.511 20 0 CHADHO C[C@@H]1CCC[N@@H+]([C@@H]2CCN[C@H](C(C)(C)C)C2)C[C@H]1C ZINC001246574946 1131660665 /nfs/dbraw/zinc/66/06/65/1131660665.db2.gz OZKVDFHKJLEFOX-FPCVCCKLSA-N 1 3 266.473 3.521 20 0 CHADHO C[C@@H]1CCC[N@H+]([C@@H]2CCN[C@H](C(C)(C)C)C2)C[C@H]1C ZINC001246574946 1131660667 /nfs/dbraw/zinc/66/06/67/1131660667.db2.gz OZKVDFHKJLEFOX-FPCVCCKLSA-N 1 3 266.473 3.521 20 0 CHADHO CCCCCC[C@@H](CC)[N@@H+]1CCCC[C@@H](CN)C1 ZINC001246584784 1131693936 /nfs/dbraw/zinc/69/39/36/1131693936.db2.gz UUJHSJZXFJKORY-JKSUJKDBSA-N 1 3 254.462 3.796 20 0 CHADHO CCCCCC[C@@H](CC)[N@H+]1CCCC[C@@H](CN)C1 ZINC001246584784 1131693938 /nfs/dbraw/zinc/69/39/38/1131693938.db2.gz UUJHSJZXFJKORY-JKSUJKDBSA-N 1 3 254.462 3.796 20 0 CHADHO CC(C)C[C@H](C)C[C@@H](C)[N@@H+]1CC[C@]2(C1)CCCNC2 ZINC001246602822 1131714630 /nfs/dbraw/zinc/71/46/30/1131714630.db2.gz JTCKKYDZQXYUJT-GVDBMIGSSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)C[C@H](C)C[C@@H](C)[N@H+]1CC[C@]2(C1)CCCNC2 ZINC001246602822 1131714633 /nfs/dbraw/zinc/71/46/33/1131714633.db2.gz JTCKKYDZQXYUJT-GVDBMIGSSA-N 1 3 266.473 3.523 20 0 CHADHO CCCCCC[C@H](CCC)[N@@H+]1CC[C@H]2CNCC[C@H]21 ZINC001246623863 1131720479 /nfs/dbraw/zinc/72/04/79/1131720479.db2.gz NUDRQLKOXXBCKA-YESZJQIVSA-N 1 3 266.473 3.809 20 0 CHADHO CCCCCC[C@H](CCC)[N@H+]1CC[C@H]2CNCC[C@H]21 ZINC001246623863 1131720484 /nfs/dbraw/zinc/72/04/84/1131720484.db2.gz NUDRQLKOXXBCKA-YESZJQIVSA-N 1 3 266.473 3.809 20 0 CHADHO CCCCC[C@H](CCC)[N@@H+]1CC[C@]2(C1)CNCC[C@H]2F ZINC001246693715 1131781752 /nfs/dbraw/zinc/78/17/52/1131781752.db2.gz QGRVIHYNLIELSU-GVDBMIGSSA-N 1 3 284.463 3.759 20 0 CHADHO CCCCC[C@H](CCC)[N@H+]1CC[C@]2(C1)CNCC[C@H]2F ZINC001246693715 1131781757 /nfs/dbraw/zinc/78/17/57/1131781757.db2.gz QGRVIHYNLIELSU-GVDBMIGSSA-N 1 3 284.463 3.759 20 0 CHADHO C[C@H]([NH2+]C1CC(C)(C)N(C)C(C)(C)C1)C(C)(C)C ZINC001171619040 1132065511 /nfs/dbraw/zinc/06/55/11/1132065511.db2.gz FLQIMSKMRFAZCO-LBPRGKRZSA-N 1 3 254.462 3.662 20 0 CHADHO CC(C)C[C@@H](C)[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001171621557 1132066046 /nfs/dbraw/zinc/06/60/46/1132066046.db2.gz MSBFIQCCIABWKR-CYBMUJFWSA-N 1 3 254.462 3.662 20 0 CHADHO C[C@@H](CCCC(C)(C)O)[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001171623143 1132068005 /nfs/dbraw/zinc/06/80/05/1132068005.db2.gz LXEDBMVIRUAAPQ-AWEZNQCLSA-N 1 3 298.515 3.557 20 0 CHADHO CC[C@@H]1CCC[N@@H+](C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001171639742 1132081207 /nfs/dbraw/zinc/08/12/07/1132081207.db2.gz RIKJUTQFGXBLIJ-CQSZACIVSA-N 1 3 266.473 3.760 20 0 CHADHO CC[C@@H]1CCC[N@H+](C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001171639742 1132081214 /nfs/dbraw/zinc/08/12/14/1132081214.db2.gz RIKJUTQFGXBLIJ-CQSZACIVSA-N 1 3 266.473 3.760 20 0 CHADHO CN1C(C)(C)CC([NH+]2CCC(C(F)F)CC2)CC1(C)C ZINC001171639553 1132081272 /nfs/dbraw/zinc/08/12/72/1132081272.db2.gz OQKBBECAAOPXPA-UHFFFAOYSA-N 1 3 288.426 3.615 20 0 CHADHO CCCOC1CC[NH+](C2CC(C)(C)N(C)C(C)(C)C2)CC1 ZINC001171638200 1132081645 /nfs/dbraw/zinc/08/16/45/1132081645.db2.gz WRDDAOFJCKNULX-UHFFFAOYSA-N 1 3 296.499 3.529 20 0 CHADHO CN1C(C)(C)CC([N@@H+]2CC[C@@H](C(F)(F)F)C2)CC1(C)C ZINC001171639612 1132082523 /nfs/dbraw/zinc/08/25/23/1132082523.db2.gz QICRJMLVHRVLBM-LLVKDONJSA-N 1 3 292.389 3.522 20 0 CHADHO CN1C(C)(C)CC([N@H+]2CC[C@@H](C(F)(F)F)C2)CC1(C)C ZINC001171639612 1132082530 /nfs/dbraw/zinc/08/25/30/1132082530.db2.gz QICRJMLVHRVLBM-LLVKDONJSA-N 1 3 292.389 3.522 20 0 CHADHO CC[NH+](CC)C1CCN([C@@H]2CC[C@@H](C)[C@H](C)C2)CC1 ZINC001172374350 1132167967 /nfs/dbraw/zinc/16/79/67/1132167967.db2.gz QATCPFBCUMKHSI-BFYDXBDKSA-N 1 3 266.473 3.617 20 0 CHADHO CCN(CC)C1CC[NH+]([C@@H]2CC[C@@H](C)[C@H](C)C2)CC1 ZINC001172374350 1132167970 /nfs/dbraw/zinc/16/79/70/1132167970.db2.gz QATCPFBCUMKHSI-BFYDXBDKSA-N 1 3 266.473 3.617 20 0 CHADHO CC[C@H](CC(C)C)[NH2+]C1CCN(C2CCCC2)CC1 ZINC001172390951 1132216056 /nfs/dbraw/zinc/21/60/56/1132216056.db2.gz BBLMDIHHHBBAJU-OAHLLOKOSA-N 1 3 266.473 3.808 20 0 CHADHO CC[C@@H](CC(C)C)[NH+]1CCC(N)(Cc2ccccc2)CC1 ZINC001172399184 1132222099 /nfs/dbraw/zinc/22/20/99/1132222099.db2.gz JRNINPYJGOQMAU-SFHVURJKSA-N 1 3 288.479 3.847 20 0 CHADHO CN1CC2(C1)CC[NH+]([C@H]1CCC[C@@H](c3ccccc3)C1)CC2 ZINC001172550206 1132261956 /nfs/dbraw/zinc/26/19/56/1132261956.db2.gz VCJNCWIWGUQBFN-MOPGFXCFSA-N 1 3 298.474 3.740 20 0 CHADHO CC1([NH3+])CCN([C@@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001172541398 1132277510 /nfs/dbraw/zinc/27/75/10/1132277510.db2.gz XNSYAXDEFOLXIV-IAGOWNOFSA-N 1 3 272.436 3.526 20 0 CHADHO CC[C@H]1CC[C@H](C2CCC([NH2+]C3CC(N)C3)CC2)CC1 ZINC001172582341 1132285679 /nfs/dbraw/zinc/28/56/79/1132285679.db2.gz CBNAKVOFECVKDQ-WXEQZHOTSA-N 1 3 278.484 3.841 20 0 CHADHO CC(C)c1ccccc1CN1CCN(c2cc[nH+]cc2)CC1 ZINC001231875550 1132386758 /nfs/dbraw/zinc/38/67/58/1132386758.db2.gz VOSILENQRWIFRL-UHFFFAOYSA-N 1 3 295.430 3.527 20 0 CHADHO CC[NH+](CC)C1CCC(N[C@H](CF)c2ccccc2)CC1 ZINC001173103251 1132391472 /nfs/dbraw/zinc/39/14/72/1132391472.db2.gz GSFFQDNKZOGNOQ-DAWZGUTISA-N 1 3 292.442 3.940 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@@H+]2CCC[C@](C)(F)CC2)c1 ZINC001232145183 1132428341 /nfs/dbraw/zinc/42/83/41/1132428341.db2.gz XFCCXNIKSXTMOM-KRWDZBQOSA-N 1 3 296.405 3.601 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@H+]2CCC[C@](C)(F)CC2)c1 ZINC001232145183 1132428345 /nfs/dbraw/zinc/42/83/45/1132428345.db2.gz XFCCXNIKSXTMOM-KRWDZBQOSA-N 1 3 296.405 3.601 20 0 CHADHO C[C@@H]1CC[N@H+](Cc2cc(F)cc(CN(C)C)c2)[C@H](C)C1 ZINC001232146678 1132428429 /nfs/dbraw/zinc/42/84/29/1132428429.db2.gz YAOFNUVMMRWDFN-ZIAGYGMSSA-N 1 3 278.415 3.508 20 0 CHADHO C[C@@H]1CC[N@@H+](Cc2cc(F)cc(CN(C)C)c2)[C@H](C)C1 ZINC001232146678 1132428431 /nfs/dbraw/zinc/42/84/31/1132428431.db2.gz YAOFNUVMMRWDFN-ZIAGYGMSSA-N 1 3 278.415 3.508 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@@H+]2CCC[C@@](C)(F)CC2)c1 ZINC001232145184 1132428558 /nfs/dbraw/zinc/42/85/58/1132428558.db2.gz XFCCXNIKSXTMOM-QGZVFWFLSA-N 1 3 296.405 3.601 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@H+]2CCC[C@@](C)(F)CC2)c1 ZINC001232145184 1132428561 /nfs/dbraw/zinc/42/85/61/1132428561.db2.gz XFCCXNIKSXTMOM-QGZVFWFLSA-N 1 3 296.405 3.601 20 0 CHADHO CC[C@@H]1CC[C@H]([NH2+]C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001173269315 1132434342 /nfs/dbraw/zinc/43/43/42/1132434342.db2.gz VLXXAQATXVSOLS-KGLIPLIRSA-N 1 3 266.473 3.806 20 0 CHADHO CC[C@@H]1CC[C@H]([NH2+]C2CCN(CC3CCCC3)CC2)C1 ZINC001173270075 1132435355 /nfs/dbraw/zinc/43/53/55/1132435355.db2.gz AGVDDSPGAQCTSK-QAPCUYQASA-N 1 3 278.484 3.809 20 0 CHADHO CCSC[C@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC001173295375 1132443860 /nfs/dbraw/zinc/44/38/60/1132443860.db2.gz GFTVZWXMUNRYBD-AWEZNQCLSA-N 1 3 284.513 3.515 20 0 CHADHO CCSC[C@H](C)NC1CC[NH+](C2CCCCC2)CC1 ZINC001173295375 1132443864 /nfs/dbraw/zinc/44/38/64/1132443864.db2.gz GFTVZWXMUNRYBD-AWEZNQCLSA-N 1 3 284.513 3.515 20 0 CHADHO [NH3+]CCCCCCNCc1csc(Cl)c1Cl ZINC000843129558 1132497035 /nfs/dbraw/zinc/49/70/35/1132497035.db2.gz PQRYCXMNBPBCPR-UHFFFAOYSA-N 1 3 281.252 3.664 20 0 CHADHO CN(C)Cc1ccccc1Nc1ccc(C(C)(C)C[NH3+])cc1 ZINC001159579337 1132866392 /nfs/dbraw/zinc/86/63/92/1132866392.db2.gz ANESAAPFADPXOS-UHFFFAOYSA-N 1 3 297.446 3.728 20 0 CHADHO Cc1nc2ccc(Nc3ccc(C(C)(C)C[NH3+])cc3)cc2[nH]1 ZINC001159581370 1132867355 /nfs/dbraw/zinc/86/73/55/1132867355.db2.gz KHYDYKJWWXVHFT-UHFFFAOYSA-N 1 3 294.402 3.851 20 0 CHADHO CCc1cc(N(CC[NH3+])c2cccc3ccccc32)ccn1 ZINC001162007918 1133047588 /nfs/dbraw/zinc/04/75/88/1133047588.db2.gz SAVFYCRYVWKKQV-UHFFFAOYSA-N 1 3 291.398 3.894 20 0 CHADHO Cc1nc2ccc(NCc3cccc(C[NH+](C)C)c3)cc2[nH]1 ZINC001163994130 1133191605 /nfs/dbraw/zinc/19/16/05/1133191605.db2.gz DWTIHSDBAHHVGA-UHFFFAOYSA-N 1 3 294.402 3.545 20 0 CHADHO [NH3+][C@H]1CCCN(Cc2ccc(-c3ccccc3)cc2)CC1 ZINC001205095338 1133529146 /nfs/dbraw/zinc/52/91/46/1133529146.db2.gz WVOSEKBOWCYFKS-IBGZPJMESA-N 1 3 280.415 3.667 20 0 CHADHO CC(C)c1ccc(CCN2CCC[C@](C)([NH3+])CC2)cc1 ZINC001205257994 1133551374 /nfs/dbraw/zinc/55/13/74/1133551374.db2.gz ZUEVYIXZUPMYFL-SFHVURJKSA-N 1 3 274.452 3.556 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@@H+]1CC[C@H](C)[C@@H](CN)C1 ZINC001205296202 1133555765 /nfs/dbraw/zinc/55/57/65/1133555765.db2.gz ITFUAHIOUPJRRA-ULQDDVLXSA-N 1 3 298.515 3.525 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@H+]1CC[C@H](C)[C@@H](CN)C1 ZINC001205296202 1133555770 /nfs/dbraw/zinc/55/57/70/1133555770.db2.gz ITFUAHIOUPJRRA-ULQDDVLXSA-N 1 3 298.515 3.525 20 0 CHADHO C[C@H](C[N@@H+]1CC[C@@H](C)[C@@H](CN)C1)c1cccc2ccccc21 ZINC001205296079 1133555901 /nfs/dbraw/zinc/55/59/01/1133555901.db2.gz GEVJZTLDRKQFBH-NUJGCVRESA-N 1 3 296.458 3.860 20 0 CHADHO C[C@H](C[N@H+]1CC[C@@H](C)[C@@H](CN)C1)c1cccc2ccccc21 ZINC001205296079 1133555908 /nfs/dbraw/zinc/55/59/08/1133555908.db2.gz GEVJZTLDRKQFBH-NUJGCVRESA-N 1 3 296.458 3.860 20 0 CHADHO Cc1ccc([C@@H](C)C[NH2+]CC[C@@H](C)N2CCCCC2)cc1 ZINC001205391382 1133573752 /nfs/dbraw/zinc/57/37/52/1133573752.db2.gz MVLZRHLPZGNRJO-ZWKOTPCHSA-N 1 3 288.479 3.953 20 0 CHADHO Cc1ccc(Cl)c(CN2CC[C@@H](C[NH3+])[C@@H](C)CC2)c1F ZINC001205618927 1133596612 /nfs/dbraw/zinc/59/66/12/1133596612.db2.gz ZGRIFBCSPOAFGM-AAEUAGOBSA-N 1 3 298.833 3.594 20 0 CHADHO CC[C@@H](C)C[C@H](CC)[NH2+]CC(C)(C)CN1CCCC1 ZINC001205645656 1133598051 /nfs/dbraw/zinc/59/80/51/1133598051.db2.gz MXZZDFFMAOINHG-CVEARBPZSA-N 1 3 268.489 3.913 20 0 CHADHO CCCCc1ccc(CN2CCC[C@H](C[NH3+])[C@H]2C)s1 ZINC001205901013 1133628224 /nfs/dbraw/zinc/62/82/24/1133628224.db2.gz AMGLBUKCEKCVGL-ZIAGYGMSSA-N 1 3 280.481 3.650 20 0 CHADHO Cc1cc(CN2CCC[C@@H](C[NH3+])[C@@H](C)C2)c(F)cc1Cl ZINC001206027281 1133644097 /nfs/dbraw/zinc/64/40/97/1133644097.db2.gz VRVMXNSBHWCDBK-STQMWFEESA-N 1 3 298.833 3.594 20 0 CHADHO Cc1c(Cl)ccc(CN2CCC[C@@](C)(C[NH3+])CC2)c1F ZINC001206326451 1133690006 /nfs/dbraw/zinc/69/00/06/1133690006.db2.gz NPHFTXBUVQSKCZ-MRXNPFEDSA-N 1 3 298.833 3.738 20 0 CHADHO CCCc1ccc(CN2CCCC[C@@](C)(C[NH3+])C2)s1 ZINC001206547115 1133715140 /nfs/dbraw/zinc/71/51/40/1133715140.db2.gz BUSGTEJNNRNXQL-INIZCTEOSA-N 1 3 280.481 3.652 20 0 CHADHO C[C@@]1(C[NH3+])CCCCN(CCCc2ccccc2Cl)C1 ZINC001206542310 1133716247 /nfs/dbraw/zinc/71/62/47/1133716247.db2.gz XWSWIINMEJIRRH-KRWDZBQOSA-N 1 3 294.870 3.724 20 0 CHADHO CC(C)[N@H+](CCCC1CCCC1)[C@H]1CCCNCC1 ZINC001206583778 1133722322 /nfs/dbraw/zinc/72/23/22/1133722322.db2.gz WKIGSISZVWRQBB-KRWDZBQOSA-N 1 3 266.473 3.809 20 0 CHADHO CC(C)[N@@H+](CCCC1CCCC1)[C@H]1CCCNCC1 ZINC001206583778 1133722324 /nfs/dbraw/zinc/72/23/24/1133722324.db2.gz WKIGSISZVWRQBB-KRWDZBQOSA-N 1 3 266.473 3.809 20 0 CHADHO CC(C)N(Cc1coc2ccccc12)[C@@H]1CCC[NH2+]CC1 ZINC001206588566 1133722862 /nfs/dbraw/zinc/72/28/62/1133722862.db2.gz BPUFOCMJXQELSW-MRXNPFEDSA-N 1 3 286.419 3.785 20 0 CHADHO CCCCc1ccc(CN2C[C@@H](C[NH3+])CC[C@@H]2C)cc1 ZINC001206769380 1133745856 /nfs/dbraw/zinc/74/58/56/1133745856.db2.gz OXNNFGIHVSDIRQ-MAUKXSAKSA-N 1 3 274.452 3.588 20 0 CHADHO C[C@H]1CC[C@@H](C[NH3+])CN1Cc1ccc(C2CCC2)cc1 ZINC001206811215 1133751686 /nfs/dbraw/zinc/75/16/86/1133751686.db2.gz RUNLZVVCGYYFSE-HOCLYGCPSA-N 1 3 272.436 3.513 20 0 CHADHO C[C@H](CCN1CCC(C)([NH+]2CCC2)CC1)c1ccccc1 ZINC001207295068 1133788376 /nfs/dbraw/zinc/78/83/76/1133788376.db2.gz XBOPYEWMZMLESA-QGZVFWFLSA-N 1 3 286.463 3.740 20 0 CHADHO CN(C)CC(C)(C)C[N@@H+]1CCC[C@@H]1c1ccccc1F ZINC001207286499 1133788534 /nfs/dbraw/zinc/78/85/34/1133788534.db2.gz VFDZCKGXYAZZKZ-MRXNPFEDSA-N 1 3 278.415 3.550 20 0 CHADHO CN(C)CC(C)(C)C[N@H+]1CCC[C@@H]1c1ccccc1F ZINC001207286499 1133788540 /nfs/dbraw/zinc/78/85/40/1133788540.db2.gz VFDZCKGXYAZZKZ-MRXNPFEDSA-N 1 3 278.415 3.550 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@@H+]1C[C@@H]1C[C@H]2C=C[C@@H]1C2 ZINC001207631418 1133833561 /nfs/dbraw/zinc/83/35/61/1133833561.db2.gz HBEZMLVGCJQOTL-XCDZQEORSA-N 1 3 288.479 3.537 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@H+]1C[C@@H]1C[C@H]2C=C[C@@H]1C2 ZINC001207631418 1133833563 /nfs/dbraw/zinc/83/35/63/1133833563.db2.gz HBEZMLVGCJQOTL-XCDZQEORSA-N 1 3 288.479 3.537 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@@H+]1C[C@H]1C[C@H]2C=C[C@@H]1C2 ZINC001207631413 1133834221 /nfs/dbraw/zinc/83/42/21/1133834221.db2.gz HBEZMLVGCJQOTL-BRIYLRKRSA-N 1 3 288.479 3.537 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@H+]1C[C@H]1C[C@H]2C=C[C@@H]1C2 ZINC001207631413 1133834224 /nfs/dbraw/zinc/83/42/24/1133834224.db2.gz HBEZMLVGCJQOTL-BRIYLRKRSA-N 1 3 288.479 3.537 20 0 CHADHO Cc1cccc(CCN(C)CC2(C[NH+](C)C)CCCC2)c1 ZINC001208185894 1133902478 /nfs/dbraw/zinc/90/24/78/1133902478.db2.gz KGYUMCCEOYZNQR-UHFFFAOYSA-N 1 3 288.479 3.591 20 0 CHADHO CC[N@H+](Cc1cccc(F)c1)CC1(CN(C)C)CCCC1 ZINC001208187371 1133902802 /nfs/dbraw/zinc/90/28/02/1133902802.db2.gz JPZBMOGBCHZQHR-UHFFFAOYSA-N 1 3 292.442 3.770 20 0 CHADHO CC[N@@H+](Cc1cccc(F)c1)CC1(CN(C)C)CCCC1 ZINC001208187371 1133902805 /nfs/dbraw/zinc/90/28/05/1133902805.db2.gz JPZBMOGBCHZQHR-UHFFFAOYSA-N 1 3 292.442 3.770 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1CCC1CCCC1 ZINC001208694511 1133928757 /nfs/dbraw/zinc/92/87/57/1133928757.db2.gz RCXQCCOOIGHZCV-ROUUACIJSA-N 1 3 278.484 3.906 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@H+]1CCC1CCCC1 ZINC001208694511 1133928760 /nfs/dbraw/zinc/92/87/60/1133928760.db2.gz RCXQCCOOIGHZCV-ROUUACIJSA-N 1 3 278.484 3.906 20 0 CHADHO C[C@H](CN(C)CCC[NH+](C)C)c1cccc2ccccc21 ZINC001208702399 1133930458 /nfs/dbraw/zinc/93/04/58/1133930458.db2.gz ABEJDJABJZPJED-MRXNPFEDSA-N 1 3 284.447 3.827 20 0 CHADHO CNc1cc(Nc2ccnc(C3CCC3)c2)cc[nH+]1 ZINC001216333498 1134857798 /nfs/dbraw/zinc/85/77/98/1134857798.db2.gz BIJMWVLQFVNGIY-UHFFFAOYSA-N 1 3 254.337 3.529 20 0 CHADHO c1ccc(C2(C[N@@H+]3CCC[C@]34CCCNC4)CCCC2)cc1 ZINC001222231373 1135210893 /nfs/dbraw/zinc/21/08/93/1135210893.db2.gz LKHZQDFPKWZKER-FQEVSTJZSA-N 1 3 298.474 3.716 20 0 CHADHO c1ccc(C2(C[N@H+]3CCC[C@]34CCCNC4)CCCC2)cc1 ZINC001222231373 1135210896 /nfs/dbraw/zinc/21/08/96/1135210896.db2.gz LKHZQDFPKWZKER-FQEVSTJZSA-N 1 3 298.474 3.716 20 0 CHADHO c1ccc([C@@H]2C[N@@H+](CCCC3CCCC3)CC23CNC3)cc1 ZINC001222596534 1135253790 /nfs/dbraw/zinc/25/37/90/1135253790.db2.gz YQXKXSJFIOWSAU-IBGZPJMESA-N 1 3 298.474 3.646 20 0 CHADHO c1ccc([C@@H]2C[N@H+](CCCC3CCCC3)CC23CNC3)cc1 ZINC001222596534 1135253792 /nfs/dbraw/zinc/25/37/92/1135253792.db2.gz YQXKXSJFIOWSAU-IBGZPJMESA-N 1 3 298.474 3.646 20 0 CHADHO c1ccc([C@@H]2CN(CCCC3CCCC3)CC23C[NH2+]C3)cc1 ZINC001222596534 1135253796 /nfs/dbraw/zinc/25/37/96/1135253796.db2.gz YQXKXSJFIOWSAU-IBGZPJMESA-N 1 3 298.474 3.646 20 0 CHADHO CCC[C@H]([NH2+][C@@H]1CCN2CCC[C@@H]2C1)C1CCCC1 ZINC000313428953 260292983 /nfs/dbraw/zinc/29/29/83/260292983.db2.gz OSANKKKQJWFYAB-ZACQAIPSSA-N 1 3 264.457 3.562 20 0 CHADHO CCCC[C@H](C)[C@H](C)[NH2+]C[C@@H]1CCN(CCC)C1 ZINC000574601030 335032648 /nfs/dbraw/zinc/03/26/48/335032648.db2.gz QIKFRSWDGWUANX-JYJNAYRXSA-N 1 3 254.462 3.523 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCCC[C@@H]1C)c1cccs1 ZINC000216004693 533381873 /nfs/dbraw/zinc/38/18/73/533381873.db2.gz WLHANWMXSINUEL-UONOGXRCSA-N 1 3 266.454 3.663 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCCc2cc(F)ccc21)CN1CCCC1 ZINC000341762982 130027901 /nfs/dbraw/zinc/02/79/01/130027901.db2.gz WWFJIMMHXJTKKP-KDOFPFPSSA-N 1 3 290.426 3.525 20 0 CHADHO CC(C)[NH+]1CCC(NCc2cccc3ccccc32)CC1 ZINC000020188923 171054496 /nfs/dbraw/zinc/05/44/96/171054496.db2.gz MTYQGBYGMRWLKV-UHFFFAOYSA-N 1 3 282.431 3.802 20 0 CHADHO C[C@H](C[NH2+][C@H](C)c1cccc(F)c1)CN1CCCCC1 ZINC000038041857 174044477 /nfs/dbraw/zinc/04/44/77/174044477.db2.gz JHPQZGMGIGCPPT-HUUCEWRRSA-N 1 3 278.415 3.598 20 0 CHADHO [NH3+]C[C@@H]1CCCN(Cc2cccc(-c3ccccc3)c2)C1 ZINC000347088447 226044078 /nfs/dbraw/zinc/04/40/78/226044078.db2.gz FCHCJFXSBCXYMP-KRWDZBQOSA-N 1 3 280.415 3.524 20 0 CHADHO c1cc2cc(CN3CCC(C[NH+]4CCCC4)CC3)ccc2o1 ZINC000347660667 226228873 /nfs/dbraw/zinc/22/88/73/226228873.db2.gz XTZJHPMHHSKRPK-UHFFFAOYSA-N 1 3 298.430 3.741 20 0 CHADHO CSC1(C[NH2+][C@H](C)c2sccc2C)CCN(C)CC1 ZINC000353606342 228129443 /nfs/dbraw/zinc/12/94/43/228129443.db2.gz DSJDEODCKNUNAK-CYBMUJFWSA-N 1 3 298.521 3.535 20 0 CHADHO C[C@H](c1cccc(F)c1)N1CCC(CCC[NH+](C)C)CC1 ZINC000179698752 260064613 /nfs/dbraw/zinc/06/46/13/260064613.db2.gz IMZUPFXLDYVHBG-OAHLLOKOSA-N 1 3 292.442 3.941 20 0 CHADHO CC(C)[NH+]1CCC(N(C)CCc2ccc(Cl)cc2)CC1 ZINC000445205985 260251354 /nfs/dbraw/zinc/25/13/54/260251354.db2.gz GHFWNWXKGKADEE-UHFFFAOYSA-N 1 3 294.870 3.687 20 0 CHADHO Cc1cc(C)c(CNC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c(C)c1 ZINC000088163738 260278649 /nfs/dbraw/zinc/27/86/49/260278649.db2.gz ICILBGVJABUHNG-AYHJJNSGSA-N 1 3 286.463 3.717 20 0 CHADHO Cc1cc(C)c(CNC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c(C)c1 ZINC000088163738 260278651 /nfs/dbraw/zinc/27/86/51/260278651.db2.gz ICILBGVJABUHNG-AYHJJNSGSA-N 1 3 286.463 3.717 20 0 CHADHO CC(C)C[C@H](N[C@@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000129022583 260380809 /nfs/dbraw/zinc/38/08/09/260380809.db2.gz ZAFQNNGSXZZUPO-SJORKVTESA-N 1 3 260.425 3.506 20 0 CHADHO C1CCC2(C1)CCC([NH2+][C@H]1CCN3CCC[C@@H]3C1)CC2 ZINC000129451394 260387166 /nfs/dbraw/zinc/38/71/66/260387166.db2.gz HEUUHRQQBMPGMF-DLBZAZTESA-N 1 3 276.468 3.706 20 0 CHADHO C[C@H]1C[C@@H](NCc2ccc(C(C)(C)C)cc2)CC[N@@H+]1C ZINC000090721269 260393178 /nfs/dbraw/zinc/39/31/78/260393178.db2.gz ODHSOFJSMAUKQW-YOEHRIQHSA-N 1 3 274.452 3.556 20 0 CHADHO C[C@H]1C[C@@H](NCc2ccc(C(C)(C)C)cc2)CC[N@H+]1C ZINC000090721269 260393179 /nfs/dbraw/zinc/39/31/79/260393179.db2.gz ODHSOFJSMAUKQW-YOEHRIQHSA-N 1 3 274.452 3.556 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2[N@@H+]1CC[C@H](CN2CCCCC2)C1 ZINC000173602893 261165965 /nfs/dbraw/zinc/16/59/65/261165965.db2.gz BSBSADLMZWLCMY-XLIONFOSSA-N 1 3 298.474 3.872 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2[N@H+]1CC[C@H](CN2CCCCC2)C1 ZINC000173602893 261165966 /nfs/dbraw/zinc/16/59/66/261165966.db2.gz BSBSADLMZWLCMY-XLIONFOSSA-N 1 3 298.474 3.872 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2N1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000173602893 261165968 /nfs/dbraw/zinc/16/59/68/261165968.db2.gz BSBSADLMZWLCMY-XLIONFOSSA-N 1 3 298.474 3.872 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@@H](C)CCc1ccc(F)cc1F ZINC000514082470 261199041 /nfs/dbraw/zinc/19/90/41/261199041.db2.gz GZUHVOSNFOUURA-AWEZNQCLSA-N 1 3 298.421 3.606 20 0 CHADHO CC(C)[N@@H+](C)CCCN[C@@H](C)CCc1ccc(F)cc1F ZINC000514082470 261199044 /nfs/dbraw/zinc/19/90/44/261199044.db2.gz GZUHVOSNFOUURA-AWEZNQCLSA-N 1 3 298.421 3.606 20 0 CHADHO CC(C)[N@H+](C)CCCN[C@@H](C)CCc1ccc(F)cc1F ZINC000514082470 261199047 /nfs/dbraw/zinc/19/90/47/261199047.db2.gz GZUHVOSNFOUURA-AWEZNQCLSA-N 1 3 298.421 3.606 20 0 CHADHO CC[NH+](CC)Cc1cccc(CN[C@H](C)c2ccncc2)c1 ZINC000173954619 261551479 /nfs/dbraw/zinc/55/14/79/261551479.db2.gz SIFGBHFLZOGEFG-MRXNPFEDSA-N 1 3 297.446 3.774 20 0 CHADHO CN1CCC[C@H]2C[N@H+](Cc3ccc(C(F)F)cc3)CC[C@@H]21 ZINC000183961086 262001698 /nfs/dbraw/zinc/00/16/98/262001698.db2.gz FETYAAXHJZPKBY-HOTGVXAUSA-N 1 3 294.389 3.540 20 0 CHADHO CN1CCC[C@H]2C[N@@H+](Cc3ccc(C(F)F)cc3)CC[C@@H]21 ZINC000183961086 262001700 /nfs/dbraw/zinc/00/17/00/262001700.db2.gz FETYAAXHJZPKBY-HOTGVXAUSA-N 1 3 294.389 3.540 20 0 CHADHO CCCN1CCC([N@H+](C)Cc2ccc(C(F)F)cc2)CC1 ZINC000183955030 262001777 /nfs/dbraw/zinc/00/17/77/262001777.db2.gz IGHSRJATVKVFLL-UHFFFAOYSA-N 1 3 296.405 3.930 20 0 CHADHO CCCN1CCC([N@@H+](C)Cc2ccc(C(F)F)cc2)CC1 ZINC000183955030 262001778 /nfs/dbraw/zinc/00/17/78/262001778.db2.gz IGHSRJATVKVFLL-UHFFFAOYSA-N 1 3 296.405 3.930 20 0 CHADHO C[C@@H](c1ccc(C(C)(C)C)cc1)N1CC[C@H]([NH3+])[C@H](C)C1 ZINC000094338891 262196510 /nfs/dbraw/zinc/19/65/10/262196510.db2.gz ARIDXTVOXOLPDO-KEYYUXOJSA-N 1 3 274.452 3.714 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)NCc1ccccc1Cl ZINC000019914648 262206134 /nfs/dbraw/zinc/20/61/34/262206134.db2.gz FTBIFQYGXIJSNE-CQSZACIVSA-N 1 3 282.859 3.940 20 0 CHADHO CSc1ccc(C[NH2+]CCCN2CCC(C)CC2)cc1 ZINC000019998669 262213559 /nfs/dbraw/zinc/21/35/59/262213559.db2.gz PFAKCSYDOGGIIH-UHFFFAOYSA-N 1 3 292.492 3.620 20 0 CHADHO CSc1ccc([C@H](C)[NH2+]CCCN2CCCC2)cc1 ZINC000020129160 262230014 /nfs/dbraw/zinc/23/00/14/262230014.db2.gz LSTXCKOVTCAHHQ-AWEZNQCLSA-N 1 3 278.465 3.545 20 0 CHADHO CCC[C@H]([NH2+]CCCN(C)C(C)C)c1ccccc1 ZINC000221908327 262323013 /nfs/dbraw/zinc/32/30/13/262323013.db2.gz BKVDUIKLBZVDFM-KRWDZBQOSA-N 1 3 262.441 3.848 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H](N2CCC[C@]3(CC[NH2+]C3)C2)C1 ZINC000414784213 263046615 /nfs/dbraw/zinc/04/66/15/263046615.db2.gz KQLBQYAVQSIJPF-SLFFLAALSA-N 1 3 298.474 3.572 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCCC[C@@H]1CN)c1cccc(Cl)c1 ZINC000414791463 263048815 /nfs/dbraw/zinc/04/88/15/263048815.db2.gz BFQPZZTZMOXGOS-XPKDYRNWSA-N 1 3 280.843 3.551 20 0 CHADHO CC[C@@H](Cc1ccc(Cl)cc1Cl)NCC(C)(C)[NH3+] ZINC000414811703 263052809 /nfs/dbraw/zinc/05/28/09/263052809.db2.gz ZUGVIRJEGUBVFF-LBPRGKRZSA-N 1 3 289.250 3.641 20 0 CHADHO C[C@H](N)CC[NH2+][C@@H](CCc1ccccc1)Cc1ccccc1 ZINC000414817313 263054091 /nfs/dbraw/zinc/05/40/91/263054091.db2.gz AOSOAVFBQDISQE-PXNSSMCTSA-N 1 3 296.458 3.557 20 0 CHADHO Clc1ccc([C@@H]2CCC[C@@H]2[NH2+]C[C@H]2CCCNC2)cc1 ZINC000414822775 263055029 /nfs/dbraw/zinc/05/50/29/263055029.db2.gz COPPJEVEVZPULR-JQFCIGGWSA-N 1 3 292.854 3.565 20 0 CHADHO C[C@H]([NH2+]C1CCC(C(C)(C)C)CC1)[C@@H]1CCCNC1 ZINC000414844896 263059321 /nfs/dbraw/zinc/05/93/21/263059321.db2.gz DFJWESYDCHYPCG-QRNKSROTSA-N 1 3 266.473 3.569 20 0 CHADHO Clc1oc2ccccc2c1CNCC[C@H]1CCC[NH2+]C1 ZINC000414846732 263062555 /nfs/dbraw/zinc/06/25/55/263062555.db2.gz VAHDCQQLNQQWFV-GFCCVEGCSA-N 1 3 292.810 3.566 20 0 CHADHO C[C@H](Cc1ccc(Cl)cc1)NCC1([NH3+])CCCCC1 ZINC000414847020 263063361 /nfs/dbraw/zinc/06/33/61/263063361.db2.gz UJENCLYHJGINML-CYBMUJFWSA-N 1 3 280.843 3.522 20 0 CHADHO CNCCC[NH2+]CCCCc1ccc(Cl)c(Cl)c1 ZINC000414861363 263075805 /nfs/dbraw/zinc/07/58/05/263075805.db2.gz SBKLTNLKQOAHKA-UHFFFAOYSA-N 1 3 289.250 3.515 20 0 CHADHO NC1(C[NH2+]Cc2ccc(-c3ccccc3F)s2)CCC1 ZINC000414879267 263094589 /nfs/dbraw/zinc/09/45/89/263094589.db2.gz IHRZYACRLJNRTJ-UHFFFAOYSA-N 1 3 290.407 3.525 20 0 CHADHO CCC[C@H](C[NH2+]C[C@]1(C)CCCNC1)c1ccccc1 ZINC000414903798 263111376 /nfs/dbraw/zinc/11/13/76/263111376.db2.gz MFLAODPAZXKJMM-QZTJIDSGSA-N 1 3 274.452 3.550 20 0 CHADHO C[N@@H+]1CCC[C@@H]1CCN(C1CC1)[C@@H]1CCc2ccccc21 ZINC000340370033 263119923 /nfs/dbraw/zinc/11/99/23/263119923.db2.gz KIDCMCUBBWSWDS-VQIMIIECSA-N 1 3 284.447 3.623 20 0 CHADHO C[N@H+]1CCC[C@@H]1CCN(C1CC1)[C@@H]1CCc2ccccc21 ZINC000340370033 263119924 /nfs/dbraw/zinc/11/99/24/263119924.db2.gz KIDCMCUBBWSWDS-VQIMIIECSA-N 1 3 284.447 3.623 20 0 CHADHO CC[C@H]([NH3+])CN[C@@H](CC)Cc1ccc(Cl)cc1Cl ZINC000414981040 263180203 /nfs/dbraw/zinc/18/02/03/263180203.db2.gz BGFCLMKETYKBKC-STQMWFEESA-N 1 3 289.250 3.641 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](CNCc2cccc(Cl)c2Cl)C1 ZINC000414985938 263183064 /nfs/dbraw/zinc/18/30/64/263183064.db2.gz BWJQMCXDPQAUIH-ZYHUDNBSSA-N 1 3 287.234 3.601 20 0 CHADHO [NH3+]C1C[C@H]2CC[C@@H](C1)C2NCc1c(Cl)cccc1Cl ZINC000414986035 263183242 /nfs/dbraw/zinc/18/32/42/263183242.db2.gz HBPLIHFTPQNWDU-SWKMLJDHSA-N 1 3 299.245 3.599 20 0 CHADHO CCC[C@@H](CC)[NH2+]C[C@@H]1CNCC[C@@H]1c1ccc(F)cc1 ZINC000415005697 263215778 /nfs/dbraw/zinc/21/57/78/263215778.db2.gz POUXMZCRUWYBSW-CGTJXYLNSA-N 1 3 292.442 3.687 20 0 CHADHO Cc1oc2ccccc2c1CN1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000415060913 263258588 /nfs/dbraw/zinc/25/85/88/263258588.db2.gz ZKSRWCQSJOPLOL-QAPCUYQASA-N 1 3 298.430 3.705 20 0 CHADHO Cc1ccc(F)c(CN[C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000415054307 263258766 /nfs/dbraw/zinc/25/87/66/263258766.db2.gz NEPWSVPXAOHRTK-SFHVURJKSA-N 1 3 286.394 3.704 20 0 CHADHO Cc1ccc(CN[C@H](CCC[NH3+])c2ccccc2)c(C)c1 ZINC000415069623 263259553 /nfs/dbraw/zinc/25/95/53/263259553.db2.gz SQWFEKDYAOBAIO-LJQANCHMSA-N 1 3 282.431 3.873 20 0 CHADHO c1ccc(C(C[NH2+][C@@H]2CCCNCC2)c2ccccc2)cc1 ZINC000415075453 263263635 /nfs/dbraw/zinc/26/36/35/263263635.db2.gz BKKZCMDPBIRGFP-LJQANCHMSA-N 1 3 294.442 3.550 20 0 CHADHO c1ccc(C(CN[C@@H]2CCC[NH2+]CC2)c2ccccc2)cc1 ZINC000415075453 263263637 /nfs/dbraw/zinc/26/36/37/263263637.db2.gz BKKZCMDPBIRGFP-LJQANCHMSA-N 1 3 294.442 3.550 20 0 CHADHO CC(C)C[C@@H]([NH3+])CNCC(c1ccccc1)c1ccccc1 ZINC000415078158 263267972 /nfs/dbraw/zinc/26/79/72/263267972.db2.gz FQZGRPOHNGUROB-LJQANCHMSA-N 1 3 296.458 3.782 20 0 CHADHO CC(C)([NH3+])CNCCC(c1ccccc1)c1ccccc1 ZINC000415087428 263271257 /nfs/dbraw/zinc/27/12/57/263271257.db2.gz UJEXLFGYUBLXEM-UHFFFAOYSA-N 1 3 282.431 3.536 20 0 CHADHO Cc1ccccc1CN[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415094676 263273421 /nfs/dbraw/zinc/27/34/21/263273421.db2.gz XQDRYMQOCZPIJB-RTBURBONSA-N 1 3 280.415 3.578 20 0 CHADHO CS[C@H]1CC[C@@H]1NCc1cccc(C[N@H+](C)C(C)C)c1 ZINC000425361221 264147309 /nfs/dbraw/zinc/14/73/09/264147309.db2.gz UAJZOOUSUSRAGK-IRXDYDNUSA-N 1 3 292.492 3.510 20 0 CHADHO CS[C@H]1CC[C@@H]1NCc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000425361221 264147310 /nfs/dbraw/zinc/14/73/10/264147310.db2.gz UAJZOOUSUSRAGK-IRXDYDNUSA-N 1 3 292.492 3.510 20 0 CHADHO C[NH+](C)C1CCN([C@@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC000189696478 264322542 /nfs/dbraw/zinc/32/25/42/264322542.db2.gz UBGHWNPLZIJGBQ-RTBURBONSA-N 1 3 286.463 3.523 20 0 CHADHO CCCc1cccc(CN2CCC[C@@H]3C[N@H+](C)CC[C@H]32)c1 ZINC000518837996 265122500 /nfs/dbraw/zinc/12/25/00/265122500.db2.gz GPHVFNSDAQVLRX-RTBURBONSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1cccc(CN2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)c1 ZINC000518837996 265122503 /nfs/dbraw/zinc/12/25/03/265122503.db2.gz GPHVFNSDAQVLRX-RTBURBONSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1cccc(C[N@@H+]2CCC[C@@H]3CN(C)CC[C@H]32)c1 ZINC000518837996 265122506 /nfs/dbraw/zinc/12/25/06/265122506.db2.gz GPHVFNSDAQVLRX-RTBURBONSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1cccc(C[N@H+]2CCC[C@@H]3CN(C)CC[C@H]32)c1 ZINC000518837996 265122508 /nfs/dbraw/zinc/12/25/08/265122508.db2.gz GPHVFNSDAQVLRX-RTBURBONSA-N 1 3 286.463 3.555 20 0 CHADHO CCCCN1CCC([NH2+][C@@H](C)c2cc(F)cc(F)c2)CC1 ZINC000094826881 265259706 /nfs/dbraw/zinc/25/97/06/265259706.db2.gz CYWZOOHVZRCZER-ZDUSSCGKSA-N 1 3 296.405 3.880 20 0 CHADHO Cc1ccc(C2CC(NC3CC([NH+]4CCCCC4)C3)C2)cc1 ZINC000370134119 267294376 /nfs/dbraw/zinc/29/43/76/267294376.db2.gz VKLIMCVTMDGOLJ-UHFFFAOYSA-N 1 3 298.474 3.848 20 0 CHADHO C[C@@H](NCc1ccc(C[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000119547259 267345036 /nfs/dbraw/zinc/34/50/36/267345036.db2.gz SSIVMDZABJWAHT-CQSZACIVSA-N 1 3 286.394 3.738 20 0 CHADHO CSC1(C[NH2+]C2CCN(CC3CCCCC3)CC2)CC1 ZINC000372971811 267621121 /nfs/dbraw/zinc/62/11/21/267621121.db2.gz AWNGOSAHMRMFGA-UHFFFAOYSA-N 1 3 296.524 3.516 20 0 CHADHO CSC1(CNC2CC[NH+](CC3CCCCC3)CC2)CC1 ZINC000372971811 267621123 /nfs/dbraw/zinc/62/11/23/267621123.db2.gz AWNGOSAHMRMFGA-UHFFFAOYSA-N 1 3 296.524 3.516 20 0 CHADHO c1ccc([C@H](CC2CC2)NCCC[NH+]2CCCCC2)cc1 ZINC000531689282 328024320 /nfs/dbraw/zinc/02/43/20/328024320.db2.gz CQLXCPDYRMIECV-IBGZPJMESA-N 1 3 286.463 3.993 20 0 CHADHO C[C@@H](CN[C@@H](c1ccccc1)C1CC1)C[NH+]1CCCCC1 ZINC000041075777 328026588 /nfs/dbraw/zinc/02/65/88/328026588.db2.gz VTOQODKQPKJNRK-LPHOPBHVSA-N 1 3 286.463 3.849 20 0 CHADHO C[C@@H](C[NH2+][C@@H](c1ccccc1)C1CC1)CN1CCCCC1 ZINC000041075777 328026589 /nfs/dbraw/zinc/02/65/89/328026589.db2.gz VTOQODKQPKJNRK-LPHOPBHVSA-N 1 3 286.463 3.849 20 0 CHADHO c1ccc([C@@H](NCCC[NH+]2CCCCC2)C2CC2)cc1 ZINC000041075330 328026621 /nfs/dbraw/zinc/02/66/21/328026621.db2.gz NMQBCBHFDIEVKG-GOSISDBHSA-N 1 3 272.436 3.603 20 0 CHADHO CC[N@@H+]1CC[C@@H](NCc2cc3ccccc3s2)[C@H](C)C1 ZINC000571304576 328101148 /nfs/dbraw/zinc/10/11/48/328101148.db2.gz SMMXWYZKPIEGMN-CZUORRHYSA-N 1 3 288.460 3.721 20 0 CHADHO CC[N@H+]1CC[C@@H](NCc2cc3ccccc3s2)[C@H](C)C1 ZINC000571304576 328101149 /nfs/dbraw/zinc/10/11/49/328101149.db2.gz SMMXWYZKPIEGMN-CZUORRHYSA-N 1 3 288.460 3.721 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1NCc1cc2ccccc2s1 ZINC000268796424 328186153 /nfs/dbraw/zinc/18/61/53/328186153.db2.gz IKZLYWXIZNZKEZ-XJKCOSOUSA-N 1 3 288.460 3.720 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1NCc1cc2ccccc2s1 ZINC000268796424 328186155 /nfs/dbraw/zinc/18/61/55/328186155.db2.gz IKZLYWXIZNZKEZ-XJKCOSOUSA-N 1 3 288.460 3.720 20 0 CHADHO C[C@H](N)[C@H]1CC[N@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC000414655064 328208750 /nfs/dbraw/zinc/20/87/50/328208750.db2.gz CTHCBFGCRYDQSE-GSHBMFQSSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@H](N)[C@H]1CC[N@@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC000414655064 328208752 /nfs/dbraw/zinc/20/87/52/328208752.db2.gz CTHCBFGCRYDQSE-GSHBMFQSSA-N 1 3 286.463 3.630 20 0 CHADHO COc1ccccc1-c1ccc([C@H](C)N(C)CCC[NH3+])cc1 ZINC000414750763 328219045 /nfs/dbraw/zinc/21/90/45/328219045.db2.gz YROGHGOWTBSJQW-HNNXBMFYSA-N 1 3 298.430 3.704 20 0 CHADHO Cc1ccc(-c2cccc(C[NH2+]C3CCNCC3)c2)cc1 ZINC000414781329 328224849 /nfs/dbraw/zinc/22/48/49/328224849.db2.gz CLQTZRFPQZPZCE-UHFFFAOYSA-N 1 3 280.415 3.504 20 0 CHADHO C[C@H](CCC1CCCCC1)[NH2+][C@@H]1CCC[C@H](N)C1 ZINC000414928611 328273357 /nfs/dbraw/zinc/27/33/57/328273357.db2.gz QIWYHDBFDFQNFP-VNQPRFMTSA-N 1 3 252.446 3.595 20 0 CHADHO CC(C)C[C@H]([NH3+])CN[C@H](C)CC(C)(C)c1ccccc1 ZINC000415080337 328302199 /nfs/dbraw/zinc/30/21/99/328302199.db2.gz IXLMMKMAISTDQN-WBVHZDCISA-N 1 3 276.468 3.706 20 0 CHADHO Cc1cc(C)c(CN[C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)c(C)c1 ZINC000415081554 328302317 /nfs/dbraw/zinc/30/23/17/328302317.db2.gz KUNFHGZOBHFJLY-BHIYHBOVSA-N 1 3 286.463 3.622 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@H](C)c1cccc2ccccc21 ZINC000049552003 328371638 /nfs/dbraw/zinc/37/16/38/328371638.db2.gz NPAAAPTVQYYQAA-HUUCEWRRSA-N 1 3 270.420 3.831 20 0 CHADHO CCCc1ccc([C@H](C)N[C@H](C)CC[NH+](C)C)cc1 ZINC000049553348 328371668 /nfs/dbraw/zinc/37/16/68/328371668.db2.gz KSSDKZPWEQCZAG-CABCVRRESA-N 1 3 262.441 3.630 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000049553710 328371807 /nfs/dbraw/zinc/37/18/07/328371807.db2.gz FTBVPXWFXXJXPH-CABCVRRESA-N 1 3 274.452 3.556 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)c1ccc(Cl)cc1 ZINC000531993596 328385910 /nfs/dbraw/zinc/38/59/10/328385910.db2.gz HSFKBZNHZQEALB-MAZHCROVSA-N 1 3 280.843 3.863 20 0 CHADHO [NH3+]CC1CCN(Cc2cccc(Oc3ccccc3)c2)CC1 ZINC000262003540 326998223 /nfs/dbraw/zinc/99/82/23/326998223.db2.gz VNUWIAPWQVTRFF-UHFFFAOYSA-N 1 3 296.414 3.650 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCCN1)c1ccccc1 ZINC000093488476 327123684 /nfs/dbraw/zinc/12/36/84/327123684.db2.gz RHBKXUHYFOHPTB-OQIJWPOYSA-N 1 3 286.463 3.691 20 0 CHADHO Fc1cc(Cl)cc(CNCCCCC[NH+]2CCCC2)c1 ZINC000559328203 327160264 /nfs/dbraw/zinc/16/02/64/327160264.db2.gz IMDZHTAQQLJGSE-UHFFFAOYSA-N 1 3 298.833 3.835 20 0 CHADHO C[C@@H]1CCC[C@@H]([NH+]2CCC(NC3CC(C)(F)C3)CC2)C1 ZINC000449377794 327181256 /nfs/dbraw/zinc/18/12/56/327181256.db2.gz UOIZSQBZAHMIPA-CRYBEJKASA-N 1 3 282.447 3.510 20 0 CHADHO C[C@@H]1CCC[C@@H](N2CCC([NH2+]C3CC(C)(F)C3)CC2)C1 ZINC000449377794 327181258 /nfs/dbraw/zinc/18/12/58/327181258.db2.gz UOIZSQBZAHMIPA-CRYBEJKASA-N 1 3 282.447 3.510 20 0 CHADHO CC1(C)CCC(N[C@@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC000132125958 327185539 /nfs/dbraw/zinc/18/55/39/327185539.db2.gz SYWKDEYDXSYBNV-HZPDHXFCSA-N 1 3 258.409 3.690 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCc1ccc(-c2ccccc2F)s1 ZINC000566230230 327248550 /nfs/dbraw/zinc/24/85/50/327248550.db2.gz SPIVUZSZQJMXHP-RYUDHWBXSA-N 1 3 292.423 3.770 20 0 CHADHO Cc1ccccc1C[C@H]([NH2+]CCCN(C)C(C)C)C1CC1 ZINC000560247321 327293520 /nfs/dbraw/zinc/29/35/20/327293520.db2.gz MHKRAWMJORUDCB-IBGZPJMESA-N 1 3 288.479 3.636 20 0 CHADHO CCCN(CC[C@@H]1CCCC[N@@H+]1C)Cc1ccccc1 ZINC000560742649 327340439 /nfs/dbraw/zinc/34/04/39/327340439.db2.gz AICSGGYPJKZREK-SFHVURJKSA-N 1 3 274.452 3.773 20 0 CHADHO CCCN(CC[C@@H]1CCCC[N@H+]1C)Cc1ccccc1 ZINC000560742649 327340441 /nfs/dbraw/zinc/34/04/41/327340441.db2.gz AICSGGYPJKZREK-SFHVURJKSA-N 1 3 274.452 3.773 20 0 CHADHO CCCC[C@H](C)[C@H](C)[NH2+][C@@H]1CCC[C@H](N(C)C)C1 ZINC000569884509 327553705 /nfs/dbraw/zinc/55/37/05/327553705.db2.gz TXNRINJTJIJDJH-JONQDZQNSA-N 1 3 254.462 3.664 20 0 CHADHO CC1(C)C[C@@H](NCc2ccc(C[NH3+])cc2)c2ccccc21 ZINC000570515999 327596758 /nfs/dbraw/zinc/59/67/58/327596758.db2.gz GGCHMINYDHCIBA-GOSISDBHSA-N 1 3 280.415 3.658 20 0 CHADHO CC[NH+](CC)C[C@@H]1CCN(CC[C@@H](C)c2ccccc2)C1 ZINC000194012852 329064954 /nfs/dbraw/zinc/06/49/54/329064954.db2.gz HDFOYQUGVGNRRS-MSOLQXFVSA-N 1 3 288.479 3.844 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](CC[C@@H](C)c2ccccc2)C1 ZINC000194012852 329064955 /nfs/dbraw/zinc/06/49/55/329064955.db2.gz HDFOYQUGVGNRRS-MSOLQXFVSA-N 1 3 288.479 3.844 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](CC[C@@H](C)c2ccccc2)C1 ZINC000194012852 329064956 /nfs/dbraw/zinc/06/49/56/329064956.db2.gz HDFOYQUGVGNRRS-MSOLQXFVSA-N 1 3 288.479 3.844 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1C[N@@H+]1CC[C@@H](C2CCN(C)CC2)C1 ZINC000584378547 329307119 /nfs/dbraw/zinc/30/71/19/329307119.db2.gz NYFLATXQIJMOKJ-QXAKKESOSA-N 1 3 290.495 3.643 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1C[N@H+]1CC[C@@H](C2CCN(C)CC2)C1 ZINC000584378547 329307120 /nfs/dbraw/zinc/30/71/20/329307120.db2.gz NYFLATXQIJMOKJ-QXAKKESOSA-N 1 3 290.495 3.643 20 0 CHADHO CC[NH2+]CCCN[C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000583198211 329360199 /nfs/dbraw/zinc/36/01/99/329360199.db2.gz SVFKRLFRJKDSDA-GDBMZVCRSA-N 1 3 280.843 3.565 20 0 CHADHO CCNCCC[NH2+][C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000583198211 329360200 /nfs/dbraw/zinc/36/02/00/329360200.db2.gz SVFKRLFRJKDSDA-GDBMZVCRSA-N 1 3 280.843 3.565 20 0 CHADHO CN(C)Cc1cccc(C[NH2+][C@H]2CCC23CCCC3)c1 ZINC000189052002 329375361 /nfs/dbraw/zinc/37/53/61/329375361.db2.gz PXLKTVGKBRVMHH-KRWDZBQOSA-N 1 3 272.436 3.561 20 0 CHADHO CCN(C)C[C@H]1CC[N@@H+]([C@@H](C)c2ccc3c(c2)CCC3)C1 ZINC000445403229 330110958 /nfs/dbraw/zinc/11/09/58/330110958.db2.gz MNPHHXDUKMVVEZ-JKSUJKDBSA-N 1 3 286.463 3.510 20 0 CHADHO CCN(C)C[C@H]1CC[N@H+]([C@@H](C)c2ccc3c(c2)CCC3)C1 ZINC000445403229 330110960 /nfs/dbraw/zinc/11/09/60/330110960.db2.gz MNPHHXDUKMVVEZ-JKSUJKDBSA-N 1 3 286.463 3.510 20 0 CHADHO c1cc(CN2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)cc(C2CC2)c1 ZINC000422550837 330149021 /nfs/dbraw/zinc/14/90/21/330149021.db2.gz BZTDUNDNWPOYME-RTBURBONSA-N 1 3 284.447 3.528 20 0 CHADHO C[C@H]([NH3+])c1ccc(CNCc2cccc(C3CC3)c2)cc1 ZINC000422554418 330149162 /nfs/dbraw/zinc/14/91/62/330149162.db2.gz MLBOGOJXACGLJV-AWEZNQCLSA-N 1 3 280.415 3.874 20 0 CHADHO Cc1ccc(CN[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c(C)c1 ZINC000422691775 330150866 /nfs/dbraw/zinc/15/08/66/330150866.db2.gz IYGRTDMZVMSHFD-WOJBJXKFSA-N 1 3 294.442 3.886 20 0 CHADHO C[C@H]1CCNCC[C@@H]1[NH2+]CC(C)(C)c1ccccc1Cl ZINC000422714007 330151749 /nfs/dbraw/zinc/15/17/49/330151749.db2.gz QONWDAYTDIXVCJ-BBRMVZONSA-N 1 3 294.870 3.595 20 0 CHADHO C[C@H]1CC[NH2+]CC[C@@H]1NCC(C)(C)c1ccccc1Cl ZINC000422714007 330151750 /nfs/dbraw/zinc/15/17/50/330151750.db2.gz QONWDAYTDIXVCJ-BBRMVZONSA-N 1 3 294.870 3.595 20 0 CHADHO CC[C@@H](Cc1ccccc1)[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000422717960 330152102 /nfs/dbraw/zinc/15/21/02/330152102.db2.gz WGBZGMZKWQLLKI-YOEHRIQHSA-N 1 3 297.446 3.521 20 0 CHADHO CCCC[C@H](N[C@@H](C)C[C@H](C)[NH3+])c1ccc(OC)cc1 ZINC000422717980 330152204 /nfs/dbraw/zinc/15/22/04/330152204.db2.gz WHIPUWQFYNZJLA-ZQIUZPCESA-N 1 3 278.440 3.642 20 0 CHADHO [NH3+][C@H]1CCC[C@@H]1NCCC(c1ccccc1)c1ccccc1 ZINC000422727643 330152309 /nfs/dbraw/zinc/15/23/09/330152309.db2.gz HRWJEMOXNUVSOR-PMACEKPBSA-N 1 3 294.442 3.678 20 0 CHADHO C[C@H](CCC[NH3+])N[C@H](C)c1cc(F)c(Cl)cc1Cl ZINC000422728026 330152413 /nfs/dbraw/zinc/15/24/13/330152413.db2.gz IPWYEFLIZMLBSL-RKDXNWHRSA-N 1 3 293.213 3.911 20 0 CHADHO [NH3+][C@@H]1CCC[C@H]1NCCC(c1ccccc1)c1ccccc1 ZINC000422727646 330152478 /nfs/dbraw/zinc/15/24/78/330152478.db2.gz HRWJEMOXNUVSOR-WOJBJXKFSA-N 1 3 294.442 3.678 20 0 CHADHO C[C@H](CN[C@@H]1C[C@@H]([NH3+])c2ccccc21)c1ccc(F)cc1 ZINC000422739812 330152783 /nfs/dbraw/zinc/15/27/83/330152783.db2.gz LXMGZKJQMNSKOO-NXOUGTEYSA-N 1 3 284.378 3.664 20 0 CHADHO C[C@@H](N[C@H](c1ccc(Cl)cc1)C1CCCC1)C1C[NH2+]C1 ZINC000422746910 330152926 /nfs/dbraw/zinc/15/29/26/330152926.db2.gz XNBPABYFHONOKZ-PXAZEXFGSA-N 1 3 292.854 3.769 20 0 CHADHO C[C@H](N[C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccc2ccccc2c1 ZINC000422749598 330153284 /nfs/dbraw/zinc/15/32/84/330153284.db2.gz ZVIYJEOEKVXFAH-YZVOILCLSA-N 1 3 282.431 3.879 20 0 CHADHO C[C@H](N[C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1cccs1 ZINC000422766237 330153963 /nfs/dbraw/zinc/15/39/63/330153963.db2.gz RBCPHVJAWONDDL-CWRNSKLLSA-N 1 3 286.444 3.892 20 0 CHADHO NC[C@H]1CCC[C@H]1[NH2+]CC1(c2cccs2)CCCCC1 ZINC000422767939 330154248 /nfs/dbraw/zinc/15/42/48/330154248.db2.gz NHZOBVHGYJHYQR-HUUCEWRRSA-N 1 3 292.492 3.667 20 0 CHADHO CCC[C@H](N[C@H](C)[C@H]1CCC[NH2+]C1)c1ccccc1 ZINC000422771579 330154303 /nfs/dbraw/zinc/15/43/03/330154303.db2.gz WCQOUTBUKKGUEL-PVAVHDDUSA-N 1 3 260.425 3.506 20 0 CHADHO CCC[C@H]([NH2+][C@H](C)[C@H]1CCCNC1)c1ccccc1 ZINC000422771579 330154305 /nfs/dbraw/zinc/15/43/05/330154305.db2.gz WCQOUTBUKKGUEL-PVAVHDDUSA-N 1 3 260.425 3.506 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]CC1(c2cccs2)CCCCC1 ZINC000422772736 330154384 /nfs/dbraw/zinc/15/43/84/330154384.db2.gz XQMYOTZBQDCIBB-KBPBESRZSA-N 1 3 280.481 3.665 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCC1(c2cccs2)CCCCC1 ZINC000422772736 330154385 /nfs/dbraw/zinc/15/43/85/330154385.db2.gz XQMYOTZBQDCIBB-KBPBESRZSA-N 1 3 280.481 3.665 20 0 CHADHO CC[C@@H](C)[C@H]([NH2+]C1CCNCC1)c1ccc(Cl)cc1 ZINC000422788038 330155154 /nfs/dbraw/zinc/15/51/54/330155154.db2.gz VBJLXFQZFQWQKK-WBMJQRKESA-N 1 3 280.843 3.769 20 0 CHADHO Cc1cccc([C@H](C)C[NH2+][C@H](C)c2ccc(CN)nc2C)c1 ZINC000422792039 330155248 /nfs/dbraw/zinc/15/52/48/330155248.db2.gz WSBCXYSKWFKIJM-HUUCEWRRSA-N 1 3 297.446 3.611 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H](c1ccccc1)C(C)C ZINC000422792782 330155574 /nfs/dbraw/zinc/15/55/74/330155574.db2.gz WLAGRTKTTIONFP-KXBFYZLASA-N 1 3 297.446 3.897 20 0 CHADHO CC(C)(C)[C@@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1 ZINC000422826534 330156537 /nfs/dbraw/zinc/15/65/37/330156537.db2.gz CIUHQGFKDYCLEN-WFVVYAPDSA-N 1 3 272.436 3.646 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC[C@@H](C)c1ccccc1 ZINC000422849912 330157559 /nfs/dbraw/zinc/15/75/59/330157559.db2.gz MOEFYJJCDGDCJT-CABCVRRESA-N 1 3 297.446 3.693 20 0 CHADHO C[C@@H](N[C@@H](C)CCCC[NH3+])c1nc(C(C)(C)C)cs1 ZINC000422856518 330157725 /nfs/dbraw/zinc/15/77/25/330157725.db2.gz FOHFOYXRFRGYGN-NWDGAFQWSA-N 1 3 283.485 3.609 20 0 CHADHO [NH3+][C@H]1CCC[C@H]1NCC1(c2ccc(Cl)cc2)CCCC1 ZINC000422882329 330158999 /nfs/dbraw/zinc/15/89/99/330158999.db2.gz RXAHXCGQXWQJNK-JKSUJKDBSA-N 1 3 292.854 3.621 20 0 CHADHO C[C@H]([NH3+])[C@H](Cc1ccccc1)N[C@H]1C[C@H]1C1CCCCC1 ZINC000422917529 330160462 /nfs/dbraw/zinc/16/04/62/330160462.db2.gz GDBWDDZVPHVDBF-QZHFEQFPSA-N 1 3 286.463 3.503 20 0 CHADHO N[C@@H]1C[C@@H]([NH2+]CCc2cc3ccccc3o2)c2ccccc21 ZINC000422923901 330160671 /nfs/dbraw/zinc/16/06/71/330160671.db2.gz SYFMXFMTCSQGRU-QZTJIDSGSA-N 1 3 292.382 3.710 20 0 CHADHO C[C@H](CCCC[NH3+])NCc1nc2cc(Cl)ccc2s1 ZINC000422899659 330161943 /nfs/dbraw/zinc/16/19/43/330161943.db2.gz HZPMNBVDHOFPQS-SNVBAGLBSA-N 1 3 297.855 3.557 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@@H]1NCCc1ccc2ccccc2c1 ZINC000422950980 330163867 /nfs/dbraw/zinc/16/38/67/330163867.db2.gz ZHDZWLVNSQIWHU-MOPGFXCFSA-N 1 3 282.431 3.632 20 0 CHADHO c1ccc(C2CC(N[C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)C2)cc1 ZINC000422968669 330164581 /nfs/dbraw/zinc/16/45/81/330164581.db2.gz RTRBKUSCIKASKP-WFAGLZIHSA-N 1 3 298.474 3.833 20 0 CHADHO c1ccc([C@H](CC2CCCC2)[NH2+]C2CCNCC2)cc1 ZINC000423005621 330164784 /nfs/dbraw/zinc/16/47/84/330164784.db2.gz SNPFACUHEOPQMY-SFHVURJKSA-N 1 3 272.436 3.650 20 0 CHADHO C[C@@H](N[C@H]1CC[C@@H](C)c2ccccc21)[C@H]1CCC[NH2+]C1 ZINC000423005410 330164951 /nfs/dbraw/zinc/16/49/51/330164951.db2.gz RZTCMMGZRKFMHP-BSXFFOKHSA-N 1 3 272.436 3.603 20 0 CHADHO C[C@@H]([NH2+][C@H]1CC[C@@H](C)c2ccccc21)[C@H]1CCCNC1 ZINC000423005410 330164953 /nfs/dbraw/zinc/16/49/53/330164953.db2.gz RZTCMMGZRKFMHP-BSXFFOKHSA-N 1 3 272.436 3.603 20 0 CHADHO C[C@@H]1CC[C@H](N[C@@H]2CC[NH2+]CC[C@H]2C)c2ccccc21 ZINC000423004505 330164971 /nfs/dbraw/zinc/16/49/71/330164971.db2.gz PGXHPVSSODKTCW-DTDBQYNISA-N 1 3 272.436 3.603 20 0 CHADHO C[C@H]([NH2+]C1CCC(c2ccc(F)cc2)CC1)[C@H]1CCCN1 ZINC000423027067 330165904 /nfs/dbraw/zinc/16/59/04/330165904.db2.gz CVCSWZTZZDUXJM-SMRZUVACSA-N 1 3 290.426 3.582 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]C1CCC(c2ccc(F)cc2)CC1 ZINC000423037481 330166416 /nfs/dbraw/zinc/16/64/16/330166416.db2.gz WBCMTTXIAXOEFL-CFUBCSQMSA-N 1 3 278.415 3.567 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+][C@@H](C)C1(c2ccccc2)CCCC1 ZINC000423048115 330166972 /nfs/dbraw/zinc/16/69/72/330166972.db2.gz HRGKZECHMVUPEQ-XHSDSOJGSA-N 1 3 274.452 3.602 20 0 CHADHO C[C@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)C1(c2ccccc2)CCCC1 ZINC000423052724 330167355 /nfs/dbraw/zinc/16/73/55/330167355.db2.gz QJUKLVTZTKFSAE-UBLGTCEWSA-N 1 3 298.474 3.760 20 0 CHADHO CC(C)[C@@H](CC(F)(F)F)N[C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000423059124 330167795 /nfs/dbraw/zinc/16/77/95/330167795.db2.gz LESWOBBJRLEBGB-HZSPNIEDSA-N 1 3 294.405 3.864 20 0 CHADHO C[C@H](N[C@@H](C)[C@@H]1CCC[NH2+]C1)c1cc2ccccc2s1 ZINC000423063220 330168075 /nfs/dbraw/zinc/16/80/75/330168075.db2.gz WAHNGQMGLQRNDK-KCQAQPDRSA-N 1 3 288.460 3.940 20 0 CHADHO C[C@H]([NH2+][C@@H](C)[C@@H]1CCCNC1)c1cc2ccccc2s1 ZINC000423063220 330168076 /nfs/dbraw/zinc/16/80/76/330168076.db2.gz WAHNGQMGLQRNDK-KCQAQPDRSA-N 1 3 288.460 3.940 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]C1CCC2(CCCCC2)CC1 ZINC000423076777 330168562 /nfs/dbraw/zinc/16/85/62/330168562.db2.gz ZSOBFDHLPISNEB-UONOGXRCSA-N 1 3 252.446 3.595 20 0 CHADHO C[C@H]1CCNCC[C@H]1[NH2+][C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423100314 330170082 /nfs/dbraw/zinc/17/00/82/330170082.db2.gz VDAQLXCCIQAZMO-ZFZWDLNGSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@H]1CC[NH2+]CC[C@H]1N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423100314 330170083 /nfs/dbraw/zinc/17/00/83/330170083.db2.gz VDAQLXCCIQAZMO-ZFZWDLNGSA-N 1 3 292.854 3.564 20 0 CHADHO CC1(c2ccccc2)CC(N[C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000423102168 330170137 /nfs/dbraw/zinc/17/01/37/330170137.db2.gz OEFXCLGWBSTMJX-RWSSSABPSA-N 1 3 298.474 3.617 20 0 CHADHO C[C@@H]1CCNCC[C@@H]1[NH2+][C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423100313 330170248 /nfs/dbraw/zinc/17/02/48/330170248.db2.gz VDAQLXCCIQAZMO-WNOSKKOXSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@@H]1CC[NH2+]CC[C@@H]1N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423100313 330170249 /nfs/dbraw/zinc/17/02/49/330170249.db2.gz VDAQLXCCIQAZMO-WNOSKKOXSA-N 1 3 292.854 3.564 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000423105665 330170406 /nfs/dbraw/zinc/17/04/06/330170406.db2.gz ZEDLKBWCIXUPHU-HOSILWTGSA-N 1 3 289.467 3.572 20 0 CHADHO C[C@@H](C[C@@H]1CCCCC[NH2+]1)NCCc1cccc2[nH]ccc21 ZINC000423116842 330171194 /nfs/dbraw/zinc/17/11/94/330171194.db2.gz RSSFEDSJZFOZAD-RDJZCZTQSA-N 1 3 299.462 3.611 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NC[C@H](c2ccccc2)C2CC2)c2ccccc21 ZINC000423123512 330171231 /nfs/dbraw/zinc/17/12/31/330171231.db2.gz FCCQLJYHHWJEHF-VAMGGRTRSA-N 1 3 292.426 3.915 20 0 CHADHO c1ccc([C@H](CN[C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)C2CC2)cc1 ZINC000423122789 330171370 /nfs/dbraw/zinc/17/13/70/330171370.db2.gz CZULOODJUZLJSF-LWYYNNOASA-N 1 3 298.474 3.691 20 0 CHADHO C=Cc1ccc(CCN[C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000423133286 330171807 /nfs/dbraw/zinc/17/18/07/330171807.db2.gz CRWUBTXESCFLQH-VAMGGRTRSA-N 1 3 298.474 3.773 20 0 CHADHO C=Cc1ccc(CC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCCN2)cc1 ZINC000423133286 330171808 /nfs/dbraw/zinc/17/18/08/330171808.db2.gz CRWUBTXESCFLQH-VAMGGRTRSA-N 1 3 298.474 3.773 20 0 CHADHO C[C@H](N[C@@H]1CCC[NH2+]CC1)c1ccc(F)c2ccccc21 ZINC000423137152 330172253 /nfs/dbraw/zinc/17/22/53/330172253.db2.gz ZSVIVMCWPBQUGB-UONOGXRCSA-N 1 3 286.394 3.772 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+]CCc1cc2ccccc2s1 ZINC000423138055 330172308 /nfs/dbraw/zinc/17/23/08/330172308.db2.gz RXHFYUXEXBOCCY-HOCLYGCPSA-N 1 3 288.460 3.551 20 0 CHADHO NC[C@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423142553 330172510 /nfs/dbraw/zinc/17/25/10/330172510.db2.gz ANEQGSREAJBTEL-WBOJAVRRSA-N 1 3 292.854 3.693 20 0 CHADHO CCC[C@H]([NH2+][C@@H](C)c1ccc(CN)nc1C)C1CCCC1 ZINC000423169035 330174127 /nfs/dbraw/zinc/17/41/27/330174127.db2.gz IPTOQCNYSFKCQU-KSSFIOAISA-N 1 3 289.467 3.858 20 0 CHADHO CC[C@@H]1CCCC[C@H]1C[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000423166532 330174279 /nfs/dbraw/zinc/17/42/79/330174279.db2.gz ZKKFDOHFQYFMAO-BMFZPTHFSA-N 1 3 289.467 3.716 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@@H](c2cccc(Cl)c2)C1)C1CNC1 ZINC000423170773 330174422 /nfs/dbraw/zinc/17/44/22/330174422.db2.gz YUSQGCXGKWRRMW-QEORTHHSSA-N 1 3 292.854 3.564 20 0 CHADHO N[C@@H]1CCCCC[C@H]1[NH2+][C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000423172174 330174520 /nfs/dbraw/zinc/17/45/20/330174520.db2.gz RREDUPNXZUJVLI-JUDXGUMMSA-N 1 3 296.817 3.585 20 0 CHADHO N[C@H]1CCCCC[C@@H]1[NH2+][C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000423172176 330174538 /nfs/dbraw/zinc/17/45/38/330174538.db2.gz RREDUPNXZUJVLI-SDJAHQOYSA-N 1 3 296.817 3.585 20 0 CHADHO NC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000423177304 330174988 /nfs/dbraw/zinc/17/49/88/330174988.db2.gz HBSVXEHRKXKYCJ-OTRWWLKZSA-N 1 3 292.854 3.693 20 0 CHADHO NC1(C[NH2+][C@H](c2ccc(F)cc2)C2CC2)CCCCC1 ZINC000423176805 330175044 /nfs/dbraw/zinc/17/50/44/330175044.db2.gz HYNZTTPEDIGERN-INIZCTEOSA-N 1 3 276.399 3.528 20 0 CHADHO c1ccc2c(c1)sc1c2CCC[C@@H]1NC1CC[NH2+]CC1 ZINC000423176702 330175061 /nfs/dbraw/zinc/17/50/61/330175061.db2.gz CQPMXMIUQOGJLR-HNNXBMFYSA-N 1 3 286.444 3.620 20 0 CHADHO c1ccc2c(c1)sc1c2CCC[C@@H]1[NH2+]C1CCNCC1 ZINC000423176702 330175062 /nfs/dbraw/zinc/17/50/62/330175062.db2.gz CQPMXMIUQOGJLR-HNNXBMFYSA-N 1 3 286.444 3.620 20 0 CHADHO [NH3+]CCCN[C@H](Cc1ccccc1Cl)c1cccs1 ZINC000423192145 330175911 /nfs/dbraw/zinc/17/59/11/330175911.db2.gz PPBBEOZFOVBVLE-CQSZACIVSA-N 1 3 294.851 3.624 20 0 CHADHO [NH3+]CCCN[C@@H](Cc1ccccc1Cl)c1cccs1 ZINC000423192144 330176118 /nfs/dbraw/zinc/17/61/18/330176118.db2.gz PPBBEOZFOVBVLE-AWEZNQCLSA-N 1 3 294.851 3.624 20 0 CHADHO Clc1ccc([C@@H]2CC[C@H]([NH2+]C[C@@H]3CCCNC3)C2)cc1 ZINC000423202650 330176766 /nfs/dbraw/zinc/17/67/66/330176766.db2.gz BINDCLIXHVZFKM-UNEWFSDZSA-N 1 3 292.854 3.565 20 0 CHADHO CC(C)[C@@H]1C[C@H](N[C@@H](C)[C@@H]2CCC[NH2+]C2)c2ccccc21 ZINC000423206301 330177468 /nfs/dbraw/zinc/17/74/68/330177468.db2.gz BRWQXPMFISCLDO-QXGSTGNESA-N 1 3 286.463 3.849 20 0 CHADHO C[C@@H](N[C@H]1CC[C@@H](C)c2ccsc21)[C@H]1CCC[NH2+]C1 ZINC000423209969 330177601 /nfs/dbraw/zinc/17/76/01/330177601.db2.gz FQYDVOVESRWIJL-CXTNEJHOSA-N 1 3 278.465 3.664 20 0 CHADHO C[C@@H]([NH2+][C@H]1CC[C@@H](C)c2ccsc21)[C@H]1CCCNC1 ZINC000423209969 330177602 /nfs/dbraw/zinc/17/76/02/330177602.db2.gz FQYDVOVESRWIJL-CXTNEJHOSA-N 1 3 278.465 3.664 20 0 CHADHO CC(C)[C@H](CCc1ccc(Cl)cc1)[NH2+]CC[C@H](C)N ZINC000423223065 330179757 /nfs/dbraw/zinc/17/97/57/330179757.db2.gz DREYZZYAPXXQIH-BBRMVZONSA-N 1 3 282.859 3.624 20 0 CHADHO C[C@H](N)CC[NH2+][C@H]1CCC[C@H](c2ccc(Cl)cc2)C1 ZINC000423225572 330180067 /nfs/dbraw/zinc/18/00/67/330180067.db2.gz NGOUJUZLJLTDAA-NOLJZWGESA-N 1 3 280.843 3.693 20 0 CHADHO C[C@H]([NH3+])CCN[C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423224630 330180172 /nfs/dbraw/zinc/18/01/72/330180172.db2.gz JQHLXEASRDPOKZ-NHYWBVRUSA-N 1 3 266.816 3.508 20 0 CHADHO CCC[C@H](N[C@@H]1CCCC[C@H]1C[NH3+])c1ccsc1 ZINC000423279918 330185415 /nfs/dbraw/zinc/18/54/15/330185415.db2.gz SBZOYXAIKAJQJF-AEGPPILISA-N 1 3 266.454 3.696 20 0 CHADHO C[C@H](N[C@H]1CCCC[C@@H]1C[NH3+])c1csc(Cl)c1 ZINC000423278979 330185502 /nfs/dbraw/zinc/18/55/02/330185502.db2.gz QPRYHENTJQROJB-UMNHJUIQSA-N 1 3 272.845 3.570 20 0 CHADHO CC(C)(N)C[NH2+][C@@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423283240 330185694 /nfs/dbraw/zinc/18/56/94/330185694.db2.gz FAZKORXNBARELA-AWEZNQCLSA-N 1 3 266.816 3.508 20 0 CHADHO C[C@H]([NH2+]CC(C)(C)N)c1ccc(-c2ccccc2)cc1 ZINC000423282164 330185712 /nfs/dbraw/zinc/18/57/12/330185712.db2.gz CDDKGVKYXRYXLA-AWEZNQCLSA-N 1 3 268.404 3.742 20 0 CHADHO CC[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1cccc(OC)c1 ZINC000423288973 330186375 /nfs/dbraw/zinc/18/63/75/330186375.db2.gz AEVQWHOZBHXDKT-KUHUBIRLSA-N 1 3 298.430 3.956 20 0 CHADHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1cccc(F)c1 ZINC000423289878 330186548 /nfs/dbraw/zinc/18/65/48/330186548.db2.gz BVYBNEXTLIRYHK-QWHCGFSZSA-N 1 3 272.367 3.696 20 0 CHADHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccsc1 ZINC000423290505 330186853 /nfs/dbraw/zinc/18/68/53/330186853.db2.gz DHLKSJFMEYWKPM-NWDGAFQWSA-N 1 3 260.406 3.619 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@H]2CCc3cc(F)ccc32)cc1 ZINC000423291842 330187522 /nfs/dbraw/zinc/18/75/22/330187522.db2.gz KBEUHXZISQGVCM-SGTLLEGYSA-N 1 3 284.378 3.623 20 0 CHADHO CC(C)C[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccccn1 ZINC000423292013 330187529 /nfs/dbraw/zinc/18/75/29/330187529.db2.gz KYFDNBMGLRPEGK-BEFAXECRSA-N 1 3 297.446 3.978 20 0 CHADHO CCC([NH3+])(CC)CN[C@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000423293522 330188034 /nfs/dbraw/zinc/18/80/34/330188034.db2.gz RPROMUGPLCMDNO-CVEARBPZSA-N 1 3 289.467 3.523 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2CCc3c2cccc3F)cc1 ZINC000423295000 330188340 /nfs/dbraw/zinc/18/83/40/330188340.db2.gz WAYDCUGNSROIDT-KPZWWZAWSA-N 1 3 284.378 3.623 20 0 CHADHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccccc1 ZINC000423296803 330188695 /nfs/dbraw/zinc/18/86/95/330188695.db2.gz ZWKIAKZAJXVZFI-UONOGXRCSA-N 1 3 254.377 3.557 20 0 CHADHO C[C@@H](C[NH3+])CN[C@H](CCc1ccccc1)c1ccccc1 ZINC000423297577 330188701 /nfs/dbraw/zinc/18/87/01/330188701.db2.gz KWQGGMIURRKVFC-QFBILLFUSA-N 1 3 282.431 3.545 20 0 CHADHO CCCC[C@@H](CN)[NH2+][C@@H](C)c1cc2cccc(OC)c2o1 ZINC000423297041 330188741 /nfs/dbraw/zinc/18/87/41/330188741.db2.gz IMTROVPGDQJSPE-JSGCOSHPSA-N 1 3 290.407 3.610 20 0 CHADHO C[C@@H](C[NH3+])CN[C@@H](CCc1ccccc1)c1ccccc1 ZINC000423297576 330188779 /nfs/dbraw/zinc/18/87/79/330188779.db2.gz KWQGGMIURRKVFC-LPHOPBHVSA-N 1 3 282.431 3.545 20 0 CHADHO CC(C)[C@@H](NC[C@H](C)C[NH3+])c1cccc(C(F)(F)F)c1 ZINC000423300909 330188980 /nfs/dbraw/zinc/18/89/80/330188980.db2.gz SMOGTBUACZRWJJ-BXUZGUMPSA-N 1 3 288.357 3.587 20 0 CHADHO CC(C)Sc1ccc([C@@H](C)[NH2+]C[C@@H](N)C2CC2)cc1 ZINC000423317882 330190138 /nfs/dbraw/zinc/19/01/38/330190138.db2.gz KUCZZZNYBGTMSB-MLGOLLRUSA-N 1 3 278.465 3.575 20 0 CHADHO C[C@H](CN)[NH2+][C@H](Cc1ccccc1Cl)c1ccsc1 ZINC000423322409 330190438 /nfs/dbraw/zinc/19/04/38/330190438.db2.gz IOAWLYYXRGAHNK-IAQYHMDHSA-N 1 3 294.851 3.622 20 0 CHADHO CC(C)Oc1ccc([C@H](C)[NH2+]CC2(N)CCC2)cc1Cl ZINC000423327956 330190862 /nfs/dbraw/zinc/19/08/62/330190862.db2.gz NKQIMGPSOGAEQY-LBPRGKRZSA-N 1 3 296.842 3.659 20 0 CHADHO CC(C)CC[C@H]([NH2+][C@H]1CCN[C@@H](C)C1)C(C)(C)C ZINC000423374695 330190944 /nfs/dbraw/zinc/19/09/44/330190944.db2.gz IABFEPPXDPLTKB-KKUMJFAQSA-N 1 3 254.462 3.567 20 0 CHADHO Clc1cccc([C@@H]2CC[C@@H](NCC[C@H]3CCC[NH2+]3)C2)c1 ZINC000423355545 330193136 /nfs/dbraw/zinc/19/31/36/330193136.db2.gz ICLGJFMNAYVBLN-DJIMGWMZSA-N 1 3 292.854 3.708 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@@H](c3cccc(Cl)c3)C2)C1 ZINC000423359981 330193660 /nfs/dbraw/zinc/19/36/60/330193660.db2.gz DYEVKUBHCYKCIX-MXASKKJJSA-N 1 3 292.854 3.836 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@H](c3cccc(Cl)c3)C2)C1 ZINC000423359982 330193709 /nfs/dbraw/zinc/19/37/09/330193709.db2.gz DYEVKUBHCYKCIX-ORQFMDKSSA-N 1 3 292.854 3.836 20 0 CHADHO CC(C)[C@@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CNC3)C1 ZINC000423364498 330194230 /nfs/dbraw/zinc/19/42/30/330194230.db2.gz AULXNIPPYBPDAF-QAPCUYQASA-N 1 3 272.436 3.594 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCNC[C@@H]1C)c1ccccc1C(C)(C)C ZINC000423363895 330194437 /nfs/dbraw/zinc/19/44/37/330194437.db2.gz CCSKBFBZPCRKGE-GRDNDAEWSA-N 1 3 274.452 3.633 20 0 CHADHO CCC[C@H]([NH2+][C@@H]1CCN[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000423365523 330194778 /nfs/dbraw/zinc/19/47/78/330194778.db2.gz BVTIPIIDXSCJCY-MAZHCROVSA-N 1 3 280.843 3.911 20 0 CHADHO Cc1cccc(CC[C@H](C)[NH2+]Cc2ccc3c(c2)CNC3)c1 ZINC000423371480 330195167 /nfs/dbraw/zinc/19/51/67/330195167.db2.gz GFQACOUMWDFHKJ-INIZCTEOSA-N 1 3 294.442 3.709 20 0 CHADHO COc1ccc2cc([C@H](C)N[C@H]3CCC[C@@H]([NH3+])C3)ccc2c1 ZINC000423372116 330195247 /nfs/dbraw/zinc/19/52/47/330195247.db2.gz GTPKJCNDXPTUJZ-VHSSKADRSA-N 1 3 298.430 3.769 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+][C@@H]1CCN[C@H](C)C1 ZINC000423371317 330195430 /nfs/dbraw/zinc/19/54/30/330195430.db2.gz FJBKJGVCICUFBS-LMOYCYGVSA-N 1 3 280.843 3.562 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@H](C)N[C@@H]1CC[NH2+][C@H](C)C1 ZINC000423371317 330195432 /nfs/dbraw/zinc/19/54/32/330195432.db2.gz FJBKJGVCICUFBS-LMOYCYGVSA-N 1 3 280.843 3.562 20 0 CHADHO c1ccc([C@@H](NCc2ccc3c(c2)C[NH2+]C3)C2CC2)cc1 ZINC000423398901 330195891 /nfs/dbraw/zinc/19/58/91/330195891.db2.gz UIYXYXLXIYMHDS-LJQANCHMSA-N 1 3 278.399 3.531 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@@H]1N[C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423399494 330195897 /nfs/dbraw/zinc/19/58/97/330195897.db2.gz POECMFKQHGWHTE-DQYPLSBCSA-N 1 3 292.854 3.769 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423399494 330195898 /nfs/dbraw/zinc/19/58/98/330195898.db2.gz POECMFKQHGWHTE-DQYPLSBCSA-N 1 3 292.854 3.769 20 0 CHADHO C[C@H](N[C@@H]1CC[NH2+]C[C@@H]1C)c1ccc(F)c2ccccc21 ZINC000423397657 330195937 /nfs/dbraw/zinc/19/59/37/330195937.db2.gz OIIUREAGEDVUPK-ZJNRKIDTSA-N 1 3 286.394 3.628 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCNC[C@@H]1C)c1ccc(F)c2ccccc21 ZINC000423397657 330195938 /nfs/dbraw/zinc/19/59/38/330195938.db2.gz OIIUREAGEDVUPK-ZJNRKIDTSA-N 1 3 286.394 3.628 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@H](N)C1)C1(c2ccccc2)CCCC1 ZINC000423400460 330196015 /nfs/dbraw/zinc/19/60/15/330196015.db2.gz VKUPJTBWTMQVSO-RYQLBKOJSA-N 1 3 286.463 3.746 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)N[C@@H]1CC[NH2+]C[C@H]1C ZINC000423401991 330196216 /nfs/dbraw/zinc/19/62/16/330196216.db2.gz RCMLIJODYBOMEO-NXHRZFHOSA-N 1 3 274.452 3.670 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)[NH2+][C@@H]1CCNC[C@H]1C ZINC000423401991 330196217 /nfs/dbraw/zinc/19/62/17/330196217.db2.gz RCMLIJODYBOMEO-NXHRZFHOSA-N 1 3 274.452 3.670 20 0 CHADHO C[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)c1cc2c(s1)CCCC2 ZINC000423402991 330196322 /nfs/dbraw/zinc/19/63/22/330196322.db2.gz WWSJCJJYOIPZPQ-YUTCNCBUSA-N 1 3 278.465 3.547 20 0 CHADHO CC(C)[C@H]([NH2+]Cc1ccc2c(c1)CNC2)c1ccccc1 ZINC000423403901 330196335 /nfs/dbraw/zinc/19/63/35/330196335.db2.gz XKDODHPOIQTENO-IBGZPJMESA-N 1 3 280.415 3.777 20 0 CHADHO Cc1cc2c(cc1C)[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)CCS2 ZINC000423406168 330196685 /nfs/dbraw/zinc/19/66/85/330196685.db2.gz YRFZSAPVRIZPLY-SQWLQELKSA-N 1 3 290.476 3.700 20 0 CHADHO CC[C@H](N[C@@H]1CCC[C@@H]([NH3+])C1)c1ccc(OC(F)F)cc1 ZINC000423406082 330196720 /nfs/dbraw/zinc/19/67/20/330196720.db2.gz YKTQIASOKDGXLI-NFAWXSAZSA-N 1 3 298.377 3.599 20 0 CHADHO C[C@@H]1[C@H]([NH2+]Cc2ccc3c(c2)CNC3)C[C@@H]1c1ccccc1 ZINC000423382162 330199356 /nfs/dbraw/zinc/19/93/56/330199356.db2.gz JXNPWMIKWKENFT-PNHOKKKMSA-N 1 3 292.426 3.572 20 0 CHADHO CC[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1cccc(F)c1 ZINC000423386582 330199545 /nfs/dbraw/zinc/19/95/45/330199545.db2.gz LXRCIXJAYYXYRN-GOSISDBHSA-N 1 3 284.378 3.670 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+]C2CCC3(CCCCC3)CC2)CCN1 ZINC000423385793 330199780 /nfs/dbraw/zinc/19/97/80/330199780.db2.gz RBEFRMXVSPCQOP-ZBFHGGJFSA-N 1 3 264.457 3.610 20 0 CHADHO Cc1ccc([C@H](N[C@H]2CC[NH2+][C@H](C)C2)C2CCC2)cc1 ZINC000423393569 330200611 /nfs/dbraw/zinc/20/06/11/330200611.db2.gz YUWXGCOWVZNOPI-FHLIZLRMSA-N 1 3 272.436 3.566 20 0 CHADHO Cc1ccc([C@H]([NH2+][C@H]2CCN[C@H](C)C2)C2CCC2)cc1 ZINC000423393569 330200612 /nfs/dbraw/zinc/20/06/12/330200612.db2.gz YUWXGCOWVZNOPI-FHLIZLRMSA-N 1 3 272.436 3.566 20 0 CHADHO CCCC[C@H]1CCC[C@@H]1[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423393611 330200624 /nfs/dbraw/zinc/20/06/24/330200624.db2.gz QPNLIXUYMUCOLB-YJBOKZPZSA-N 1 3 272.436 3.738 20 0 CHADHO Cc1ccc([C@H](N[C@@H]2CC[NH2+][C@H](C)C2)C2CCC2)cc1 ZINC000423393571 330200628 /nfs/dbraw/zinc/20/06/28/330200628.db2.gz YUWXGCOWVZNOPI-ZTFGCOKTSA-N 1 3 272.436 3.566 20 0 CHADHO Cc1ccc([C@H]([NH2+][C@@H]2CCN[C@H](C)C2)C2CCC2)cc1 ZINC000423393571 330200630 /nfs/dbraw/zinc/20/06/30/330200630.db2.gz YUWXGCOWVZNOPI-ZTFGCOKTSA-N 1 3 272.436 3.566 20 0 CHADHO CCCC[C@H]1CCC[C@H]1[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423393609 330200656 /nfs/dbraw/zinc/20/06/56/330200656.db2.gz QPNLIXUYMUCOLB-MAUKXSAKSA-N 1 3 272.436 3.738 20 0 CHADHO C[C@@H]([NH2+][C@@H](CC(C)(C)C)c1ccc(F)cc1)[C@H](C)N ZINC000423432767 330201182 /nfs/dbraw/zinc/20/11/82/330201182.db2.gz BMJZCLRDJCALFT-ZOWXZIJZSA-N 1 3 266.404 3.628 20 0 CHADHO C[C@H](N)[C@H](C)[NH2+][C@@H](C)c1ccc(OCc2ccccc2)cc1 ZINC000423450195 330202955 /nfs/dbraw/zinc/20/29/55/330202955.db2.gz SQNUXXPOMRWULY-JYJNAYRXSA-N 1 3 298.430 3.652 20 0 CHADHO C[C@H](N)[C@H](C)[NH2+][C@@H](C)c1cccc(OCc2ccccc2)c1 ZINC000423453741 330203147 /nfs/dbraw/zinc/20/31/47/330203147.db2.gz YAFXFTZFAFKZIM-JYJNAYRXSA-N 1 3 298.430 3.652 20 0 CHADHO C[C@@H](N)[C@H](C)[NH2+][C@@H](C)c1cccc(OCc2ccccc2)c1 ZINC000423453743 330203215 /nfs/dbraw/zinc/20/32/15/330203215.db2.gz YAFXFTZFAFKZIM-PMPSAXMXSA-N 1 3 298.430 3.652 20 0 CHADHO C[C@@H](NCCC[C@H]1CCC[NH2+]1)c1ccc(F)cc1Cl ZINC000423475458 330205773 /nfs/dbraw/zinc/20/57/73/330205773.db2.gz HZHPXPCSJHBGAH-YPMHNXCESA-N 1 3 284.806 3.662 20 0 CHADHO C[C@H](NCCC[C@@H]1CCC[NH2+]1)c1ccccc1Cl ZINC000423486462 330206734 /nfs/dbraw/zinc/20/67/34/330206734.db2.gz SUOCMTCNFGMIDY-QWHCGFSZSA-N 1 3 266.816 3.523 20 0 CHADHO [NH3+]C[C@@H]1CC[C@@H](N[C@H]2CCc3cc(Cl)cc(Cl)c32)C1 ZINC000423485686 330206748 /nfs/dbraw/zinc/20/67/48/330206748.db2.gz BDGIKLQBNXLGGX-IUPBHXKESA-N 1 3 299.245 3.698 20 0 CHADHO Cc1ccncc1[C@@H](C)N[C@@H](CCC[NH3+])c1ccccc1 ZINC000423497046 330207959 /nfs/dbraw/zinc/20/79/59/330207959.db2.gz FWTDTUDQRODZPN-QAPCUYQASA-N 1 3 283.419 3.521 20 0 CHADHO C[C@H](N[C@H](CCC[NH3+])c1ccccc1)c1ccccc1 ZINC000423504673 330208824 /nfs/dbraw/zinc/20/88/24/330208824.db2.gz NRQSPBZDPFOIFK-MAUKXSAKSA-N 1 3 268.404 3.817 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1)[C@@H]1C[C@H]1C1CC1 ZINC000527691042 330279328 /nfs/dbraw/zinc/27/93/28/330279328.db2.gz KRPASNXYEMJJRW-FVUVGQSESA-N 1 3 290.495 3.664 20 0 CHADHO Cc1cccc([C@H]([NH2+]CC2=CCN(C)CC2)C(C)C)c1 ZINC000527876412 330291313 /nfs/dbraw/zinc/29/13/13/330291313.db2.gz NGDQLXFAYMEBII-GOSISDBHSA-N 1 3 272.436 3.544 20 0 CHADHO Cc1ccc2c(c1)[C@@H](NCc1ccc(C[NH+](C)C)cc1)CC2 ZINC000106479663 330338553 /nfs/dbraw/zinc/33/85/53/330338553.db2.gz HRIBVSIKUSGLHR-FQEVSTJZSA-N 1 3 294.442 3.834 20 0 CHADHO CC(C)(C)C1CCC([NH2+][C@H]2CCN3CCC[C@@H]3C2)CC1 ZINC000106868909 330341522 /nfs/dbraw/zinc/34/15/22/330341522.db2.gz LZTKVVINMWYDFB-SJJHQCBESA-N 1 3 278.484 3.808 20 0 CHADHO C1CC1[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@H]2[C@H]2CCCCN2)C1 ZINC000424370038 330348334 /nfs/dbraw/zinc/34/83/34/330348334.db2.gz DFRRQRIMFJSBGM-ICBNADEASA-N 1 3 290.495 3.856 20 0 CHADHO Cc1cc(F)ccc1CN1CCC(CCC[NH+](C)C)CC1 ZINC000537649944 330451719 /nfs/dbraw/zinc/45/17/19/330451719.db2.gz QNLHOZPZECMITE-UHFFFAOYSA-N 1 3 292.442 3.688 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000436276931 330672871 /nfs/dbraw/zinc/67/28/71/330672871.db2.gz VSONNHYLKDJVBV-QZTJIDSGSA-N 1 3 274.452 3.644 20 0 CHADHO CN(C)[C@H]1CCC[N@H+](CC/C=C\c2ccccc2)CC1 ZINC000450853328 331002954 /nfs/dbraw/zinc/00/29/54/331002954.db2.gz HKXRDUDUPGMSON-SNMSSPIJSA-N 1 3 272.436 3.506 20 0 CHADHO CN(C)[C@H]1CCC[N@@H+](CC/C=C\c2ccccc2)CC1 ZINC000450853328 331002955 /nfs/dbraw/zinc/00/29/55/331002955.db2.gz HKXRDUDUPGMSON-SNMSSPIJSA-N 1 3 272.436 3.506 20 0 CHADHO C[NH+](C)[C@H]1CCCN(CC/C=C\c2ccccc2)CC1 ZINC000450853328 331002956 /nfs/dbraw/zinc/00/29/56/331002956.db2.gz HKXRDUDUPGMSON-SNMSSPIJSA-N 1 3 272.436 3.506 20 0 CHADHO C[C@@H]1CC[C@@H](NC[C@@H]2CC[N@@H+](C3CC3)C2)c2sccc21 ZINC000453076619 331086883 /nfs/dbraw/zinc/08/68/83/331086883.db2.gz JIVCWDKBTGFLFR-DVOMOZLQSA-N 1 3 290.476 3.760 20 0 CHADHO C[C@@H]1CC[C@@H](NC[C@@H]2CC[N@H+](C3CC3)C2)c2sccc21 ZINC000453076619 331086884 /nfs/dbraw/zinc/08/68/84/331086884.db2.gz JIVCWDKBTGFLFR-DVOMOZLQSA-N 1 3 290.476 3.760 20 0 CHADHO CCC[C@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)C1CCC1 ZINC000453107625 331089875 /nfs/dbraw/zinc/08/98/75/331089875.db2.gz LQPBUZGAQHNSKV-RDJZCZTQSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+][C@@H](C2CC2)C2CCC2)C1 ZINC000453178866 331097773 /nfs/dbraw/zinc/09/77/73/331097773.db2.gz UFJZRCNPVNRYQE-CRAIPNDOSA-N 1 3 278.484 3.523 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1N[C@@H]1CCCc2c(F)cccc21 ZINC000453239860 331105711 /nfs/dbraw/zinc/10/57/11/331105711.db2.gz TURVDSCWUMWGNG-XHSVMWQWSA-N 1 3 290.426 3.521 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1N[C@@H]1CCCc2c(F)cccc21 ZINC000453239860 331105712 /nfs/dbraw/zinc/10/57/12/331105712.db2.gz TURVDSCWUMWGNG-XHSVMWQWSA-N 1 3 290.426 3.521 20 0 CHADHO CC(C)C[C@@H]1C[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000459659426 331292677 /nfs/dbraw/zinc/29/26/77/331292677.db2.gz RHBKOMXRFGDNED-CRAIPNDOSA-N 1 3 278.484 3.808 20 0 CHADHO CC(C)C[C@@H]1C[C@H]1NC1CC[NH+](C2CCCCC2)CC1 ZINC000459659426 331292678 /nfs/dbraw/zinc/29/26/78/331292678.db2.gz RHBKOMXRFGDNED-CRAIPNDOSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@@H]1CCC[C@H](N2CCC([NH2+][C@@H]3CCC[C@@H]4C[C@@H]43)CC2)C1 ZINC000459751690 331298490 /nfs/dbraw/zinc/29/84/90/331298490.db2.gz ICYZVQJTEIYOLB-VKSUQKOCSA-N 1 3 290.495 3.808 20 0 CHADHO C[C@H]([NH3+])C1CCN(Cc2ccc(C(C)(C)C)s2)CC1 ZINC000166172607 331306569 /nfs/dbraw/zinc/30/65/69/331306569.db2.gz JMOIOLIMWGOSEB-LBPRGKRZSA-N 1 3 280.481 3.605 20 0 CHADHO c1cc(C2CCCC2)ccc1CNC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000462795059 331329416 /nfs/dbraw/zinc/32/94/16/331329416.db2.gz MDXCRJDUOGYJIQ-KRWDZBQOSA-N 1 3 298.474 3.918 20 0 CHADHO c1cc(C2CCCC2)ccc1CNC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000462795059 331329417 /nfs/dbraw/zinc/32/94/17/331329417.db2.gz MDXCRJDUOGYJIQ-KRWDZBQOSA-N 1 3 298.474 3.918 20 0 CHADHO c1cc(C2CCCC2)ccc1C[NH2+]C[C@@H]1CCN(C2CC2)C1 ZINC000462795059 331329418 /nfs/dbraw/zinc/32/94/18/331329418.db2.gz MDXCRJDUOGYJIQ-KRWDZBQOSA-N 1 3 298.474 3.918 20 0 CHADHO C[C@@H]1CCC[C@H](N2CCC([NH2+]CCC3(C)CC3)CC2)C1 ZINC000475207412 331618170 /nfs/dbraw/zinc/61/81/70/331618170.db2.gz AKYLKHKAZIMHGG-WBVHZDCISA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)(C[NH2+][C@@H]1CCCC[C@@H]1C1CC1)CN1CCCC1 ZINC000477942186 331695061 /nfs/dbraw/zinc/69/50/61/331695061.db2.gz SVQMLENUUZZCTI-IAGOWNOFSA-N 1 3 278.484 3.667 20 0 CHADHO C[C@H](CC[NH2+][C@@H]1CCC[C@H]1CCCF)N1CCCCC1 ZINC000511030651 332924966 /nfs/dbraw/zinc/92/49/66/332924966.db2.gz OOKGYAYKIADORC-IXDOHACOSA-N 1 3 284.463 3.759 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]([NH2+][C@H]3CCN4CCC[C@@H]4C3)C2)cc1 ZINC000488364962 332002226 /nfs/dbraw/zinc/00/22/26/332002226.db2.gz ICXIXLMEUNXKON-FUMNGEBKSA-N 1 3 298.474 3.929 20 0 CHADHO c1ccc([C@@H]2CCC[C@H](N[C@H]3CC[N@@H+]4CCC[C@@H]4C3)C2)cc1 ZINC000488364962 332002227 /nfs/dbraw/zinc/00/22/27/332002227.db2.gz ICXIXLMEUNXKON-FUMNGEBKSA-N 1 3 298.474 3.929 20 0 CHADHO c1ccc([C@@H]2CCC[C@H](N[C@H]3CC[N@H+]4CCC[C@@H]4C3)C2)cc1 ZINC000488364962 332002229 /nfs/dbraw/zinc/00/22/29/332002229.db2.gz ICXIXLMEUNXKON-FUMNGEBKSA-N 1 3 298.474 3.929 20 0 CHADHO CC(C)[C@H]1C[C@@H](NCCC[N@H+](C)C2CCCCC2)CS1 ZINC000488419647 332005954 /nfs/dbraw/zinc/00/59/54/332005954.db2.gz HGALUJJZROOULT-NVXWUHKLSA-N 1 3 298.540 3.761 20 0 CHADHO CC(C)[C@H]1C[C@@H](NCCC[N@@H+](C)C2CCCCC2)CS1 ZINC000488419647 332005955 /nfs/dbraw/zinc/00/59/55/332005955.db2.gz HGALUJJZROOULT-NVXWUHKLSA-N 1 3 298.540 3.761 20 0 CHADHO C[C@H]([NH2+]C1CCC2(CC2)CC1)[C@H]1CCCN(C2CCC2)C1 ZINC000488508866 332014581 /nfs/dbraw/zinc/01/45/81/332014581.db2.gz UNYIZGSNWATALE-HOTGVXAUSA-N 1 3 290.495 3.952 20 0 CHADHO C(C1CCCC1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000491060587 332143776 /nfs/dbraw/zinc/14/37/76/332143776.db2.gz LFDCSIOAVXUCRS-GOSISDBHSA-N 1 3 278.484 3.765 20 0 CHADHO C(C1CCCC1)[N@H+]1CCC[C@H](CN2CCCCCC2)C1 ZINC000491060587 332143777 /nfs/dbraw/zinc/14/37/77/332143777.db2.gz LFDCSIOAVXUCRS-GOSISDBHSA-N 1 3 278.484 3.765 20 0 CHADHO C(C1CCCC1)[N@@H+]1CCC[C@H](CN2CCCCCC2)C1 ZINC000491060587 332143779 /nfs/dbraw/zinc/14/37/79/332143779.db2.gz LFDCSIOAVXUCRS-GOSISDBHSA-N 1 3 278.484 3.765 20 0 CHADHO C[N@H+](CCCNC1CC(OC(C)(C)C)C1)C1CCCCC1 ZINC000491271143 332178294 /nfs/dbraw/zinc/17/82/94/332178294.db2.gz MUBRFXTVANUWBB-UHFFFAOYSA-N 1 3 296.499 3.577 20 0 CHADHO C[N@@H+](CCCNC1CC(OC(C)(C)C)C1)C1CCCCC1 ZINC000491271143 332178296 /nfs/dbraw/zinc/17/82/96/332178296.db2.gz MUBRFXTVANUWBB-UHFFFAOYSA-N 1 3 296.499 3.577 20 0 CHADHO C/C(=C/c1ccc(Cl)cc1)CNC[C@@H](C)C[NH+](C)C ZINC000491597880 332242184 /nfs/dbraw/zinc/24/21/84/332242184.db2.gz ZZMFTZDJWZBPEY-RNQWEJQRSA-N 1 3 280.843 3.531 20 0 CHADHO C/C(=C/c1ccc(Cl)cc1)C[NH2+]C[C@@H](C)CN(C)C ZINC000491597880 332242186 /nfs/dbraw/zinc/24/21/86/332242186.db2.gz ZZMFTZDJWZBPEY-RNQWEJQRSA-N 1 3 280.843 3.531 20 0 CHADHO C[C@@H](Cc1ccoc1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000513340834 333014777 /nfs/dbraw/zinc/01/47/77/333014777.db2.gz NZDFGTLRSGLLDR-HNNXBMFYSA-N 1 3 290.451 3.597 20 0 CHADHO C[C@@H](Cc1ccoc1)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000513340834 333014778 /nfs/dbraw/zinc/01/47/78/333014778.db2.gz NZDFGTLRSGLLDR-HNNXBMFYSA-N 1 3 290.451 3.597 20 0 CHADHO CC[C@H](C)[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000310027203 333052941 /nfs/dbraw/zinc/05/29/41/333052941.db2.gz VWQGKXUOUCKLAC-FUHWJXTLSA-N 1 3 274.452 3.677 20 0 CHADHO N[C@H]1CCC[C@H]([NH2+]CC(c2ccccc2)c2ccccc2)C1 ZINC000516877607 333085004 /nfs/dbraw/zinc/08/50/04/333085004.db2.gz IWHIKLZSZOTARG-OALUTQOASA-N 1 3 294.442 3.678 20 0 CHADHO CC(C)C[C@H](C[NH2+][C@@H](C)C[C@H](C)N)c1ccccc1 ZINC000517371885 333098140 /nfs/dbraw/zinc/09/81/40/333098140.db2.gz JWZYDMXITKDJRG-YQQAZPJKSA-N 1 3 262.441 3.532 20 0 CHADHO C[C@@H](CCC1CC1)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000186371552 333159591 /nfs/dbraw/zinc/15/95/91/333159591.db2.gz NDICNVGFKCFJPK-HNNXBMFYSA-N 1 3 278.484 3.952 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@@H]([NH3+])C1)c1ccc(C(F)(F)F)cc1 ZINC000222949830 333202882 /nfs/dbraw/zinc/20/28/82/333202882.db2.gz RJEYASWRWPXBPC-ZLKJLUDKSA-N 1 3 286.341 3.626 20 0 CHADHO C[C@H]([NH3+])[C@H]1CCN([C@@H](C)c2ccc3ccccc3c2)C1 ZINC000226540138 333264456 /nfs/dbraw/zinc/26/44/56/333264456.db2.gz NVGDUAJFFPGGBT-DEYYWGMASA-N 1 3 268.404 3.570 20 0 CHADHO Cc1cccc([C@H](N[C@@H]2CCC[C@H]([NH3+])C2)C(C)C)c1 ZINC000530227517 333529175 /nfs/dbraw/zinc/52/91/75/333529175.db2.gz YNRRACLRZYHMQW-GVDBMIGSSA-N 1 3 260.425 3.552 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1C[NH2+]C1CCN(C2CCCC2)CC1 ZINC000152616186 333787773 /nfs/dbraw/zinc/78/77/73/333787773.db2.gz AHSYFXUSEXFXJU-QFBILLFUSA-N 1 3 290.495 3.975 20 0 CHADHO CC[C@@H](c1ccc(Cl)cc1)N1CCC(CC[NH3+])CC1 ZINC000070183443 333800935 /nfs/dbraw/zinc/80/09/35/333800935.db2.gz TVCWHYZUGBGLLM-INIZCTEOSA-N 1 3 280.843 3.852 20 0 CHADHO CC(C)[NH+]1CCC(N[C@]2(C)CCCc3ccccc32)CC1 ZINC000546581255 334038768 /nfs/dbraw/zinc/03/87/68/334038768.db2.gz LTEPCNQSEORCIC-LJQANCHMSA-N 1 3 286.463 3.701 20 0 CHADHO CCCC[C@H](CC)C[N@@H+]1CC[C@@H]2[C@@H](CCCN2C)C1 ZINC000546930635 334055634 /nfs/dbraw/zinc/05/56/34/334055634.db2.gz KQYQNGCBZOSJPC-YESZJQIVSA-N 1 3 266.473 3.619 20 0 CHADHO CCCC[C@H](CC)C[N@H+]1CC[C@@H]2[C@@H](CCCN2C)C1 ZINC000546930635 334055635 /nfs/dbraw/zinc/05/56/35/334055635.db2.gz KQYQNGCBZOSJPC-YESZJQIVSA-N 1 3 266.473 3.619 20 0 CHADHO C[C@@H]([NH2+]CC1(CN(C)C)CCCC1)c1ccc(F)c(F)c1 ZINC000546932679 334055954 /nfs/dbraw/zinc/05/59/54/334055954.db2.gz YZLOMSXWKOTMNY-CYBMUJFWSA-N 1 3 296.405 3.737 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1C[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000134014920 334077442 /nfs/dbraw/zinc/07/74/42/334077442.db2.gz JXCXAJMUPYGMHK-RDJZCZTQSA-N 1 3 278.484 3.831 20 0 CHADHO C(CN1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1)C1CCCC1 ZINC000134915945 334108275 /nfs/dbraw/zinc/10/82/75/334108275.db2.gz CCDMWHARMYHVBR-AEFFLSMTSA-N 1 3 276.468 3.515 20 0 CHADHO C(CN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)C1CCCC1 ZINC000134915945 334108276 /nfs/dbraw/zinc/10/82/76/334108276.db2.gz CCDMWHARMYHVBR-AEFFLSMTSA-N 1 3 276.468 3.515 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+]([C@@H](C)c2cccc(C)c2)C1 ZINC000081516203 334193788 /nfs/dbraw/zinc/19/37/88/334193788.db2.gz PGBSUJGQNUZRHL-DLBZAZTESA-N 1 3 274.452 3.720 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+]([C@@H](C)c2cccc(C)c2)C1 ZINC000081516203 334193789 /nfs/dbraw/zinc/19/37/89/334193789.db2.gz PGBSUJGQNUZRHL-DLBZAZTESA-N 1 3 274.452 3.720 20 0 CHADHO C1=C[C@@H](N2CCC[C@H]([NH+]3CCCC3)CC2)CCCCC1 ZINC000549464166 334194692 /nfs/dbraw/zinc/19/46/92/334194692.db2.gz LEAPTGPBWSVOGO-MSOLQXFVSA-N 1 3 276.468 3.826 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](C)c2ccc(SC)cc2)C1 ZINC000245467803 334195530 /nfs/dbraw/zinc/19/55/30/334195530.db2.gz SNJMXKWEOCMGMS-CABCVRRESA-N 1 3 292.492 3.791 20 0 CHADHO Fc1c(Cl)cccc1CNCCCCC[NH+]1CCCC1 ZINC000549869210 334207587 /nfs/dbraw/zinc/20/75/87/334207587.db2.gz DYYVADDOFJCQLE-UHFFFAOYSA-N 1 3 298.833 3.835 20 0 CHADHO CC(C)=CCC[C@H](C)[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000246988989 334273629 /nfs/dbraw/zinc/27/36/29/334273629.db2.gz JHKVKTYHVRXUGZ-ARFHVFGLSA-N 1 3 252.446 3.584 20 0 CHADHO C[C@@H]1C[C@H](N[C@H]2CCC(C)(C)c3ccccc32)CC[N@@H+]1C ZINC000245913186 334223876 /nfs/dbraw/zinc/22/38/76/334223876.db2.gz DOHWLYQXHONYAW-RKVPGOIHSA-N 1 3 286.463 3.871 20 0 CHADHO C[C@@H]1C[C@H](N[C@H]2CCC(C)(C)c3ccccc32)CC[N@H+]1C ZINC000245913186 334223878 /nfs/dbraw/zinc/22/38/78/334223878.db2.gz DOHWLYQXHONYAW-RKVPGOIHSA-N 1 3 286.463 3.871 20 0 CHADHO CC(C)(C[NH2+][C@@H]1CCCC12CCCC2)CN1CCCC1 ZINC000551176322 334240093 /nfs/dbraw/zinc/24/00/93/334240093.db2.gz XGSINYYKGGGDIF-MRXNPFEDSA-N 1 3 278.484 3.811 20 0 CHADHO CC(C)C1([NH2+]C2CCN([C@H]3CCC[C@@H](C)C3)CC2)CC1 ZINC000551263339 334243398 /nfs/dbraw/zinc/24/33/98/334243398.db2.gz PWPVXRDJNVZETL-WBVHZDCISA-N 1 3 278.484 3.808 20 0 CHADHO C[C@@H]1CC[C@@H](NC[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc21 ZINC000247080357 334275152 /nfs/dbraw/zinc/27/51/52/334275152.db2.gz OVBOQTJATACSEQ-SPYBWZPUSA-N 1 3 284.447 3.699 20 0 CHADHO C[C@@H]1CC[C@@H](NC[C@H]2CC[N@H+](C3CC3)C2)c2ccccc21 ZINC000247080357 334275154 /nfs/dbraw/zinc/27/51/54/334275154.db2.gz OVBOQTJATACSEQ-SPYBWZPUSA-N 1 3 284.447 3.699 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H]2[C@H](C)CCC[C@@H]2C)C1 ZINC000246890603 334271428 /nfs/dbraw/zinc/27/14/28/334271428.db2.gz DSBLMZVARJDDFT-TWMKSMIVSA-N 1 3 266.473 3.521 20 0 CHADHO C[C@@H](NCCCC[N@@H+]1CCCC[C@@H]1C)c1ccoc1 ZINC000247225175 334277753 /nfs/dbraw/zinc/27/77/53/334277753.db2.gz XYIVZDQAKMXNGZ-LSDHHAIUSA-N 1 3 264.413 3.585 20 0 CHADHO C[C@@H](NCCCC[N@H+]1CCCC[C@@H]1C)c1ccoc1 ZINC000247225175 334277754 /nfs/dbraw/zinc/27/77/54/334277754.db2.gz XYIVZDQAKMXNGZ-LSDHHAIUSA-N 1 3 264.413 3.585 20 0 CHADHO C[C@@H](CN1CC[C@@H](C[NH+]2CCCCC2)C1)c1ccccc1 ZINC000247249397 334278342 /nfs/dbraw/zinc/27/83/42/334278342.db2.gz DVKPGHKEZDFGLP-ROUUACIJSA-N 1 3 286.463 3.598 20 0 CHADHO C[C@@H](C[N@@H+]1CC[C@@H](CN2CCCCC2)C1)c1ccccc1 ZINC000247249397 334278343 /nfs/dbraw/zinc/27/83/43/334278343.db2.gz DVKPGHKEZDFGLP-ROUUACIJSA-N 1 3 286.463 3.598 20 0 CHADHO C[C@@H](C[N@H+]1CC[C@@H](CN2CCCCC2)C1)c1ccccc1 ZINC000247249397 334278345 /nfs/dbraw/zinc/27/83/45/334278345.db2.gz DVKPGHKEZDFGLP-ROUUACIJSA-N 1 3 286.463 3.598 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN([C@H](C)c2ccccc2C)C1 ZINC000248014455 334293632 /nfs/dbraw/zinc/29/36/32/334293632.db2.gz LPDIDHCWKPFNJB-SJORKVTESA-N 1 3 274.452 3.720 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN([C@H](C)c2ccccc2C)C1 ZINC000248014455 334293633 /nfs/dbraw/zinc/29/36/33/334293633.db2.gz LPDIDHCWKPFNJB-SJORKVTESA-N 1 3 274.452 3.720 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2C)C1 ZINC000248014455 334293634 /nfs/dbraw/zinc/29/36/34/334293634.db2.gz LPDIDHCWKPFNJB-SJORKVTESA-N 1 3 274.452 3.720 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+]([C@H](C)c2ccccc2C)C1 ZINC000248014455 334293635 /nfs/dbraw/zinc/29/36/35/334293635.db2.gz LPDIDHCWKPFNJB-SJORKVTESA-N 1 3 274.452 3.720 20 0 CHADHO CC[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@@H]2[C@@H](CCCN2C)C1 ZINC000248157352 334296193 /nfs/dbraw/zinc/29/61/93/334296193.db2.gz RNQSWNDTVRPTIZ-CGTJXYLNSA-N 1 3 290.426 3.693 20 0 CHADHO CC[C@H](c1ccc(F)cc1)[N@H+]1CC[C@@H]2[C@@H](CCCN2C)C1 ZINC000248157352 334296194 /nfs/dbraw/zinc/29/61/94/334296194.db2.gz RNQSWNDTVRPTIZ-CGTJXYLNSA-N 1 3 290.426 3.693 20 0 CHADHO CC(C)[C@H]1CC[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000552251192 334308656 /nfs/dbraw/zinc/30/86/56/334308656.db2.gz NBCKSAKZDAWMOX-QZTJIDSGSA-N 1 3 278.484 3.808 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC000249091944 334327277 /nfs/dbraw/zinc/32/72/77/334327277.db2.gz DJKARLMOZLEMSD-YIYPIFLZSA-N 1 3 292.389 3.570 20 0 CHADHO CC(C)CN1CCC[C@@H](C[NH2+][C@H]2CCC23CCCC3)C1 ZINC000249127803 334328639 /nfs/dbraw/zinc/32/86/39/334328639.db2.gz ULUBGNVEPUJOCT-IRXDYDNUSA-N 1 3 278.484 3.667 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2N[C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000250528629 334345844 /nfs/dbraw/zinc/34/58/44/334345844.db2.gz IXJZNJGXVSVDHH-ZSYWTGECSA-N 1 3 284.447 3.574 20 0 CHADHO Cc1cccc(CC[C@H](C)N[C@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000251205170 334358173 /nfs/dbraw/zinc/35/81/73/334358173.db2.gz WGPFRQYEUVPRHV-WDSOQIARSA-N 1 3 286.463 3.533 20 0 CHADHO Cc1cccc(CC[C@H](C)N[C@H]2CC[N@H+]3CCC[C@H]3C2)c1 ZINC000251205170 334358174 /nfs/dbraw/zinc/35/81/74/334358174.db2.gz WGPFRQYEUVPRHV-WDSOQIARSA-N 1 3 286.463 3.533 20 0 CHADHO Cc1cccc(CC[C@H](C)[NH2+][C@H]2CCN3CCC[C@H]3C2)c1 ZINC000251205170 334358175 /nfs/dbraw/zinc/35/81/75/334358175.db2.gz WGPFRQYEUVPRHV-WDSOQIARSA-N 1 3 286.463 3.533 20 0 CHADHO C[C@@H](c1ccc2ccccc2c1)N1CC[C@@H]([NH3+])[C@H](C)C1 ZINC000251608405 334365327 /nfs/dbraw/zinc/36/53/27/334365327.db2.gz DJNCNITVVJWAKN-QWQRMKEZSA-N 1 3 268.404 3.570 20 0 CHADHO C1CCC(N2CCC([NH2+]C3CCCCCC3)CC2)C1 ZINC000553517356 334389792 /nfs/dbraw/zinc/38/97/92/334389792.db2.gz MVYYAZSHRDQFIS-UHFFFAOYSA-N 1 3 264.457 3.706 20 0 CHADHO CC(C)NCCC[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000576386538 335196897 /nfs/dbraw/zinc/19/68/97/335196897.db2.gz SIICAUGYLOEOMS-IYXRBSQSSA-N 1 3 294.405 3.721 20 0 CHADHO CCC[C@@H](Cc1ccccc1)[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000576692821 335235180 /nfs/dbraw/zinc/23/51/80/335235180.db2.gz LEINXIPPGXMXGV-MOPGFXCFSA-N 1 3 288.479 3.718 20 0 CHADHO CCCC[C@@H]([NH2+]CC1=CCN(C)CC1)c1ccccc1 ZINC000344299711 335246415 /nfs/dbraw/zinc/24/64/15/335246415.db2.gz PLCMSIPGAKGPRJ-GOSISDBHSA-N 1 3 272.436 3.769 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@H]2CC[C@H](c3ccccc3)C2)C1 ZINC000576907767 335262854 /nfs/dbraw/zinc/26/28/54/335262854.db2.gz PMDLPKKTKMKIQQ-NEWSRXKRSA-N 1 3 286.463 3.643 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3N[C@@H](C)CC[NH+](C)C ZINC000580672815 335320266 /nfs/dbraw/zinc/32/02/66/335320266.db2.gz OTPHRRANBUXWRA-KBXCAEBGSA-N 1 3 299.462 3.784 20 0 CHADHO C[C@H](N[C@H]1CCCC[C@H]1C[NH3+])c1ccc(Cl)c(F)c1 ZINC000577481861 335356756 /nfs/dbraw/zinc/35/67/56/335356756.db2.gz HMXYCRQJFSRBRK-WBIUFABUSA-N 1 3 284.806 3.647 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCC[C@H](N)C1)C(C)(C)c1ccccc1 ZINC000578906533 335688527 /nfs/dbraw/zinc/68/85/27/335688527.db2.gz ORAJPMJMIHBDJQ-ULQDDVLXSA-N 1 3 274.452 3.602 20 0 CHADHO [NH3+]CCC1CCN(Cc2ccc(-c3ccccc3)o2)CC1 ZINC000581432864 336076766 /nfs/dbraw/zinc/07/67/66/336076766.db2.gz NVUDZNWLGKOPPH-UHFFFAOYSA-N 1 3 284.403 3.507 20 0 CHADHO CC1CC([NH2+]C[C@@H]2CCCCN(Cc3ccccc3)C2)C1 ZINC000381991422 336079819 /nfs/dbraw/zinc/07/98/19/336079819.db2.gz PDZWIMZQXICSLW-AVAKVYKDSA-N 1 3 286.463 3.677 20 0 CHADHO CC(C)(CN[C@H]1C[C@@H]([NH3+])c2ccccc21)C1CCC1 ZINC000384834583 336132232 /nfs/dbraw/zinc/13/22/32/336132232.db2.gz GHVFHPBZTLSUFW-CVEARBPZSA-N 1 3 258.409 3.547 20 0 CHADHO C[NH+](C)CCCC(C)(C)NCc1ccc(F)cc1Cl ZINC000387291180 336191077 /nfs/dbraw/zinc/19/10/77/336191077.db2.gz IERCIRUMPGWZRP-UHFFFAOYSA-N 1 3 286.822 3.689 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H](CC)c2ccc(F)cc2)C1 ZINC000151132732 519862100 /nfs/dbraw/zinc/86/21/00/519862100.db2.gz GWGZSWRBERPTLQ-YOEHRIQHSA-N 1 3 278.415 3.598 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H]2C[C@H](C)Sc3sccc32)C1 ZINC000130351565 521717612 /nfs/dbraw/zinc/71/76/12/521717612.db2.gz PXDPUMRDVMYDQR-OUCADQQQSA-N 1 3 296.505 3.605 20 0 CHADHO CC[C@H]([NH2+]C1CCN(c2ccncc2)CC1)c1ccccc1 ZINC000298260346 522562131 /nfs/dbraw/zinc/56/21/31/522562131.db2.gz FLMCQKQHOODLAD-IBGZPJMESA-N 1 3 295.430 3.791 20 0 CHADHO Cc1nc2ccccc2c(N2CC[C@H]([NH+]3CCCC3)C2)c1C ZINC000302086727 534671724 /nfs/dbraw/zinc/67/17/24/534671724.db2.gz NSEDDUZDAJCLBV-INIZCTEOSA-N 1 3 295.430 3.526 20 0 CHADHO C[C@H](NC1CC[NH+](C2CC2)CC1)c1ccc(Cl)cc1 ZINC000037140854 525292737 /nfs/dbraw/zinc/29/27/37/525292737.db2.gz UOEHLFKOSQSEHO-LBPRGKRZSA-N 1 3 278.827 3.617 20 0 CHADHO Cc1ccc([C@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)s1 ZINC000088164249 525918104 /nfs/dbraw/zinc/91/81/04/525918104.db2.gz VJIRZRITLXGLGP-AVOUXACISA-N 1 3 278.465 3.722 20 0 CHADHO Cc1ccc([C@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)s1 ZINC000088164249 525918111 /nfs/dbraw/zinc/91/81/11/525918111.db2.gz VJIRZRITLXGLGP-AVOUXACISA-N 1 3 278.465 3.722 20 0 CHADHO Cc1nc(C)c([C@@H](C)[NH2+]C[C@H](C)CN2CCCCC2)s1 ZINC000111361640 526746745 /nfs/dbraw/zinc/74/67/45/526746745.db2.gz AJPVFYHUDAIOTK-QWHCGFSZSA-N 1 3 295.496 3.533 20 0 CHADHO [NH3+][C@@H]1C[C@H](N[C@@H]2CCC[C@H](C(F)(F)F)C2)c2ccccc21 ZINC000157377310 527377436 /nfs/dbraw/zinc/37/74/36/527377436.db2.gz YKPGSNRFOIPTTM-DRABBMOASA-N 1 3 298.352 3.842 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H](CC)c2cccc(C)c2)C1 ZINC000353525332 528261520 /nfs/dbraw/zinc/26/15/20/528261520.db2.gz YINCEHORGCMJOV-AEFFLSMTSA-N 1 3 274.452 3.768 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H](CC)c2cccc(C)c2)C1 ZINC000353525332 528261522 /nfs/dbraw/zinc/26/15/22/528261522.db2.gz YINCEHORGCMJOV-AEFFLSMTSA-N 1 3 274.452 3.768 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H](CC)c2cccc(C)c2)C1 ZINC000353525332 528261524 /nfs/dbraw/zinc/26/15/24/528261524.db2.gz YINCEHORGCMJOV-AEFFLSMTSA-N 1 3 274.452 3.768 20 0 CHADHO CSCCCCCCN[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000235156673 1119361199 /nfs/dbraw/zinc/36/11/99/1119361199.db2.gz IISHRQJNAYJLON-JKSUJKDBSA-N 1 3 278.465 3.644 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]CCCN2CCCC[C@H]2C)C[C@H]1C ZINC000251760323 1125500566 /nfs/dbraw/zinc/50/05/66/1125500566.db2.gz KEOASSPXFQHIME-VQHPVUNQSA-N 1 3 266.473 3.665 20 0 CHADHO CCC(CC)(CC)C[N@H+]1CC[C@@H](CN2CCCC2)C1 ZINC000542949317 1120276341 /nfs/dbraw/zinc/27/63/41/1120276341.db2.gz WPQVFNSXXXZTRA-INIZCTEOSA-N 1 3 266.473 3.621 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)CCSC2CCCCC2)C[C@H]1C ZINC000500093427 1120508447 /nfs/dbraw/zinc/50/84/47/1120508447.db2.gz SGQOYUCSZTYTOO-CVEARBPZSA-N 1 3 298.540 3.857 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)CCSC2CCCCC2)C[C@H]1C ZINC000500093427 1120508451 /nfs/dbraw/zinc/50/84/51/1120508451.db2.gz SGQOYUCSZTYTOO-CVEARBPZSA-N 1 3 298.540 3.857 20 0 CHADHO CC[C@H]([NH2+]CC[C@H]1CCCN1C)c1ccc(Cl)s1 ZINC000543484578 1120533774 /nfs/dbraw/zinc/53/37/74/1120533774.db2.gz CMUJEKUHXLBRFB-NEPJUHHUSA-N 1 3 286.872 3.927 20 0 CHADHO CN1C(C)(C)CC([NH2+]CC2(C)CC(F)(F)C2)CC1(C)C ZINC001171621889 1132064774 /nfs/dbraw/zinc/06/47/74/1132064774.db2.gz ROOPWULILXMNIU-UHFFFAOYSA-N 1 3 288.426 3.663 20 0 CHADHO CC/C=C\CCC[N@@H+](C(C)C)[C@@H]1CCCNCC1 ZINC001206580499 1133722381 /nfs/dbraw/zinc/72/23/81/1133722381.db2.gz DACYALWUTPIKKF-OGZRUICASA-N 1 3 252.446 3.585 20 0 CHADHO CC[N@H+](Cc1cccs1)CC1(CN(C)C)CCCC1 ZINC001208187154 1133903052 /nfs/dbraw/zinc/90/30/52/1133903052.db2.gz HMQGFMUSKWNQFZ-UHFFFAOYSA-N 1 3 280.481 3.692 20 0 CHADHO CC[N@@H+](Cc1cccs1)CC1(CN(C)C)CCCC1 ZINC001208187154 1133903060 /nfs/dbraw/zinc/90/30/60/1133903060.db2.gz HMQGFMUSKWNQFZ-UHFFFAOYSA-N 1 3 280.481 3.692 20 0 CHADHO C[C@@H](CC[N@@H+]1CCC[C@@]12CCCNC2)CC(C)(C)C ZINC001222232319 1135211487 /nfs/dbraw/zinc/21/14/87/1135211487.db2.gz UXMSJFJFCIHRBD-DOTOQJQBSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@@H](CC[N@H+]1CCC[C@@]12CCCNC2)CC(C)(C)C ZINC001222232319 1135211492 /nfs/dbraw/zinc/21/14/92/1135211492.db2.gz UXMSJFJFCIHRBD-DOTOQJQBSA-N 1 3 266.473 3.667 20 0 CHADHO Cc1nc2ccc(Nc3ccc(CC[NH+](C)C)cc3)cc2[nH]1 ZINC001213075259 1125516559 /nfs/dbraw/zinc/51/65/59/1125516559.db2.gz LKRSXZIXMCRZGP-UHFFFAOYSA-N 1 3 294.402 3.719 20 0 CHADHO Cc1ccc([C@H](C)NCc2ccc(F)c(CN(C)C)c2)o1 ZINC000120974545 1125553447 /nfs/dbraw/zinc/55/34/47/1125553447.db2.gz JWNHREQSORMAAP-ZDUSSCGKSA-N 1 3 290.382 3.640 20 0 CHADHO Cc1ccc([C@H](C)NCc2ccc(F)c(C[NH+](C)C)c2)o1 ZINC000120974545 1125553454 /nfs/dbraw/zinc/55/34/54/1125553454.db2.gz JWNHREQSORMAAP-ZDUSSCGKSA-N 1 3 290.382 3.640 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]Cc2ccc(F)c(CN(C)C)c2)o1 ZINC000120974545 1125553463 /nfs/dbraw/zinc/55/34/63/1125553463.db2.gz JWNHREQSORMAAP-ZDUSSCGKSA-N 1 3 290.382 3.640 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H](C)c2cccs2)C1 ZINC000246924285 1125654248 /nfs/dbraw/zinc/65/42/48/1125654248.db2.gz GOSYTVGMNNQIAY-ZIAGYGMSSA-N 1 3 266.454 3.519 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H](C)c2cccs2)C1 ZINC000246924265 1125655105 /nfs/dbraw/zinc/65/51/05/1125655105.db2.gz GOSYTVGMNNQIAY-KGLIPLIRSA-N 1 3 266.454 3.519 20 0 CHADHO CC[C@H](CC(F)F)C[NH+]1CCC(CC)(N2CCC2)CC1 ZINC000886719669 1125712833 /nfs/dbraw/zinc/71/28/33/1125712833.db2.gz CTAMGGIJEAEWHG-CQSZACIVSA-N 1 3 288.426 3.618 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C[C@]1(C)CC[NH2+]C1 ZINC000261769215 1125742347 /nfs/dbraw/zinc/74/23/47/1125742347.db2.gz MLWKRTOIMZOASO-JJRVBVJISA-N 1 3 294.870 3.763 20 0 CHADHO C[C@@]1(C[NH3+])CCN(Cc2cccc(-c3ccccc3)c2)C1 ZINC000261856833 1125745483 /nfs/dbraw/zinc/74/54/83/1125745483.db2.gz RXLCKZLRSPFNAM-IBGZPJMESA-N 1 3 280.415 3.524 20 0 CHADHO CCC[N@H+](Cc1ccc2nc(C)ccc2c1)C1CCNCC1 ZINC000261952006 1125747079 /nfs/dbraw/zinc/74/70/79/1125747079.db2.gz ODCGFGUMNIOMBE-UHFFFAOYSA-N 1 3 297.446 3.507 20 0 CHADHO CCC[N@@H+](Cc1ccc2nc(C)ccc2c1)C1CCNCC1 ZINC000261952006 1125747083 /nfs/dbraw/zinc/74/70/83/1125747083.db2.gz ODCGFGUMNIOMBE-UHFFFAOYSA-N 1 3 297.446 3.507 20 0 CHADHO CCCN(Cc1ccc2nc(C)ccc2c1)C1CC[NH2+]CC1 ZINC000261952006 1125747087 /nfs/dbraw/zinc/74/70/87/1125747087.db2.gz ODCGFGUMNIOMBE-UHFFFAOYSA-N 1 3 297.446 3.507 20 0 CHADHO CCC[C@H](C)[C@@H](CC)[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000482361601 1126752077 /nfs/dbraw/zinc/75/20/77/1126752077.db2.gz REESDXCTJWRJCZ-YESZJQIVSA-N 1 3 268.489 3.911 20 0 CHADHO C[C@@H]([NH2+][C@H](CCN(C)C)C(C)(C)C)c1cc(F)cc(F)c1 ZINC000483194621 1126772672 /nfs/dbraw/zinc/77/26/72/1126772672.db2.gz JGECGJIVYOJEFB-MLGOLLRUSA-N 1 3 298.421 3.982 20 0 CHADHO C(CC1CCCC1)CN1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000483232818 1126774962 /nfs/dbraw/zinc/77/49/62/1126774962.db2.gz SMNMEVWPYUVJTM-SFHVURJKSA-N 1 3 278.484 3.765 20 0 CHADHO C(CC1CCCC1)C[N@@H+]1CC[C@@H](CN2CCCCC2)C1 ZINC000483232818 1126774963 /nfs/dbraw/zinc/77/49/63/1126774963.db2.gz SMNMEVWPYUVJTM-SFHVURJKSA-N 1 3 278.484 3.765 20 0 CHADHO C(CC1CCCC1)C[N@H+]1CC[C@@H](CN2CCCCC2)C1 ZINC000483232818 1126774965 /nfs/dbraw/zinc/77/49/65/1126774965.db2.gz SMNMEVWPYUVJTM-SFHVURJKSA-N 1 3 278.484 3.765 20 0 CHADHO Cc1cccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)c1C ZINC000484482068 1126821228 /nfs/dbraw/zinc/82/12/28/1126821228.db2.gz BJHZATBGENROBM-GVDBMIGSSA-N 1 3 274.452 3.827 20 0 CHADHO CC(C)[C@H](CNC[C@H]([NH3+])CCC(C)(C)C)c1cccnc1 ZINC000904363541 1126850278 /nfs/dbraw/zinc/85/02/78/1126850278.db2.gz IBQDZMFYNMQCQS-SJORKVTESA-N 1 3 291.483 3.564 20 0 CHADHO c1ccc(CC2CCN([C@H]3CC[N@@H+]4CCC[C@@H]4C3)CC2)cc1 ZINC000183366019 1126885477 /nfs/dbraw/zinc/88/54/77/1126885477.db2.gz ZSYGXNJONAHAOH-UXHICEINSA-N 1 3 298.474 3.568 20 0 CHADHO c1ccc(CC2CCN([C@H]3CC[N@H+]4CCC[C@@H]4C3)CC2)cc1 ZINC000183366019 1126885483 /nfs/dbraw/zinc/88/54/83/1126885483.db2.gz ZSYGXNJONAHAOH-UXHICEINSA-N 1 3 298.474 3.568 20 0 CHADHO CCC[C@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)c1cccnc1 ZINC000185357837 1126899563 /nfs/dbraw/zinc/89/95/63/1126899563.db2.gz RJWFYQCKLYMQBD-AEFFLSMTSA-N 1 3 289.467 3.633 20 0 CHADHO CCC[C@H]([NH2+]C1CCN(CC(C)C)CC1)c1cccnc1 ZINC000184972589 1126897088 /nfs/dbraw/zinc/89/70/88/1126897088.db2.gz MDTUJTJGZGIJFY-SFHVURJKSA-N 1 3 289.467 3.633 20 0 CHADHO CCCCCC[N@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236371784 1130921905 /nfs/dbraw/zinc/92/19/05/1130921905.db2.gz NESKGMPGUFKZOL-INIZCTEOSA-N 1 3 266.473 3.811 20 0 CHADHO CCCCCC[N@@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236371784 1130921908 /nfs/dbraw/zinc/92/19/08/1130921908.db2.gz NESKGMPGUFKZOL-INIZCTEOSA-N 1 3 266.473 3.811 20 0 CHADHO CCCC[C@H](C)[C@@H](C)[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000571960807 1127184157 /nfs/dbraw/zinc/18/41/57/1127184157.db2.gz OAQMJWGDTSFBHR-ARFHVFGLSA-N 1 3 254.462 3.521 20 0 CHADHO Cc1cccc([C@@H](C)NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1C ZINC000296040995 1127660955 /nfs/dbraw/zinc/66/09/55/1127660955.db2.gz UJWPYCHASYRCGE-MGNMYUMUSA-N 1 3 272.436 3.579 20 0 CHADHO Cc1cccc([C@@H](C)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1C ZINC000296040995 1127660957 /nfs/dbraw/zinc/66/09/57/1127660957.db2.gz UJWPYCHASYRCGE-MGNMYUMUSA-N 1 3 272.436 3.579 20 0 CHADHO CCN1CC[C@H]([N@H+](C)C/C=C\c2ccc(F)cc2)C[C@@H]1C ZINC000539819065 1127943358 /nfs/dbraw/zinc/94/33/58/1127943358.db2.gz JPFMOYZMCRFMRG-YMTSHVIYSA-N 1 3 290.426 3.644 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)C/C=C\c2ccc(F)cc2)C[C@@H]1C ZINC000539819065 1127943361 /nfs/dbraw/zinc/94/33/61/1127943361.db2.gz JPFMOYZMCRFMRG-YMTSHVIYSA-N 1 3 290.426 3.644 20 0 CHADHO CCN1CC[C@H]([N@H+](C)C/C=C/c2ccc(F)cc2)C[C@@H]1C ZINC000539819063 1127943489 /nfs/dbraw/zinc/94/34/89/1127943489.db2.gz JPFMOYZMCRFMRG-PWSDSBMBSA-N 1 3 290.426 3.644 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)C/C=C/c2ccc(F)cc2)C[C@@H]1C ZINC000539819063 1127943492 /nfs/dbraw/zinc/94/34/92/1127943492.db2.gz JPFMOYZMCRFMRG-PWSDSBMBSA-N 1 3 290.426 3.644 20 0 CHADHO Cc1cccc(C2=CC[N@H+](CC[C@@H]3CCCCN3C)CC2)c1 ZINC000540045013 1127958411 /nfs/dbraw/zinc/95/84/11/1127958411.db2.gz YTHBGDISKVSUOX-FQEVSTJZSA-N 1 3 298.474 3.959 20 0 CHADHO Cc1cccc(C2=CC[N@@H+](CC[C@@H]3CCCCN3C)CC2)c1 ZINC000540045013 1127958412 /nfs/dbraw/zinc/95/84/12/1127958412.db2.gz YTHBGDISKVSUOX-FQEVSTJZSA-N 1 3 298.474 3.959 20 0 CHADHO CCc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H](N(C)C)C2)cc1 ZINC000468072230 1127990683 /nfs/dbraw/zinc/99/06/83/1127990683.db2.gz XFQBABASRPGLAR-QGTPRVQTSA-N 1 3 274.452 3.772 20 0 CHADHO CC[C@@H](CC(F)(F)F)[NH2+]C1CCN(C2CCCC2)CC1 ZINC000545460870 1128014998 /nfs/dbraw/zinc/01/49/98/1128014998.db2.gz UERPSDMPPXUMAB-LBPRGKRZSA-N 1 3 292.389 3.714 20 0 CHADHO C[C@H]1C[C@@H](C[NH3+])CN1Cc1ccc(-c2ccccc2)s1 ZINC000469850687 1128055584 /nfs/dbraw/zinc/05/55/84/1128055584.db2.gz WNONLEOTHLBTMS-KBPBESRZSA-N 1 3 286.444 3.584 20 0 CHADHO CCN1CCC[C@@H](C[NH2+]CCc2ccc(C(C)C)cc2)C1 ZINC000470185501 1128065467 /nfs/dbraw/zinc/06/54/67/1128065467.db2.gz XHFFYCHYDAMGHF-SFHVURJKSA-N 1 3 288.479 3.674 20 0 CHADHO CC(C)N(C)CCC[NH2+]C[C@@H](C)c1cccc(Cl)c1 ZINC000470196775 1128066510 /nfs/dbraw/zinc/06/65/10/1128066510.db2.gz WKCTXOCENOZAJR-CQSZACIVSA-N 1 3 282.859 3.763 20 0 CHADHO C[C@H](Cc1cccc(F)c1)[N@H+](CCCN)C1CCCCC1 ZINC001168456076 1128133376 /nfs/dbraw/zinc/13/33/76/1128133376.db2.gz NOWILDRKUAJLOR-OAHLLOKOSA-N 1 3 292.442 3.740 20 0 CHADHO C[C@H](Cc1cccc(F)c1)[N@@H+](CCCN)C1CCCCC1 ZINC001168456076 1128133377 /nfs/dbraw/zinc/13/33/77/1128133377.db2.gz NOWILDRKUAJLOR-OAHLLOKOSA-N 1 3 292.442 3.740 20 0 CHADHO C[C@H]([NH3+])[C@@H](NC1CCC2(CC2(F)F)CC1)c1ccccc1 ZINC000925710527 1128137746 /nfs/dbraw/zinc/13/77/46/1128137746.db2.gz XIGZQTGCOMGNCO-LKGAJIBZSA-N 1 3 294.389 3.633 20 0 CHADHO C[C@@H]([NH2+]C1CC2(C1)CCCC2)[C@H]1CCCN(C2CCC2)C1 ZINC000926119909 1128156037 /nfs/dbraw/zinc/15/60/37/1128156037.db2.gz SHPSEFMUZOCBNK-CVEARBPZSA-N 1 3 290.495 3.952 20 0 CHADHO CC(C)CCN1CCC([NH2+]CC(C)(C)CC(F)F)CC1 ZINC000926842833 1128197876 /nfs/dbraw/zinc/19/78/76/1128197876.db2.gz SGFLYSYEJBFJIG-UHFFFAOYSA-N 1 3 290.442 3.768 20 0 CHADHO CCCCCC[C@H](C)[N@H+]1C[C@H]2CN(CCC)C[C@H]2C1 ZINC001257372897 1128285394 /nfs/dbraw/zinc/28/53/94/1128285394.db2.gz QQUBSJXBQODEEY-YESZJQIVSA-N 1 3 266.473 3.619 20 0 CHADHO CCCCCC[C@H](C)[N@@H+]1C[C@H]2CN(CCC)C[C@H]2C1 ZINC001257372897 1128285398 /nfs/dbraw/zinc/28/53/98/1128285398.db2.gz QQUBSJXBQODEEY-YESZJQIVSA-N 1 3 266.473 3.619 20 0 CHADHO CCCCCC[C@@H](C)[N@H+]1C[C@H]2CN(CCC)C[C@H]2C1 ZINC001257372910 1128285582 /nfs/dbraw/zinc/28/55/82/1128285582.db2.gz QQUBSJXBQODEEY-ZACQAIPSSA-N 1 3 266.473 3.619 20 0 CHADHO CCCCCC[C@@H](C)[N@@H+]1C[C@H]2CN(CCC)C[C@H]2C1 ZINC001257372910 1128285585 /nfs/dbraw/zinc/28/55/85/1128285585.db2.gz QQUBSJXBQODEEY-ZACQAIPSSA-N 1 3 266.473 3.619 20 0 CHADHO C[C@@H](C[NH2+]C1CCN(CC2CCCC2)CC1)C(C)(C)C ZINC000670267223 1128379438 /nfs/dbraw/zinc/37/94/38/1128379438.db2.gz WFDQOWHWRDTPKU-HNNXBMFYSA-N 1 3 280.500 3.913 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1)C(C)(C)C ZINC000670268948 1128380135 /nfs/dbraw/zinc/38/01/35/1128380135.db2.gz UKUGTSWUCKNPKG-OWCLPIDISA-N 1 3 280.500 3.911 20 0 CHADHO C[C@@H](C[NH2+]C1CCN(C(C)(C)C)CC1)c1ccccc1 ZINC000037786586 1128436602 /nfs/dbraw/zinc/43/66/02/1128436602.db2.gz MDNLQHVUSXFXEW-HNNXBMFYSA-N 1 3 274.452 3.643 20 0 CHADHO Cc1ccc(C)c([C@@H](C)NC[C@H](C)C[NH+]2CCCC2)c1 ZINC000062078164 1128437081 /nfs/dbraw/zinc/43/70/81/1128437081.db2.gz SKTPGEANPDZJIW-DOTOQJQBSA-N 1 3 274.452 3.686 20 0 CHADHO CC(C)C[C@H](C[N@H+](C)C1CCNCC1)c1ccccc1 ZINC000563131709 1128451766 /nfs/dbraw/zinc/45/17/66/1128451766.db2.gz GVUGELMSSJBHRI-QGZVFWFLSA-N 1 3 274.452 3.500 20 0 CHADHO CC(C)C[C@H](C[N@@H+](C)C1CCNCC1)c1ccccc1 ZINC000563131709 1128451767 /nfs/dbraw/zinc/45/17/67/1128451767.db2.gz GVUGELMSSJBHRI-QGZVFWFLSA-N 1 3 274.452 3.500 20 0 CHADHO CC[C@H](NC[C@@H]1CCC[N@@H+](C(C)C)C1)c1cccs1 ZINC000125825862 1128455014 /nfs/dbraw/zinc/45/50/14/1128455014.db2.gz RSOBBWQJEPCQFG-GJZGRUSLSA-N 1 3 280.481 3.909 20 0 CHADHO CC[C@H](NC[C@@H]1CCC[N@H+](C(C)C)C1)c1cccs1 ZINC000125825862 1128455015 /nfs/dbraw/zinc/45/50/15/1128455015.db2.gz RSOBBWQJEPCQFG-GJZGRUSLSA-N 1 3 280.481 3.909 20 0 CHADHO CC[C@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)c1cccs1 ZINC000125825862 1128455017 /nfs/dbraw/zinc/45/50/17/1128455017.db2.gz RSOBBWQJEPCQFG-GJZGRUSLSA-N 1 3 280.481 3.909 20 0 CHADHO CC[C@H](NC[C@H]1CCC[N@@H+](C(C)C)C1)c1cccs1 ZINC000125826322 1128454731 /nfs/dbraw/zinc/45/47/31/1128454731.db2.gz RSOBBWQJEPCQFG-CABCVRRESA-N 1 3 280.481 3.909 20 0 CHADHO CC[C@H](NC[C@H]1CCC[N@H+](C(C)C)C1)c1cccs1 ZINC000125826322 1128454734 /nfs/dbraw/zinc/45/47/34/1128454734.db2.gz RSOBBWQJEPCQFG-CABCVRRESA-N 1 3 280.481 3.909 20 0 CHADHO CC[C@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)c1cccs1 ZINC000125826322 1128454737 /nfs/dbraw/zinc/45/47/37/1128454737.db2.gz RSOBBWQJEPCQFG-CABCVRRESA-N 1 3 280.481 3.909 20 0 CHADHO C[C@H](N[C@H](CC[NH+](C)C)C(C)(C)C)c1cccs1 ZINC000125890538 1128455626 /nfs/dbraw/zinc/45/56/26/1128455626.db2.gz OHJYFKSDQWJIDW-GXTWGEPZSA-N 1 3 268.470 3.765 20 0 CHADHO Cc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)CC2 ZINC000125909143 1128456229 /nfs/dbraw/zinc/45/62/29/1128456229.db2.gz GAOZNJKUVURGDN-LPHOPBHVSA-N 1 3 286.463 3.692 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCCN(C(C)C)C2)cc1 ZINC000125977155 1128459585 /nfs/dbraw/zinc/45/95/85/1128459585.db2.gz UGKFDVBTXZFJEY-IAGOWNOFSA-N 1 3 274.452 3.766 20 0 CHADHO C[C@@H](CCSc1ccccc1)[NH+]1CCC(N(C)C)CC1 ZINC000128017382 1128485477 /nfs/dbraw/zinc/48/54/77/1128485477.db2.gz HMBGWROPKKHIAN-HNNXBMFYSA-N 1 3 292.492 3.583 20 0 CHADHO CCCCC[C@@H](C)[N@H+](CCCN)C1CCCCC1 ZINC001257500383 1128510389 /nfs/dbraw/zinc/51/03/89/1128510389.db2.gz PNNACQKETWCBJM-OAHLLOKOSA-N 1 3 254.462 3.939 20 0 CHADHO CCCCC[C@@H](C)[N@@H+](CCCN)C1CCCCC1 ZINC001257500383 1128510393 /nfs/dbraw/zinc/51/03/93/1128510393.db2.gz PNNACQKETWCBJM-OAHLLOKOSA-N 1 3 254.462 3.939 20 0 CHADHO Cc1ccc(C[N@@H+](C)CC[C@@H]2CCCCN2C)c(C)c1 ZINC000565790856 1128532804 /nfs/dbraw/zinc/53/28/04/1128532804.db2.gz BATGLCHELGSNQG-SFHVURJKSA-N 1 3 274.452 3.610 20 0 CHADHO Cc1ccc(C[N@H+](C)CC[C@@H]2CCCCN2C)c(C)c1 ZINC000565790856 1128532806 /nfs/dbraw/zinc/53/28/06/1128532806.db2.gz BATGLCHELGSNQG-SFHVURJKSA-N 1 3 274.452 3.610 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+]C(C)(C)c1ccc(Cl)cc1 ZINC000556179778 1128560332 /nfs/dbraw/zinc/56/03/32/1128560332.db2.gz OWMIFNIJBOMHOX-OAHLLOKOSA-N 1 3 280.843 3.649 20 0 CHADHO Cc1cc(C)cc([C@H](C)NC[C@@H](C)C[NH+]2CCCC2)c1 ZINC000130352685 1128580724 /nfs/dbraw/zinc/58/07/24/1128580724.db2.gz UECFWOAQKVBHDI-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO CCc1ccc(CNCCCC[N@@H+]2CCCC[C@H]2C)o1 ZINC000130648618 1128590789 /nfs/dbraw/zinc/59/07/89/1128590789.db2.gz URABBVWHAPIMJF-OAHLLOKOSA-N 1 3 278.440 3.586 20 0 CHADHO CCc1ccc(CNCCCC[N@H+]2CCCC[C@H]2C)o1 ZINC000130648618 1128590792 /nfs/dbraw/zinc/59/07/92/1128590792.db2.gz URABBVWHAPIMJF-OAHLLOKOSA-N 1 3 278.440 3.586 20 0 CHADHO CC(C)C1([NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000570230006 1128618705 /nfs/dbraw/zinc/61/87/05/1128618705.db2.gz FHKBGMIGHYNXSH-UHFFFAOYSA-N 1 3 264.457 3.562 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CCC1=CCCCCC1 ZINC000578005095 1128702860 /nfs/dbraw/zinc/70/28/60/1128702860.db2.gz BZVXZKQLGXMBKC-AWEZNQCLSA-N 1 3 287.451 3.780 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[NH2+][C@@H]1CCC[C@H](N(C)C)C1 ZINC001258060604 1128719259 /nfs/dbraw/zinc/71/92/59/1128719259.db2.gz HSQJYYDFMASWGP-NXOAAHMSSA-N 1 3 268.489 3.910 20 0 CHADHO C[C@@H]([NH2+][C@H]1CCNC2(CCC2)C1)C(C)(C)c1ccccc1 ZINC000643545863 1117791328 /nfs/dbraw/zinc/79/13/28/1117791328.db2.gz DKMVWXVTZRVRBX-WBVHZDCISA-N 1 3 286.463 3.617 20 0 CHADHO Cc1ccc([C@H](N[C@H]2CC[NH2+]C3(CCC3)C2)C2CC2)cc1 ZINC000643549061 1117800069 /nfs/dbraw/zinc/80/00/69/1117800069.db2.gz ZRPHRSYYLZNMEF-ROUUACIJSA-N 1 3 284.447 3.710 20 0 CHADHO Cc1ccc(SCCN[C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000623341952 1117835363 /nfs/dbraw/zinc/83/53/63/1117835363.db2.gz ZMBKENYQWDAPTB-OAHLLOKOSA-N 1 3 292.492 3.550 20 0 CHADHO Cc1ccc(SCCN[C@@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000623341952 1117835371 /nfs/dbraw/zinc/83/53/71/1117835371.db2.gz ZMBKENYQWDAPTB-OAHLLOKOSA-N 1 3 292.492 3.550 20 0 CHADHO CC(C)[C@H](N[C@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(F)cc1 ZINC000623343534 1117836017 /nfs/dbraw/zinc/83/60/17/1117836017.db2.gz YXDNNTHIPYEFSD-IRXDYDNUSA-N 1 3 292.442 3.985 20 0 CHADHO CC(C)[C@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(F)cc1 ZINC000623343534 1117836019 /nfs/dbraw/zinc/83/60/19/1117836019.db2.gz YXDNNTHIPYEFSD-IRXDYDNUSA-N 1 3 292.442 3.985 20 0 CHADHO CC1=C[C@H](C)[C@@H](C[NH+]2CCC(N(C)C3CC3)CC2)CC1 ZINC001208181398 1117860475 /nfs/dbraw/zinc/86/04/75/1117860475.db2.gz MBOPKHIVPSUOPX-JKSUJKDBSA-N 1 3 276.468 3.537 20 0 CHADHO CC[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccc(F)cc1 ZINC000624120014 1117983916 /nfs/dbraw/zinc/98/39/16/1117983916.db2.gz POHXIQRBOILMPD-PBHICJAKSA-N 1 3 278.415 3.598 20 0 CHADHO CC[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccc(C)cc1 ZINC000624119595 1117985857 /nfs/dbraw/zinc/98/58/57/1117985857.db2.gz FTGQBOJIUPGWLN-SJLPKXTDSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@@H](NC[C@H]1CCCC[N@H+](C)C1)c1ccc(C)cc1 ZINC000624119595 1117985861 /nfs/dbraw/zinc/98/58/61/1117985861.db2.gz FTGQBOJIUPGWLN-SJLPKXTDSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@@H](NC[C@H]1CCCC[N@@H+](C)C1)c1ccc(C)cc1 ZINC000624119595 1117985862 /nfs/dbraw/zinc/98/58/62/1117985862.db2.gz FTGQBOJIUPGWLN-SJLPKXTDSA-N 1 3 274.452 3.768 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000624123079 1117986148 /nfs/dbraw/zinc/98/61/48/1117986148.db2.gz FNNGLJWSOUWZCO-YHUYYLMFSA-N 1 3 292.492 3.562 20 0 CHADHO CC(C)CC[C@H]([NH2+]C[C@H]1CCCCN(C)C1)C1CC1 ZINC000624123107 1117986464 /nfs/dbraw/zinc/98/64/64/1117986464.db2.gz FYUIYBBVKRODKJ-WBVHZDCISA-N 1 3 266.473 3.523 20 0 CHADHO CCC[C@H](NCC[C@@H]1CCC[N@@H+]1C)c1ccccc1 ZINC000181788178 1118006966 /nfs/dbraw/zinc/00/69/66/1118006966.db2.gz FJUFIMFUAAPLOV-IRXDYDNUSA-N 1 3 260.425 3.602 20 0 CHADHO CCC[C@H](NCC[C@@H]1CCC[N@H+]1C)c1ccccc1 ZINC000181788178 1118006972 /nfs/dbraw/zinc/00/69/72/1118006972.db2.gz FJUFIMFUAAPLOV-IRXDYDNUSA-N 1 3 260.425 3.602 20 0 CHADHO CCC[C@H]([NH2+]CC[C@@H]1CCCN1C)c1ccccc1 ZINC000181788178 1118006974 /nfs/dbraw/zinc/00/69/74/1118006974.db2.gz FJUFIMFUAAPLOV-IRXDYDNUSA-N 1 3 260.425 3.602 20 0 CHADHO CCSc1ccc([C@H](C)[NH2+]CC[C@@H]2CCCN2C)cc1 ZINC000182137884 1118015173 /nfs/dbraw/zinc/01/51/73/1118015173.db2.gz XTBNXEHWLCNQKA-HOCLYGCPSA-N 1 3 292.492 3.934 20 0 CHADHO C[C@H](CC[NH2+][C@H](C)c1ccccc1)N1CCCCC1 ZINC000184503447 1118054276 /nfs/dbraw/zinc/05/42/76/1118054276.db2.gz WGPISIHYKZVJKC-HZPDHXFCSA-N 1 3 260.425 3.602 20 0 CHADHO C[C@@H]([NH2+]CC[C@H](C)N1CCCCC1)c1ccccc1 ZINC000184503429 1118054424 /nfs/dbraw/zinc/05/44/24/1118054424.db2.gz WGPISIHYKZVJKC-JKSUJKDBSA-N 1 3 260.425 3.602 20 0 CHADHO CCC[C@@H]([NH2+]C[C@H](C)CN1CCCCC1)c1cccnc1 ZINC000185081670 1118059014 /nfs/dbraw/zinc/05/90/14/1118059014.db2.gz CXIHRIISZAPJEX-FUHWJXTLSA-N 1 3 289.467 3.634 20 0 CHADHO C[C@@H]([NH2+]C[C@H](C)CN(C)C)c1cccc2ccccc21 ZINC000380423381 1118069814 /nfs/dbraw/zinc/06/98/14/1118069814.db2.gz IJAJHGKORJTMSV-LSDHHAIUSA-N 1 3 270.420 3.688 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]CCCN2CCCC[C@H]2C)s1 ZINC000019913191 1118173467 /nfs/dbraw/zinc/17/34/67/1118173467.db2.gz NZAXWRHAJZKZCT-HIFRSBDPSA-N 1 3 280.481 3.972 20 0 CHADHO C[C@@H]1C[C@@H](C)CN(CCC[NH2+]C2CCC(C)(C)CC2)C1 ZINC001648814931 1118223299 /nfs/dbraw/zinc/22/32/99/1118223299.db2.gz VJSXCSHNLDLDGD-HZPDHXFCSA-N 1 3 280.500 3.913 20 0 CHADHO C[C@@H](c1ccc(Cl)cc1)N(C)C[C@@H]1CCC[N@H+](C)C1 ZINC000118841364 1118234062 /nfs/dbraw/zinc/23/40/62/1118234062.db2.gz NFXBEFAAFXVGQI-UONOGXRCSA-N 1 3 280.843 3.675 20 0 CHADHO C[C@@H](c1ccc(Cl)cc1)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000118841364 1118234067 /nfs/dbraw/zinc/23/40/67/1118234067.db2.gz NFXBEFAAFXVGQI-UONOGXRCSA-N 1 3 280.843 3.675 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1)CN(C)C ZINC000312656398 1118347347 /nfs/dbraw/zinc/34/73/47/1118347347.db2.gz GHAKUCGFFILWKB-RYUDHWBXSA-N 1 3 288.357 3.554 20 0 CHADHO CCOc1cccc([C@@H](C)[NH2+]CC[C@H]2CCCCN2C)c1 ZINC000539279161 1118350564 /nfs/dbraw/zinc/35/05/64/1118350564.db2.gz ABQLUKARYNSKLD-NVXWUHKLSA-N 1 3 290.451 3.610 20 0 CHADHO Cc1ccc2c(c1)CC[C@H]2[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000765783202 1118405648 /nfs/dbraw/zinc/40/56/48/1118405648.db2.gz KOTJZJFGDBDXTD-VQIMIIECSA-N 1 3 286.463 3.692 20 0 CHADHO C[NH+](C)Cc1cccc(CNCc2cc3ccccc3[nH]2)c1 ZINC000683927917 1118447513 /nfs/dbraw/zinc/44/75/13/1118447513.db2.gz RARFVTWOLIRXGY-UHFFFAOYSA-N 1 3 293.414 3.519 20 0 CHADHO C[C@H]([NH3+])[C@H]1CCCN(Cc2ccc(-c3ccccc3)cc2)C1 ZINC000262001649 1118479188 /nfs/dbraw/zinc/47/91/88/1118479188.db2.gz VFWWKGCVSNQRGP-JXFKEZNVSA-N 1 3 294.442 3.913 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CC[C@@H](C)[C@@H](C)C1)CN1CCCCC1 ZINC000084987629 1118519863 /nfs/dbraw/zinc/51/98/63/1118519863.db2.gz BCUSXYCZYGAUMO-WCXIOVBPSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@@H](C[NH2+]C1CCC(C(C)(C)C)CC1)CN1CCCC1 ZINC000109961480 1118626019 /nfs/dbraw/zinc/62/60/19/1118626019.db2.gz SJOALIPSMPVAJJ-GTPINHCMSA-N 1 3 280.500 3.913 20 0 CHADHO C[C@@H]1C[C@H](C[NH3+])CN1Cc1cccc(C2CCCC2)c1 ZINC000656786767 1118659099 /nfs/dbraw/zinc/65/90/99/1118659099.db2.gz QHHCQELRTRFOSH-GDBMZVCRSA-N 1 3 272.436 3.513 20 0 CHADHO c1ccc(C2CC2)c(C[NH2+]C2CC(N3CCCCC3)C2)c1 ZINC000684425577 1118700752 /nfs/dbraw/zinc/70/07/52/1118700752.db2.gz VDUADAYKLFAFJW-UHFFFAOYSA-N 1 3 284.447 3.671 20 0 CHADHO CC(C)N(C)CCC[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000341530848 1118721257 /nfs/dbraw/zinc/72/12/57/1118721257.db2.gz MFXZBCOWUSTDME-UHFFFAOYSA-N 1 3 294.405 3.675 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H]2CCC[C@@H]2CCCF)C1 ZINC000510756009 1118807029 /nfs/dbraw/zinc/80/70/29/1118807029.db2.gz YHEINOBJKPMJBH-BRWVUGGUSA-N 1 3 284.463 3.615 20 0 CHADHO CC(C)(C)C[C@H](N[C@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000133714801 1118866730 /nfs/dbraw/zinc/86/67/30/1118866730.db2.gz JLLMRKUTMFKQBI-IRXDYDNUSA-N 1 3 274.452 3.896 20 0 CHADHO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCc1ccccc1 ZINC000148140596 1118966603 /nfs/dbraw/zinc/96/66/03/1118966603.db2.gz YZGHAOLYPGNJJY-FXAWDEMLSA-N 1 3 294.442 3.687 20 0 CHADHO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1ccccc1 ZINC000148140596 1118966607 /nfs/dbraw/zinc/96/66/07/1118966607.db2.gz YZGHAOLYPGNJJY-FXAWDEMLSA-N 1 3 294.442 3.687 20 0 CHADHO CN(C)CC(C)(C)C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001207276512 1118999924 /nfs/dbraw/zinc/99/99/24/1118999924.db2.gz YMBWZEGYIOZXHV-MRXNPFEDSA-N 1 3 278.415 3.550 20 0 CHADHO CN(C)CC(C)(C)C[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001207276512 1118999926 /nfs/dbraw/zinc/99/99/26/1118999926.db2.gz YMBWZEGYIOZXHV-MRXNPFEDSA-N 1 3 278.415 3.550 20 0 CHADHO CSc1cc(C)ccc1C[NH2+][C@@H]1C[C@@H](C)N(C)C[C@@H]1C ZINC000119274447 1119208500 /nfs/dbraw/zinc/20/85/00/1119208500.db2.gz LLDZLMIAFUHIBP-SQWLQELKSA-N 1 3 292.492 3.535 20 0 CHADHO C[C@@H]1C[C@@H]1C[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000583294973 1119337173 /nfs/dbraw/zinc/33/71/73/1119337173.db2.gz JAUAIWDOENWBFN-BHIYHBOVSA-N 1 3 286.463 3.534 20 0 CHADHO C[NH2+]Cc1ccccc1CNCc1ccc(C)c(Cl)c1 ZINC000650720132 1119379956 /nfs/dbraw/zinc/37/99/56/1119379956.db2.gz GBYPVDCCSXGOIY-UHFFFAOYSA-N 1 3 288.822 3.658 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2ccc(SC)c(F)c2)C1 ZINC000163249355 1119382449 /nfs/dbraw/zinc/38/24/49/1119382449.db2.gz QGJOWYCIVHVYIH-STQMWFEESA-N 1 3 296.455 3.540 20 0 CHADHO CC(C)(C)C[C@@H]1C[C@H]1[NH2+][C@H]1C[C@H](N)c2ccccc21 ZINC000650741630 1119396020 /nfs/dbraw/zinc/39/60/20/1119396020.db2.gz IFDHTJDAFKAOLY-KSYCFECVSA-N 1 3 258.409 3.546 20 0 CHADHO Cc1ccc2c(c1)[C@H](NCc1ccc(C[NH3+])cc1F)[C@H](C)C2 ZINC000650754435 1119411538 /nfs/dbraw/zinc/41/15/38/1119411538.db2.gz JAPLKQFEGKBLCS-BFUOFWGJSA-N 1 3 298.405 3.616 20 0 CHADHO Cc1ccc([C@H](C)NCCCC[NH+]2CCC(C)CC2)o1 ZINC000158204297 1119436580 /nfs/dbraw/zinc/43/65/80/1119436580.db2.gz MUTGLTVRPIIYOL-INIZCTEOSA-N 1 3 278.440 3.751 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@H]2CCCC(C)(C)CC2)C1 ZINC000250520194 1119441765 /nfs/dbraw/zinc/44/17/65/1119441765.db2.gz SJCZIOIATQCFKV-HOTGVXAUSA-N 1 3 266.473 3.665 20 0 CHADHO Cc1ccc([C@@H](C)CN2CC[C@@H](C[NH+]3CCCC3)C2)cc1 ZINC000628182040 1119492526 /nfs/dbraw/zinc/49/25/26/1119492526.db2.gz AMJQGOUHZLBPTA-ROUUACIJSA-N 1 3 286.463 3.516 20 0 CHADHO CC(C)C[C@@H](C)C[NH2+]C1CCN(C2CCCC2)CC1 ZINC000685425560 1119606008 /nfs/dbraw/zinc/60/60/08/1119606008.db2.gz WAAAFUPGLACVTF-OAHLLOKOSA-N 1 3 266.473 3.665 20 0 CHADHO Cc1ccc([C@H](C)C[N@@H+]2CCC[C@@H](N(C)C)CC2)cc1 ZINC000628252094 1119762206 /nfs/dbraw/zinc/76/22/06/1119762206.db2.gz HZWZWWGIEXCHBI-SJLPKXTDSA-N 1 3 274.452 3.515 20 0 CHADHO Cc1ccc([C@H](C)C[N@H+]2CCC[C@@H](N(C)C)CC2)cc1 ZINC000628252094 1119762210 /nfs/dbraw/zinc/76/22/10/1119762210.db2.gz HZWZWWGIEXCHBI-SJLPKXTDSA-N 1 3 274.452 3.515 20 0 CHADHO Cc1ccc([C@H](C)C[N@@H+]2CCC[C@@H]3CN(C)CC[C@@H]32)cc1 ZINC000628281212 1119789880 /nfs/dbraw/zinc/78/98/80/1119789880.db2.gz HQSFURHVWTXQFJ-QRQLOZEOSA-N 1 3 286.463 3.515 20 0 CHADHO Cc1ccc([C@H](C)C[N@H+]2CCC[C@@H]3CN(C)CC[C@@H]32)cc1 ZINC000628281212 1119789881 /nfs/dbraw/zinc/78/98/81/1119789881.db2.gz HQSFURHVWTXQFJ-QRQLOZEOSA-N 1 3 286.463 3.515 20 0 CHADHO CCC[C@H](C[N@@H+]1CC[C@@H](N)[C@H](CC)C1)c1ccccc1 ZINC000647498630 1119850272 /nfs/dbraw/zinc/85/02/72/1119850272.db2.gz LLTMKCQQJQROBK-KBAYOESNSA-N 1 3 274.452 3.630 20 0 CHADHO CCC[C@H](C[N@H+]1CC[C@@H](N)[C@H](CC)C1)c1ccccc1 ZINC000647498630 1119850275 /nfs/dbraw/zinc/85/02/75/1119850275.db2.gz LLTMKCQQJQROBK-KBAYOESNSA-N 1 3 274.452 3.630 20 0 CHADHO CCC[C@H](C[N@@H+]1CC[C@H](N)[C@H](CC)C1)c1ccccc1 ZINC000647498631 1119850722 /nfs/dbraw/zinc/85/07/22/1119850722.db2.gz LLTMKCQQJQROBK-NXHRZFHOSA-N 1 3 274.452 3.630 20 0 CHADHO CCC[C@H](C[N@H+]1CC[C@H](N)[C@H](CC)C1)c1ccccc1 ZINC000647498631 1119850726 /nfs/dbraw/zinc/85/07/26/1119850726.db2.gz LLTMKCQQJQROBK-NXHRZFHOSA-N 1 3 274.452 3.630 20 0 CHADHO C[C@@H]1C[C@H](NC2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)CS1 ZINC000414230395 1119948502 /nfs/dbraw/zinc/94/85/02/1119948502.db2.gz NWFBFLABTJCDMK-HDEZJCGLSA-N 1 3 296.524 3.513 20 0 CHADHO CC(C)=CCC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000376462775 1120001138 /nfs/dbraw/zinc/00/11/38/1120001138.db2.gz JGWJZHJVGCLCHX-UHFFFAOYSA-N 1 3 264.457 3.729 20 0 CHADHO CCCCN1CCC([N@H+](C)Cc2ccc(C)c(F)c2)CC1 ZINC001205251605 1120024228 /nfs/dbraw/zinc/02/42/28/1120024228.db2.gz OFQWBYZIXMYGCQ-UHFFFAOYSA-N 1 3 292.442 3.830 20 0 CHADHO CCCCN1CCC([N@@H+](C)Cc2ccc(C)c(F)c2)CC1 ZINC001205251605 1120024229 /nfs/dbraw/zinc/02/42/29/1120024229.db2.gz OFQWBYZIXMYGCQ-UHFFFAOYSA-N 1 3 292.442 3.830 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccc(Cl)cc1 ZINC000623657062 1120065328 /nfs/dbraw/zinc/06/53/28/1120065328.db2.gz IZWVFUJEYCZIKE-ZIAGYGMSSA-N 1 3 280.843 3.723 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@H]2CC(C)(C)Cc3occc32)C1 ZINC000624120787 1120065472 /nfs/dbraw/zinc/06/54/72/1120065472.db2.gz GYXBOYCBWQVEIS-ZBFHGGJFSA-N 1 3 290.451 3.615 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@@H]2CC(C)(C)Cc3occc32)C1 ZINC000624120784 1120066467 /nfs/dbraw/zinc/06/64/67/1120066467.db2.gz GYXBOYCBWQVEIS-GDBMZVCRSA-N 1 3 290.451 3.615 20 0 CHADHO CC[C@H](Cc1ccc(C)cc1)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000624121140 1120076155 /nfs/dbraw/zinc/07/61/55/1120076155.db2.gz OVKADCYYKVNVOZ-RBUKOAKNSA-N 1 3 288.479 3.638 20 0 CHADHO CC(C)C1CCC([NH2+][C@@H]2CCC[C@H](N(C)C)C2)CC1 ZINC000715544289 1120111170 /nfs/dbraw/zinc/11/11/70/1120111170.db2.gz SHHIUQPJYRFDOR-BACDZXNISA-N 1 3 266.473 3.664 20 0 CHADHO CC[N@@H+]1CCC[C@H](CN[C@H](c2ccc(F)cc2)C2CC2)C1 ZINC001116473026 1120127457 /nfs/dbraw/zinc/12/74/57/1120127457.db2.gz JHCBZZJDPMBLRJ-KDOFPFPSSA-N 1 3 290.426 3.598 20 0 CHADHO CC[N@H+]1CCC[C@H](CN[C@H](c2ccc(F)cc2)C2CC2)C1 ZINC001116473026 1120127462 /nfs/dbraw/zinc/12/74/62/1120127462.db2.gz JHCBZZJDPMBLRJ-KDOFPFPSSA-N 1 3 290.426 3.598 20 0 CHADHO C[C@@H](NCc1cccc(F)c1)c1cccc(C[NH+](C)C)c1 ZINC000924610765 1120165174 /nfs/dbraw/zinc/16/51/74/1120165174.db2.gz RCGBNZRNBRBCJP-CQSZACIVSA-N 1 3 286.394 3.738 20 0 CHADHO C[C@H]1CCCCN1CCC[NH2+]C1CCC2(CC2)CC1 ZINC000362918491 1120192018 /nfs/dbraw/zinc/19/20/18/1120192018.db2.gz NRJOEIQLWGKUBT-HNNXBMFYSA-N 1 3 264.457 3.563 20 0 CHADHO CCC(CC)(CC)C[N@@H+]1CC[C@@H](CN2CCCC2)C1 ZINC000542949317 1120276336 /nfs/dbraw/zinc/27/63/36/1120276336.db2.gz WPQVFNSXXXZTRA-INIZCTEOSA-N 1 3 266.473 3.621 20 0 CHADHO CC(C)C[C@H](C)CN1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000499545767 1120311443 /nfs/dbraw/zinc/31/14/43/1120311443.db2.gz CYIYZYMMHNFTBY-LZLYRXPVSA-N 1 3 278.484 3.617 20 0 CHADHO CC(C)C[C@H](C)CN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000499545767 1120311446 /nfs/dbraw/zinc/31/14/46/1120311446.db2.gz CYIYZYMMHNFTBY-LZLYRXPVSA-N 1 3 278.484 3.617 20 0 CHADHO C(CC1CCC1)CN1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000660114223 1120381541 /nfs/dbraw/zinc/38/15/41/1120381541.db2.gz GIXUJUSZQUVWQX-SJLPKXTDSA-N 1 3 276.468 3.515 20 0 CHADHO C(CC1CCC1)CN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000660114223 1120381547 /nfs/dbraw/zinc/38/15/47/1120381547.db2.gz GIXUJUSZQUVWQX-SJLPKXTDSA-N 1 3 276.468 3.515 20 0 CHADHO CC(C)(CN[C@@H]1CCC[C@@H]1[NH3+])c1ccc2ccccc2c1 ZINC000629550496 1128914503 /nfs/dbraw/zinc/91/45/03/1128914503.db2.gz NENFSMARQJLPFK-ZWKOTPCHSA-N 1 3 282.431 3.587 20 0 CHADHO CC1(C)[C@H](N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)C[C@H]1c1ccccc1 ZINC000364071035 1120423503 /nfs/dbraw/zinc/42/35/03/1120423503.db2.gz DMTJBAVXCCKSOG-YDZRNGNQSA-N 1 3 298.474 3.785 20 0 CHADHO CC1(C)[C@H](N[C@@H]2CC[N@H+]3CCC[C@H]3C2)C[C@H]1c1ccccc1 ZINC000364071035 1120423506 /nfs/dbraw/zinc/42/35/06/1120423506.db2.gz DMTJBAVXCCKSOG-YDZRNGNQSA-N 1 3 298.474 3.785 20 0 CHADHO c1ccc(C2CC([NH2+][C@H]3CCNC[C@@H]3C3CCCC3)C2)cc1 ZINC000925604110 1120445369 /nfs/dbraw/zinc/44/53/69/1120445369.db2.gz HOCFQPMSIDEAIE-TUNPWDSISA-N 1 3 298.474 3.691 20 0 CHADHO C[C@H](CCCC(F)(F)F)[NH2+]CCCN1CCCC[C@H]1C ZINC000253126707 1128918462 /nfs/dbraw/zinc/91/84/62/1128918462.db2.gz RRTVLBURTXTRGY-ZIAGYGMSSA-N 1 3 294.405 3.962 20 0 CHADHO CCc1cc(CN2CCC3(CC([NH3+])C3)CC2)ccc1Cl ZINC001222216012 1120506735 /nfs/dbraw/zinc/50/67/35/1120506735.db2.gz SOPYRCZOIORJIA-UHFFFAOYSA-N 1 3 292.854 3.606 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]CC[C@H](C)N2CCCCC2)cc1 ZINC000543418547 1120519583 /nfs/dbraw/zinc/51/95/83/1120519583.db2.gz WRKFXTJPSUWBPI-IRXDYDNUSA-N 1 3 274.452 3.910 20 0 CHADHO CS[C@@H](C[NH2+]C1CCN(C2CCCC2)CC1)C(C)(C)C ZINC000543427413 1120520186 /nfs/dbraw/zinc/52/01/86/1120520186.db2.gz LLWZUPXRAKCXDS-INIZCTEOSA-N 1 3 298.540 3.761 20 0 CHADHO C[C@H](C[NH2+]Cc1cccc(Oc2ccccc2)c1)CN(C)C ZINC000390455740 1120527115 /nfs/dbraw/zinc/52/71/15/1120527115.db2.gz FKPNLYNXXUFJAI-MRXNPFEDSA-N 1 3 298.430 3.766 20 0 CHADHO C1CCC2(C1)CCC([N@@H+]1CCC[C@]3(CCCNC3)C1)CC2 ZINC000228078618 1120689430 /nfs/dbraw/zinc/68/94/30/1120689430.db2.gz AUSMHIDWCUQEDQ-IBGZPJMESA-N 1 3 290.495 3.955 20 0 CHADHO C1CCC2(C1)CCC([N@H+]1CCC[C@]3(CCCNC3)C1)CC2 ZINC000228078618 1120689431 /nfs/dbraw/zinc/68/94/31/1120689431.db2.gz AUSMHIDWCUQEDQ-IBGZPJMESA-N 1 3 290.495 3.955 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CC[C@]3(CC[NH2+]C3)C2)cc1 ZINC000257709779 1120742951 /nfs/dbraw/zinc/74/29/51/1120742951.db2.gz NMFDGRWHHCXPOB-YJBOKZPZSA-N 1 3 272.436 3.556 20 0 CHADHO CC1=C[C@H](C)CN(CC[C@@H](C)[N@H+]2CC(C)=C[C@H](C)C2)C1 ZINC000430264917 1120854220 /nfs/dbraw/zinc/85/42/20/1120854220.db2.gz CDQPZDHTPDYCRJ-QILLFSRXSA-N 1 3 276.468 3.561 20 0 CHADHO CC1=C[C@H](C)CN(CC[C@@H](C)[N@@H+]2CC(C)=C[C@H](C)C2)C1 ZINC000430264917 1120854223 /nfs/dbraw/zinc/85/42/23/1120854223.db2.gz CDQPZDHTPDYCRJ-QILLFSRXSA-N 1 3 276.468 3.561 20 0 CHADHO CC1=C[C@H](C)CN([C@H](C)CC[N@H+]2CC(C)=C[C@H](C)C2)C1 ZINC000430264917 1120854224 /nfs/dbraw/zinc/85/42/24/1120854224.db2.gz CDQPZDHTPDYCRJ-QILLFSRXSA-N 1 3 276.468 3.561 20 0 CHADHO CC1=C[C@H](C)CN([C@H](C)CC[N@@H+]2CC(C)=C[C@H](C)C2)C1 ZINC000430264917 1120854229 /nfs/dbraw/zinc/85/42/29/1120854229.db2.gz CDQPZDHTPDYCRJ-QILLFSRXSA-N 1 3 276.468 3.561 20 0 CHADHO COc1ccc2cc([C@@H](C)NCCC(C)(C)[NH3+])ccc2c1 ZINC000925741442 1120857770 /nfs/dbraw/zinc/85/77/70/1120857770.db2.gz RBVIFRXVWQQYRE-CYBMUJFWSA-N 1 3 286.419 3.626 20 0 CHADHO c1ccc([C@@H]2C[C@H]2C[NH2+]C[C@@H]2CCCN(CC3CC3)C2)cc1 ZINC000663344234 1120940387 /nfs/dbraw/zinc/94/03/87/1120940387.db2.gz PSHPKJLUBUDFAN-IHPCNDPISA-N 1 3 298.474 3.502 20 0 CHADHO C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663344066 1120941022 /nfs/dbraw/zinc/94/10/22/1120941022.db2.gz NIYAYHBXDBUDFM-HYVNUMGLSA-N 1 3 278.484 3.523 20 0 CHADHO CCC[C@@H]([NH2+]C[C@@H]1CCCN(CC2CC2)C1)C1CCC1 ZINC000663466205 1120980634 /nfs/dbraw/zinc/98/06/34/1120980634.db2.gz PKIPYTHMCCEQGS-FUHWJXTLSA-N 1 3 278.484 3.667 20 0 CHADHO CC1(C)[C@H]([NH2+]C[C@@H]2CCCN(CC3CC3)C2)[C@@H]2CCC[C@@H]21 ZINC000663467270 1120980746 /nfs/dbraw/zinc/98/07/46/1120980746.db2.gz ZTPINUKUFKJUEA-XWTMOSNGSA-N 1 3 290.495 3.523 20 0 CHADHO C([NH2+][C@H]1CCC[C@H](C2CC2)C1)[C@@H]1CCCN(CC2CC2)C1 ZINC000663472160 1120985730 /nfs/dbraw/zinc/98/57/30/1120985730.db2.gz ZBZWEOLRCHMUJR-WDSOQIARSA-N 1 3 290.495 3.667 20 0 CHADHO C([NH2+][C@H]1CCC[C@H](C2CC2)C1)[C@H]1CCCN(CC2CC2)C1 ZINC000663472151 1120985805 /nfs/dbraw/zinc/98/58/05/1120985805.db2.gz ZBZWEOLRCHMUJR-NEWSRXKRSA-N 1 3 290.495 3.667 20 0 CHADHO C[C@@H](N[C@@H]1CC[N@H+](CC2CC2)C1)c1cccc2ccccc21 ZINC000674048568 1121059869 /nfs/dbraw/zinc/05/98/69/1121059869.db2.gz XMBFBNNWPUIUAK-CRAIPNDOSA-N 1 3 294.442 3.975 20 0 CHADHO C[C@@H](N[C@@H]1CC[N@@H+](CC2CC2)C1)c1cccc2ccccc21 ZINC000674048568 1121059880 /nfs/dbraw/zinc/05/98/80/1121059880.db2.gz XMBFBNNWPUIUAK-CRAIPNDOSA-N 1 3 294.442 3.975 20 0 CHADHO C[NH+](C)Cc1ccc(CN[C@@H]2CCCc3occc32)cc1 ZINC000171128771 1121093993 /nfs/dbraw/zinc/09/39/93/1121093993.db2.gz HNGGOBIXPNJTKT-QGZVFWFLSA-N 1 3 284.403 3.508 20 0 CHADHO C[C@H]1CCC[C@@H]([NH+]2CCC(NCCC(C)(C)F)CC2)C1 ZINC000658193023 1121212583 /nfs/dbraw/zinc/21/25/83/1121212583.db2.gz RUGNLKFROZKVML-GOEBONIOSA-N 1 3 284.463 3.757 20 0 CHADHO C[C@H]1CCC[C@@H](N2CCC([NH2+]CCC(C)(C)F)CC2)C1 ZINC000658193023 1121212586 /nfs/dbraw/zinc/21/25/86/1121212586.db2.gz RUGNLKFROZKVML-GOEBONIOSA-N 1 3 284.463 3.757 20 0 CHADHO C(CC1CCCC1)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000675736105 1121346880 /nfs/dbraw/zinc/34/68/80/1121346880.db2.gz LGYFQWAQGFRMBW-UHFFFAOYSA-N 1 3 278.484 3.953 20 0 CHADHO CCN(CC)CCC[NH2+][C@H](C)[C@@H](C)c1ccccc1 ZINC000675724895 1121348346 /nfs/dbraw/zinc/34/83/46/1121348346.db2.gz PDPABNOMOQPHOV-HZPDHXFCSA-N 1 3 262.441 3.500 20 0 CHADHO c1ccc([C@H](CC2CC2)N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000675751887 1121352174 /nfs/dbraw/zinc/35/21/74/1121352174.db2.gz BMFLZDOJCFBGEN-QYZOEREBSA-N 1 3 284.447 3.744 20 0 CHADHO c1ccc([C@H](CC2CC2)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000675751887 1121352184 /nfs/dbraw/zinc/35/21/84/1121352184.db2.gz BMFLZDOJCFBGEN-QYZOEREBSA-N 1 3 284.447 3.744 20 0 CHADHO C[C@@H]1CCCC[C@H]1[NH+]1CCC(N[C@H]2CC23CCCC3)CC1 ZINC000429426375 1121575732 /nfs/dbraw/zinc/57/57/32/1121575732.db2.gz FVIABMUVKVHIHF-NXHRZFHOSA-N 1 3 290.495 3.952 20 0 CHADHO C[C@H](CC[NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1ccccc1 ZINC000248827278 1121584541 /nfs/dbraw/zinc/58/45/41/1121584541.db2.gz GOUXCNCLAUXLJV-BPQIPLTHSA-N 1 3 274.452 3.643 20 0 CHADHO CCCCN1CCC([NH2+]Cc2cccc3c2CCC3)CC1 ZINC001177506882 1121733521 /nfs/dbraw/zinc/73/35/21/1121733521.db2.gz VPORJZOFSOCXKJ-UHFFFAOYSA-N 1 3 286.463 3.529 20 0 CHADHO C[NH+](C)CC[C@H](NCc1cccc2ccoc21)C(C)(C)C ZINC001177823735 1121749984 /nfs/dbraw/zinc/74/99/84/1121749984.db2.gz YKXCKGFKBCANEY-INIZCTEOSA-N 1 3 288.435 3.889 20 0 CHADHO CC[N@H+](Cc1ccccc1)C1CCN([C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167939622 1121778307 /nfs/dbraw/zinc/77/83/07/1121778307.db2.gz MXVMBHRHFYIYCG-OPVJXMOQSA-N 1 3 298.474 3.771 20 0 CHADHO CC[N@@H+](Cc1ccccc1)C1CCN([C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167939622 1121778314 /nfs/dbraw/zinc/77/83/14/1121778314.db2.gz MXVMBHRHFYIYCG-OPVJXMOQSA-N 1 3 298.474 3.771 20 0 CHADHO C[NH+](C)CCCN[C@@H](CC1CC1)c1ccc(Cl)cc1 ZINC000345696384 1121905766 /nfs/dbraw/zinc/90/57/66/1121905766.db2.gz VZWMYCHEDVWDRV-INIZCTEOSA-N 1 3 280.843 3.723 20 0 CHADHO C[C@@H](N)C[NH2+][C@@H](c1cccc(Cl)c1)C1CCCC1 ZINC000420422762 1122005349 /nfs/dbraw/zinc/00/53/49/1122005349.db2.gz ZNVXOJFWPPEIIX-IAQYHMDHSA-N 1 3 266.816 3.508 20 0 CHADHO c1cc(C[NH2+]C2CC(N3CCCCC3)C2)cc(C2CC2)c1 ZINC000421392259 1122110794 /nfs/dbraw/zinc/11/07/94/1122110794.db2.gz NOMVVFSKRCWPPZ-UHFFFAOYSA-N 1 3 284.447 3.671 20 0 CHADHO C[C@@H]1CC[C@H](C)[C@H]([NH2+]C[C@@H]2CCCN(CC3CC3)C2)C1 ZINC001183093440 1122205866 /nfs/dbraw/zinc/20/58/66/1122205866.db2.gz BQEAZAXEKJYOIP-MXSMSXNCSA-N 1 3 278.484 3.523 20 0 CHADHO Cc1oc2ccccc2c1[C@H](C)NC[C@@H]1CCC[N@H+](C)C1 ZINC000925009410 1122563430 /nfs/dbraw/zinc/56/34/30/1122563430.db2.gz HGOJCAPVDYQGDY-ZFWWWQNUSA-N 1 3 286.419 3.734 20 0 CHADHO Cc1oc2ccccc2c1[C@H](C)NC[C@@H]1CCC[N@@H+](C)C1 ZINC000925009410 1122563433 /nfs/dbraw/zinc/56/34/33/1122563433.db2.gz HGOJCAPVDYQGDY-ZFWWWQNUSA-N 1 3 286.419 3.734 20 0 CHADHO C[C@H](CCN)[NH2+]CCCCc1ccc(Cl)c(Cl)c1 ZINC000414888056 1122566460 /nfs/dbraw/zinc/56/64/60/1122566460.db2.gz DUXFYPJGJKDKEI-LLVKDONJSA-N 1 3 289.250 3.643 20 0 CHADHO CC[C@H](C[NH2+]C[C@@H]1CCN(C(C)C)C1)c1ccccc1 ZINC000516099459 1122567875 /nfs/dbraw/zinc/56/78/75/1122567875.db2.gz BHIPUAVXBWXVPA-DLBZAZTESA-N 1 3 274.452 3.500 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+](C[C@@H](C)C2CCCCC2)C1 ZINC001191367584 1122596444 /nfs/dbraw/zinc/59/64/44/1122596444.db2.gz QHRMMJRKIVJTAW-IAGOWNOFSA-N 1 3 280.500 3.867 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+](C[C@@H](C)C2CCCCC2)C1 ZINC001191367584 1122596446 /nfs/dbraw/zinc/59/64/46/1122596446.db2.gz QHRMMJRKIVJTAW-IAGOWNOFSA-N 1 3 280.500 3.867 20 0 CHADHO C[C@H]([NH2+][C@@H](C)[C@H]1CCN(Cc2ccccc2)C1)c1ccc[nH]1 ZINC000775524302 1122639643 /nfs/dbraw/zinc/63/96/43/1122639643.db2.gz FLZRKXRPWHXYKG-BQFCYCMXSA-N 1 3 297.446 3.576 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)c1ccc[nH]1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000775524307 1122641019 /nfs/dbraw/zinc/64/10/19/1122641019.db2.gz FLZRKXRPWHXYKG-SOLBZPMBSA-N 1 3 297.446 3.576 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCC[C@@H]1c1ccc(Cl)cc1)CN(C)C ZINC000425934390 1122662948 /nfs/dbraw/zinc/66/29/48/1122662948.db2.gz BPAURFKPEGPPRV-XYPHTWIQSA-N 1 3 294.870 3.763 20 0 CHADHO CCCCOc1ccc([C@@H](C)[NH2+]C[C@@H](C)CN(C)C)cc1 ZINC000425933765 1122663067 /nfs/dbraw/zinc/66/30/67/1122663067.db2.gz WRAGBAJVHMGVSA-HZPDHXFCSA-N 1 3 292.467 3.714 20 0 CHADHO C[C@@H]([NH2+]C[C@H](C)CN(C)C)c1ccc(OC(C)(C)C)cc1 ZINC000425947104 1122675501 /nfs/dbraw/zinc/67/55/01/1122675501.db2.gz ZHISNVOOKZCYCW-LSDHHAIUSA-N 1 3 292.467 3.712 20 0 CHADHO Cc1c(F)ccc(CN2CC[C@H](C)[C@@H](C[NH3+])CC2)c1Cl ZINC001205651583 1122742761 /nfs/dbraw/zinc/74/27/61/1122742761.db2.gz HCORUECXSGVPEV-WCQYABFASA-N 1 3 298.833 3.594 20 0 CHADHO CCC[N@H+]([C@@H](C)CC)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167981623 1122899067 /nfs/dbraw/zinc/89/90/67/1122899067.db2.gz BWMBYXKPOVGILG-QTXGHNMQSA-N 1 3 278.484 3.902 20 0 CHADHO CCC[N@@H+]([C@@H](C)CC)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167981623 1122899074 /nfs/dbraw/zinc/89/90/74/1122899074.db2.gz BWMBYXKPOVGILG-QTXGHNMQSA-N 1 3 278.484 3.902 20 0 CHADHO C[N@@H+]1CCC[C@H]1CCN1CCCC2(CCCC2)CC1 ZINC001196039692 1122903915 /nfs/dbraw/zinc/90/39/15/1122903915.db2.gz PMLOKIOYIYGKRW-INIZCTEOSA-N 1 3 264.457 3.517 20 0 CHADHO C[N@H+]1CCC[C@H]1CCN1CCCC2(CCCC2)CC1 ZINC001196039692 1122903917 /nfs/dbraw/zinc/90/39/17/1122903917.db2.gz PMLOKIOYIYGKRW-INIZCTEOSA-N 1 3 264.457 3.517 20 0 CHADHO CCCC[N@H+](CCSC)C1CC(C)(C)NC(C)(C)C1 ZINC001196545664 1122926588 /nfs/dbraw/zinc/92/65/88/1122926588.db2.gz SMRBMYGIKKJCFQ-UHFFFAOYSA-N 1 3 286.529 3.761 20 0 CHADHO CCCC[N@@H+](CCSC)C1CC(C)(C)NC(C)(C)C1 ZINC001196545664 1122926592 /nfs/dbraw/zinc/92/65/92/1122926592.db2.gz SMRBMYGIKKJCFQ-UHFFFAOYSA-N 1 3 286.529 3.761 20 0 CHADHO C(C1CC1)N1[C@@H]2CC[C@H]1CC([N@@H+]1CCC13CCCCC3)C2 ZINC001167984765 1122938557 /nfs/dbraw/zinc/93/85/57/1122938557.db2.gz RDFVOYYPKVQKKA-JWTNVVGKSA-N 1 3 288.479 3.800 20 0 CHADHO C(C1CC1)N1[C@@H]2CC[C@H]1CC([N@H+]1CCC13CCCCC3)C2 ZINC001167984765 1122938560 /nfs/dbraw/zinc/93/85/60/1122938560.db2.gz RDFVOYYPKVQKKA-JWTNVVGKSA-N 1 3 288.479 3.800 20 0 CHADHO CC(C)CN1CCC([NH2+]Cc2ccccc2C2CC2)CC1 ZINC001199144012 1123021227 /nfs/dbraw/zinc/02/12/27/1123021227.db2.gz MGPXNKIAQNCIOL-UHFFFAOYSA-N 1 3 286.463 3.774 20 0 CHADHO C[C@@H]1[C@H](CN)CCC[N@@H+]1C[C@@H]1C[C@@H]1c1ccc(Cl)cc1 ZINC001205901715 1123060106 /nfs/dbraw/zinc/06/01/06/1123060106.db2.gz FNHRYOPWCDGUAO-VWNJHIHFSA-N 1 3 292.854 3.503 20 0 CHADHO C[C@@H]1[C@H](CN)CCC[N@H+]1C[C@@H]1C[C@@H]1c1ccc(Cl)cc1 ZINC001205901715 1123060111 /nfs/dbraw/zinc/06/01/11/1123060111.db2.gz FNHRYOPWCDGUAO-VWNJHIHFSA-N 1 3 292.854 3.503 20 0 CHADHO C[C@H]1CCCCC[N@@H+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167991556 1123093909 /nfs/dbraw/zinc/09/39/09/1123093909.db2.gz CPDOHYQZWRVESK-QTXGHNMQSA-N 1 3 276.468 3.656 20 0 CHADHO C[C@H]1CCCCC[N@H+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167991556 1123093915 /nfs/dbraw/zinc/09/39/15/1123093915.db2.gz CPDOHYQZWRVESK-QTXGHNMQSA-N 1 3 276.468 3.656 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1ccc(-c2cccnc2)cc1 ZINC000520428947 1123098760 /nfs/dbraw/zinc/09/87/60/1123098760.db2.gz DUYFBSQTPLRVDO-ZOCIIQOWSA-N 1 3 295.430 3.669 20 0 CHADHO CC[C@H](C)C[NH+]1CCC2(CN(Cc3ccccc3)C2)CC1 ZINC001201513630 1123114018 /nfs/dbraw/zinc/11/40/18/1123114018.db2.gz AGSHKBNMWTZSIQ-KRWDZBQOSA-N 1 3 286.463 3.631 20 0 CHADHO CC(C)=CCC[C@@H](C)C[NH+]1CCN(c2ccncc2)CC1 ZINC001201482844 1123115468 /nfs/dbraw/zinc/11/54/68/1123115468.db2.gz OCACQPIYTMVWMR-QGZVFWFLSA-N 1 3 287.451 3.586 20 0 CHADHO CC(C)=CCC[C@@H](C)CN1CCN(c2cc[nH+]cc2)CC1 ZINC001201482844 1123115469 /nfs/dbraw/zinc/11/54/69/1123115469.db2.gz OCACQPIYTMVWMR-QGZVFWFLSA-N 1 3 287.451 3.586 20 0 CHADHO CCCC[C@@H](CC)CN1CCC([NH+]2CCCC2)CC1 ZINC001201562910 1123124265 /nfs/dbraw/zinc/12/42/65/1123124265.db2.gz IMRJDZPHFLIULT-MRXNPFEDSA-N 1 3 266.473 3.763 20 0 CHADHO CC(C)=CCC[C@H](C)CC[NH+]1CCC2(CN(C)C2)CC1 ZINC001201980936 1123160038 /nfs/dbraw/zinc/16/00/38/1123160038.db2.gz HGGYBTMDUPLQIL-KRWDZBQOSA-N 1 3 278.484 3.787 20 0 CHADHO CC[C@H](c1ccc(F)cc1F)[N@H+](C)C[C@@H]1CCCN(C)C1 ZINC000152362746 1123182910 /nfs/dbraw/zinc/18/29/10/1123182910.db2.gz GRATUCOPKOSWEC-CXAGYDPISA-N 1 3 296.405 3.690 20 0 CHADHO CC[C@H](c1ccc(F)cc1F)[N@@H+](C)C[C@@H]1CCCN(C)C1 ZINC000152362746 1123182912 /nfs/dbraw/zinc/18/29/12/1123182912.db2.gz GRATUCOPKOSWEC-CXAGYDPISA-N 1 3 296.405 3.690 20 0 CHADHO CC(C)(C[NH2+]C1CCC2(CCC2)CC1)CN1CCCC1 ZINC001202243260 1123193210 /nfs/dbraw/zinc/19/32/10/1123193210.db2.gz UZFDAFGISIPNDA-UHFFFAOYSA-N 1 3 278.484 3.811 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCc1ccc(-c2cccs2)cc1 ZINC000665237534 1123238598 /nfs/dbraw/zinc/23/85/98/1123238598.db2.gz CUPFHCGOPZJVPC-OLZOCXBDSA-N 1 3 274.433 3.631 20 0 CHADHO CC(C)CC[C@@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1ccoc1 ZINC000428217987 1123283273 /nfs/dbraw/zinc/28/32/73/1123283273.db2.gz IQAQTHDFKNRVIJ-MAUKXSAKSA-N 1 3 290.451 3.831 20 0 CHADHO C[C@H]1CCCCN1CCC[NH2+][C@@H]1CCC12CCCC2 ZINC000474031318 1123304437 /nfs/dbraw/zinc/30/44/37/1123304437.db2.gz IHHLPERERZQQID-JKSUJKDBSA-N 1 3 264.457 3.563 20 0 CHADHO C[C@H](CSC(C)(C)C)[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000853239648 1123429092 /nfs/dbraw/zinc/42/90/92/1123429092.db2.gz ITIVZORDYWKPIR-ZBFHGGJFSA-N 1 3 298.540 3.618 20 0 CHADHO CC[C@H](C[NH2+]C[C@H]1CCCN(CC)C1)c1ccccc1 ZINC001648959939 1123439060 /nfs/dbraw/zinc/43/90/60/1123439060.db2.gz GEEIIJLOEOLHQE-IAGOWNOFSA-N 1 3 274.452 3.502 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](C[C@@H]2C(C)=CCC[C@H]2C)C1 ZINC000443641377 1123456144 /nfs/dbraw/zinc/45/61/44/1123456144.db2.gz PHFTXZKWDVBWQH-FGTMMUONSA-N 1 3 278.484 3.643 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](C[C@@H]2C(C)=CCC[C@H]2C)C1 ZINC000443641377 1123456147 /nfs/dbraw/zinc/45/61/47/1123456147.db2.gz PHFTXZKWDVBWQH-FGTMMUONSA-N 1 3 278.484 3.643 20 0 CHADHO CCN(C)C[C@@H]1CC[N@H+](C[C@@H](c2ccccc2)C(C)C)C1 ZINC000474263544 1123497094 /nfs/dbraw/zinc/49/70/94/1123497094.db2.gz CYZJBECDSLDYRY-PKOBYXMFSA-N 1 3 288.479 3.700 20 0 CHADHO CCN(C)C[C@@H]1CC[N@@H+](C[C@@H](c2ccccc2)C(C)C)C1 ZINC000474263544 1123497096 /nfs/dbraw/zinc/49/70/96/1123497096.db2.gz CYZJBECDSLDYRY-PKOBYXMFSA-N 1 3 288.479 3.700 20 0 CHADHO CCCN1CCC([N@H+](C)C/C=C/c2ccccc2)CC1 ZINC000114721699 1123507296 /nfs/dbraw/zinc/50/72/96/1123507296.db2.gz OCUCYTXDRCFIOH-JXMROGBWSA-N 1 3 272.436 3.506 20 0 CHADHO CCCN1CCC([N@@H+](C)C/C=C/c2ccccc2)CC1 ZINC000114721699 1123507299 /nfs/dbraw/zinc/50/72/99/1123507299.db2.gz OCUCYTXDRCFIOH-JXMROGBWSA-N 1 3 272.436 3.506 20 0 CHADHO CC(C)[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCCN(C(C)C)C2)C1 ZINC000474710296 1123575281 /nfs/dbraw/zinc/57/52/81/1123575281.db2.gz IVPZWGCTLWWHRW-KSZLIROESA-N 1 3 280.500 3.911 20 0 CHADHO C[NH+](C)CC[C@H](N[C@H]1CCc2c1cccc2F)C(C)(C)C ZINC000474934522 1123615881 /nfs/dbraw/zinc/61/58/81/1123615881.db2.gz QNNJHSLNGMHHRX-IRXDYDNUSA-N 1 3 292.442 3.769 20 0 CHADHO C[C@H](CC[NH2+]C[C@@H]1C[C@@H]1c1ccccc1)N1CCCCC1 ZINC000346257931 1123676495 /nfs/dbraw/zinc/67/64/95/1123676495.db2.gz YFOACFIGSZYRNR-NZSAHSFTSA-N 1 3 286.463 3.644 20 0 CHADHO [NH3+]CC1CCN(Cc2ccc(-c3ccccc3)cc2F)CC1 ZINC000346691689 1123706978 /nfs/dbraw/zinc/70/69/78/1123706978.db2.gz WZHQYSSRTYIWTK-UHFFFAOYSA-N 1 3 298.405 3.663 20 0 CHADHO Fc1cccc(CN(C[C@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC000346827080 1123724471 /nfs/dbraw/zinc/72/44/71/1123724471.db2.gz HHXCUYLTKAQOJK-INIZCTEOSA-N 1 3 290.426 3.570 20 0 CHADHO CC[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCN(C(C)C)C2)CC1 ZINC000086906390 1123800041 /nfs/dbraw/zinc/80/00/41/1123800041.db2.gz IUKFUGFMWPVCHQ-IKGGRYGDSA-N 1 3 266.473 3.665 20 0 CHADHO CCCCN1CCC([NH2+]Cc2cccc(C)c2C)CC1 ZINC000043314131 1123802653 /nfs/dbraw/zinc/80/26/53/1123802653.db2.gz HZMKATLVADTOJP-UHFFFAOYSA-N 1 3 274.452 3.658 20 0 CHADHO CC[C@@H](CN(CC)C[C@@]1(C)CC[NH2+]C1)c1ccccc1 ZINC000567234887 1124008157 /nfs/dbraw/zinc/00/81/57/1124008157.db2.gz PXHSAXWGXNYZDS-WMZOPIPTSA-N 1 3 274.452 3.502 20 0 CHADHO CCC(CC)(CN[C@H]1CC[N@@H+]2CCC[C@@H]2C1)C(F)(F)F ZINC000865756296 1124010599 /nfs/dbraw/zinc/01/05/99/1124010599.db2.gz IYDDWGMDCFWNHQ-QWHCGFSZSA-N 1 3 292.389 3.572 20 0 CHADHO CCC(CC)(CN[C@H]1CC[N@H+]2CCC[C@@H]2C1)C(F)(F)F ZINC000865756296 1124010601 /nfs/dbraw/zinc/01/06/01/1124010601.db2.gz IYDDWGMDCFWNHQ-QWHCGFSZSA-N 1 3 292.389 3.572 20 0 CHADHO Cc1cccc([C@@H]2CCN(CCC[NH+]3CCCCC3)C2)c1 ZINC000444619936 1124046342 /nfs/dbraw/zinc/04/63/42/1124046342.db2.gz MBGVDPATBLSLAV-LJQANCHMSA-N 1 3 286.463 3.660 20 0 CHADHO CCN(CCC[NH+]1CCCCC1)[C@@H](C)Cc1ccsc1 ZINC000444632284 1124046390 /nfs/dbraw/zinc/04/63/90/1124046390.db2.gz ZBWYGXYSSLZROW-INIZCTEOSA-N 1 3 294.508 3.877 20 0 CHADHO c1ccc(C[N@@H+](CCCN2CCCCC2)C2CC2)cc1 ZINC000195632315 1124066189 /nfs/dbraw/zinc/06/61/89/1124066189.db2.gz YDIPJANFFRFAEK-UHFFFAOYSA-N 1 3 272.436 3.527 20 0 CHADHO c1ccc(C[N@H+](CCCN2CCCCC2)C2CC2)cc1 ZINC000195632315 1124066193 /nfs/dbraw/zinc/06/61/93/1124066193.db2.gz YDIPJANFFRFAEK-UHFFFAOYSA-N 1 3 272.436 3.527 20 0 CHADHO C[C@@H](CC[NH2+]CC(C)(C)CN1CCCC1)c1ccccc1 ZINC000446779777 1124122811 /nfs/dbraw/zinc/12/28/11/1124122811.db2.gz CAZZACFQLQTMAS-KRWDZBQOSA-N 1 3 288.479 3.892 20 0 CHADHO CCOc1ccc([C@H](C)N[C@@H]2CC[NH2+]CC(C)(C)C2)cc1 ZINC000635012305 1129170000 /nfs/dbraw/zinc/17/00/00/1129170000.db2.gz SILSOCFGGHJCQF-GOEBONIOSA-N 1 3 290.451 3.514 20 0 CHADHO CC(C)[C@@H]1C[C@H](NC[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc21 ZINC000447536966 1124485372 /nfs/dbraw/zinc/48/53/72/1124485372.db2.gz ROSSZUNULRCPHG-YSSFQJQWSA-N 1 3 298.474 3.945 20 0 CHADHO CC(C)[C@@H]1C[C@H](NC[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc21 ZINC000447536966 1124485376 /nfs/dbraw/zinc/48/53/76/1124485376.db2.gz ROSSZUNULRCPHG-YSSFQJQWSA-N 1 3 298.474 3.945 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+][C@H]2CCCC23CCC3)C1 ZINC000449211251 1124670698 /nfs/dbraw/zinc/67/06/98/1124670698.db2.gz RTIJFWKPDXYYEK-SJORKVTESA-N 1 3 278.484 3.667 20 0 CHADHO CC(C)CN1CCC[C@@H](C[NH2+][C@H]2CCCC23CCC3)C1 ZINC000449211249 1124670835 /nfs/dbraw/zinc/67/08/35/1124670835.db2.gz RTIJFWKPDXYYEK-IRXDYDNUSA-N 1 3 278.484 3.667 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H](C)CSC(C)(C)C)C1 ZINC000125850405 1124933911 /nfs/dbraw/zinc/93/39/11/1124933911.db2.gz VKPFGLUHCRMCTH-GJZGRUSLSA-N 1 3 286.529 3.617 20 0 CHADHO CSC(C)(C)CC[NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000877188812 1125018980 /nfs/dbraw/zinc/01/89/80/1125018980.db2.gz HIWLLFQYFDOOBP-GJZGRUSLSA-N 1 3 298.540 3.761 20 0 CHADHO c1ccc([C@@H]2CCCC[C@H]2[NH2+][C@H]2CCNC23CCC3)cc1 ZINC000530177150 1125130292 /nfs/dbraw/zinc/13/02/92/1125130292.db2.gz HRUPILPMQWZXIQ-KSZLIROESA-N 1 3 284.447 3.587 20 0 CHADHO CS[C@@H]1CCC[C@H]([NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000129378719 1125331649 /nfs/dbraw/zinc/33/16/49/1125331649.db2.gz HDUMDHBBEKLAFB-DOTOQJQBSA-N 1 3 296.524 3.657 20 0 CHADHO C[C@H](CCc1ccco1)NCCC[N@H+](C)C1CCCCC1 ZINC000037901170 1125369411 /nfs/dbraw/zinc/36/94/11/1125369411.db2.gz SBRQTHNNBGYQJN-MRXNPFEDSA-N 1 3 292.467 3.845 20 0 CHADHO C[C@H](CCc1ccco1)NCCC[N@@H+](C)C1CCCCC1 ZINC000037901170 1125369412 /nfs/dbraw/zinc/36/94/12/1125369412.db2.gz SBRQTHNNBGYQJN-MRXNPFEDSA-N 1 3 292.467 3.845 20 0 CHADHO CC[NH2+]CC1CCN([C@@H](C)c2cccc(Cl)c2)CC1 ZINC000131467130 1125392934 /nfs/dbraw/zinc/39/29/34/1125392934.db2.gz KJVONGDAHAZAAF-ZDUSSCGKSA-N 1 3 280.843 3.723 20 0 CHADHO C[C@@H]1CC[C@@H](N[C@@H](C[NH3+])c2ccc3ccccc3c2)C1 ZINC000131643370 1125402924 /nfs/dbraw/zinc/40/29/24/1125402924.db2.gz HOPZDBDYOOZPMX-XWIAVFTESA-N 1 3 268.404 3.618 20 0 CHADHO Cc1cccc([C@H]2CCCN2CC[C@@H]2CCCC[NH2+]2)c1 ZINC001204849313 1125433112 /nfs/dbraw/zinc/43/31/12/1125433112.db2.gz ZAXJDYUCZQGDQI-ZWKOTPCHSA-N 1 3 272.436 3.664 20 0 CHADHO CSC(C)(C)C[C@H](C)[NH2+]C1CCN(C2CCCC2)CC1 ZINC001258331107 1129207557 /nfs/dbraw/zinc/20/75/57/1129207557.db2.gz IBLICAXDGCEDIM-AWEZNQCLSA-N 1 3 298.540 3.903 20 0 CHADHO CC(C)[N@H+](CC[C@H]1CCCN1C)Cc1cccc(F)c1 ZINC000348084239 1129279773 /nfs/dbraw/zinc/27/97/73/1129279773.db2.gz WACWSMODLXLFLV-QGZVFWFLSA-N 1 3 278.415 3.520 20 0 CHADHO CC(C)[N@@H+](CC[C@H]1CCCN1C)Cc1cccc(F)c1 ZINC000348084239 1129279774 /nfs/dbraw/zinc/27/97/74/1129279774.db2.gz WACWSMODLXLFLV-QGZVFWFLSA-N 1 3 278.415 3.520 20 0 CHADHO C[C@H](CCN1CCC2(CCC2)C1)[N@@H+]1CCC2(CCC2)C1 ZINC000178316833 1129342299 /nfs/dbraw/zinc/34/22/99/1129342299.db2.gz ZMIMEQWQDGIMQS-MRXNPFEDSA-N 1 3 276.468 3.517 20 0 CHADHO C[C@H](CCN1CCC2(CCC2)C1)[N@H+]1CCC2(CCC2)C1 ZINC000178316833 1129342303 /nfs/dbraw/zinc/34/23/03/1129342303.db2.gz ZMIMEQWQDGIMQS-MRXNPFEDSA-N 1 3 276.468 3.517 20 0 CHADHO C[C@H](CC[N@@H+]1CCC2(CCC2)C1)N1CCC2(CCC2)C1 ZINC000178316833 1129342309 /nfs/dbraw/zinc/34/23/09/1129342309.db2.gz ZMIMEQWQDGIMQS-MRXNPFEDSA-N 1 3 276.468 3.517 20 0 CHADHO C[C@H](CC[N@H+]1CCC2(CCC2)C1)N1CCC2(CCC2)C1 ZINC000178316833 1129342314 /nfs/dbraw/zinc/34/23/14/1129342314.db2.gz ZMIMEQWQDGIMQS-MRXNPFEDSA-N 1 3 276.468 3.517 20 0 CHADHO CCCC[C@@H]1C[C@@H]([NH2+]C2CCC(CC)CC2)CCN1 ZINC001246169233 1131370942 /nfs/dbraw/zinc/37/09/42/1131370942.db2.gz BTJYNGUIOYQLFC-BACDZXNISA-N 1 3 266.473 3.856 20 0 CHADHO C[C@H](N[C@@H]1CCC[NH2+]CC1)c1cccc(-c2ccncc2)c1 ZINC000643522915 1129443505 /nfs/dbraw/zinc/44/35/05/1129443505.db2.gz USJOTOGRSXIGNI-HNAYVOBHSA-N 1 3 295.430 3.541 20 0 CHADHO C[C@H](CN)C[N@H+](Cc1ccccc1)[C@H]1CCC(C)(C)C1 ZINC001258598471 1129455082 /nfs/dbraw/zinc/45/50/82/1129455082.db2.gz HLTNIRILNWHCLV-WBVHZDCISA-N 1 3 274.452 3.662 20 0 CHADHO C[C@H](CN)C[N@@H+](Cc1ccccc1)[C@H]1CCC(C)(C)C1 ZINC001258598471 1129455083 /nfs/dbraw/zinc/45/50/83/1129455083.db2.gz HLTNIRILNWHCLV-WBVHZDCISA-N 1 3 274.452 3.662 20 0 CHADHO CC(C)C1([NH2+]C2CCN([C@H]3CCCC[C@H]3C)CC2)CC1 ZINC000645494367 1129499707 /nfs/dbraw/zinc/49/97/07/1129499707.db2.gz HXXUGWLZKVHJAC-WBVHZDCISA-N 1 3 278.484 3.808 20 0 CHADHO Clc1ccc(CN2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)s1 ZINC000647543223 1129580980 /nfs/dbraw/zinc/58/09/80/1129580980.db2.gz JQVZKISHFQNFTH-QWHCGFSZSA-N 1 3 298.883 3.613 20 0 CHADHO Clc1cscc1CN1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647544375 1129581021 /nfs/dbraw/zinc/58/10/21/1129581021.db2.gz ZOOAHPGAYKYUHG-STQMWFEESA-N 1 3 298.883 3.613 20 0 CHADHO [NH3+][C@@H]1C[C@H](NC[C@H]2C[C@@H]2c2ccccc2)c2ccccc21 ZINC000647800499 1129584911 /nfs/dbraw/zinc/58/49/11/1129584911.db2.gz CTGYCMXSMAKNAX-AXUOBQJMSA-N 1 3 278.399 3.525 20 0 CHADHO CC[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(C)cc1 ZINC001169099324 1129696419 /nfs/dbraw/zinc/69/64/19/1129696419.db2.gz PTUGUJFWLZWPPQ-XMTFNYHQSA-N 1 3 272.436 3.661 20 0 CHADHO CC[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(C)cc1 ZINC001169099324 1129696420 /nfs/dbraw/zinc/69/64/20/1129696420.db2.gz PTUGUJFWLZWPPQ-XMTFNYHQSA-N 1 3 272.436 3.661 20 0 CHADHO C[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)N2C)c1ccc(Cl)c(F)c1 ZINC001169097843 1129696941 /nfs/dbraw/zinc/69/69/41/1129696941.db2.gz CMNUBZBPLYLCBZ-RUZUBIRVSA-N 1 3 296.817 3.755 20 0 CHADHO CCN(CC)CCC[N@H+](C)[C@@H](C)C1CCCCC1 ZINC001169942028 1129766052 /nfs/dbraw/zinc/76/60/52/1129766052.db2.gz JNXQYRGSTJLDON-HNNXBMFYSA-N 1 3 254.462 3.619 20 0 CHADHO CCN(CC)CCC[N@@H+](C)[C@@H](C)C1CCCCC1 ZINC001169942028 1129766056 /nfs/dbraw/zinc/76/60/56/1129766056.db2.gz JNXQYRGSTJLDON-HNNXBMFYSA-N 1 3 254.462 3.619 20 0 CHADHO CCC[C@@H](NC1CC[NH+](CC)CC1)c1cccc(F)c1 ZINC001169229597 1129710472 /nfs/dbraw/zinc/71/04/72/1129710472.db2.gz DDJHNMAIYVIPND-QGZVFWFLSA-N 1 3 278.415 3.741 20 0 CHADHO CC[C@H](NCc1ccc(C[NH3+])cc1F)c1ccccc1 ZINC000650752568 1129721283 /nfs/dbraw/zinc/72/12/83/1129721283.db2.gz UHQTYPWZHOQCGL-KRWDZBQOSA-N 1 3 272.367 3.525 20 0 CHADHO Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2c1cncc2cc[nH]c21 ZINC001169694533 1129747304 /nfs/dbraw/zinc/74/73/04/1129747304.db2.gz CFSVOHOYENLFQI-HNNXBMFYSA-N 1 3 292.386 3.803 20 0 CHADHO CC[C@@H]1CCC[C@@H]([NH2+]C[C@@H](C)CN2CCCC2)CC1 ZINC000086908796 1129829642 /nfs/dbraw/zinc/82/96/42/1129829642.db2.gz IHPZDZHBKSCHFX-BRWVUGGUSA-N 1 3 266.473 3.667 20 0 CHADHO CC[C@@H]1CCC[C@H]([NH2+]C[C@@H](C)CN2CCCC2)CC1 ZINC000086908791 1129829954 /nfs/dbraw/zinc/82/99/54/1129829954.db2.gz IHPZDZHBKSCHFX-ZACQAIPSSA-N 1 3 266.473 3.667 20 0 CHADHO C(C1CCCCC1)N1CCC([NH2+][C@H]2CCC[C@H]3C[C@H]32)CC1 ZINC000800969086 1129900781 /nfs/dbraw/zinc/90/07/81/1129900781.db2.gz GWWLDQLYRYCSLK-UHOSZYNNSA-N 1 3 290.495 3.809 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NCC[C@H]2CCC(F)(F)C2)c2ccccc21 ZINC000902458887 1130013688 /nfs/dbraw/zinc/01/36/88/1130013688.db2.gz ZCUUDISSIJABGQ-KCPJHIHWSA-N 1 3 280.362 3.546 20 0 CHADHO C[C@H](NCCCCCCC[NH+]1CCCC1)c1nccs1 ZINC000772449889 1130022921 /nfs/dbraw/zinc/02/29/21/1130022921.db2.gz YASKXIKLFNLAIX-HNNXBMFYSA-N 1 3 295.496 3.840 20 0 CHADHO Cc1ccc(-c2ccccc2CN2CCC([NH3+])CC2)c(C)c1 ZINC001239810365 1130117730 /nfs/dbraw/zinc/11/77/30/1130117730.db2.gz IPBFUOBXIMYYQH-UHFFFAOYSA-N 1 3 294.442 3.894 20 0 CHADHO CSC1CCC(C[NH2+]C2CCN(C(C)(C)C)CC2)CC1 ZINC000903156073 1130120670 /nfs/dbraw/zinc/12/06/70/1130120670.db2.gz ALWGNTHAEPWLOX-UHFFFAOYSA-N 1 3 298.540 3.761 20 0 CHADHO Cc1ccccc1[C@@H]1C[C@H]1NC1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903195441 1130127874 /nfs/dbraw/zinc/12/78/74/1130127874.db2.gz YFPAZKNDSLAWIF-KFEZLTSHSA-N 1 3 296.458 3.598 20 0 CHADHO Cc1ccccc1[C@@H]1C[C@H]1NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1 ZINC000903195441 1130127878 /nfs/dbraw/zinc/12/78/78/1130127878.db2.gz YFPAZKNDSLAWIF-KFEZLTSHSA-N 1 3 296.458 3.598 20 0 CHADHO C[C@@H](N[C@H](CC[NH+](C)C)c1cccnc1)C1CCCCC1 ZINC000903383577 1130168963 /nfs/dbraw/zinc/16/89/63/1130168963.db2.gz NOBUUAHUYWLOCD-CRAIPNDOSA-N 1 3 289.467 3.633 20 0 CHADHO C(CN1CCC[C@H](C2CC2)C1)C[N@@H+]1CCC[C@@H](C2CC2)C1 ZINC000677056885 1130285092 /nfs/dbraw/zinc/28/50/92/1130285092.db2.gz KOTPVLVEXKUJFK-KDURUIRLSA-N 1 3 290.495 3.621 20 0 CHADHO C(CN1CCC[C@H](C2CC2)C1)C[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000677056885 1130285097 /nfs/dbraw/zinc/28/50/97/1130285097.db2.gz KOTPVLVEXKUJFK-KDURUIRLSA-N 1 3 290.495 3.621 20 0 CHADHO C(CN1CCC[C@@H](C2CC2)C1)C[N@@H+]1CCC[C@H](C2CC2)C1 ZINC000677056885 1130285101 /nfs/dbraw/zinc/28/51/01/1130285101.db2.gz KOTPVLVEXKUJFK-KDURUIRLSA-N 1 3 290.495 3.621 20 0 CHADHO C(CN1CCC[C@@H](C2CC2)C1)C[N@H+]1CCC[C@H](C2CC2)C1 ZINC000677056885 1130285106 /nfs/dbraw/zinc/28/51/06/1130285106.db2.gz KOTPVLVEXKUJFK-KDURUIRLSA-N 1 3 290.495 3.621 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@H]2N[C@H]1CC[N@H+](CC2CC2)C1 ZINC000678114372 1130350200 /nfs/dbraw/zinc/35/02/00/1130350200.db2.gz DNHIWLKOJDQTID-UWWQBHOKSA-N 1 3 284.447 3.617 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@H]2N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000678114372 1130350205 /nfs/dbraw/zinc/35/02/05/1130350205.db2.gz DNHIWLKOJDQTID-UWWQBHOKSA-N 1 3 284.447 3.617 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@H](c2ccccc2)C2CCC2)C1 ZINC000791133276 1130354556 /nfs/dbraw/zinc/35/45/56/1130354556.db2.gz AEDNFTMHTWEHNL-IPMKNSEASA-N 1 3 286.463 3.990 20 0 CHADHO C[NH+](C)[C@@H]1CCC[C@H](N[C@H](c2ccccc2)C2CCC2)C1 ZINC000791133276 1130354562 /nfs/dbraw/zinc/35/45/62/1130354562.db2.gz AEDNFTMHTWEHNL-IPMKNSEASA-N 1 3 286.463 3.990 20 0 CHADHO CC(C)[N@H+](CCCCc1ccccc1)[C@H]1CCCNCC1 ZINC001206579961 1130490845 /nfs/dbraw/zinc/49/08/45/1130490845.db2.gz BPXLWCMVMPTLNO-IBGZPJMESA-N 1 3 288.479 3.862 20 0 CHADHO CC(C)[N@@H+](CCCCc1ccccc1)[C@H]1CCCNCC1 ZINC001206579961 1130490850 /nfs/dbraw/zinc/49/08/50/1130490850.db2.gz BPXLWCMVMPTLNO-IBGZPJMESA-N 1 3 288.479 3.862 20 0 CHADHO CC(C)N(Cc1cccc(Cl)c1)[C@@H]1CCC[NH2+]CC1 ZINC001206580945 1130545983 /nfs/dbraw/zinc/54/59/83/1130545983.db2.gz GNZFMNGOABKBNC-MRXNPFEDSA-N 1 3 280.843 3.693 20 0 CHADHO Cc1cc(C)c(CN2CCC[C@]3(CCC[NH2+]3)CC2)c(C)c1 ZINC001235040314 1130704697 /nfs/dbraw/zinc/70/46/97/1130704697.db2.gz KJCBWQHAZAMDBG-LJQANCHMSA-N 1 3 286.463 3.720 20 0 CHADHO Cc1ccc([C@@H](C)CCN2CCC[C@]3(CCC[NH2+]3)CC2)o1 ZINC001235041889 1130705190 /nfs/dbraw/zinc/70/51/90/1130705190.db2.gz UPJVQLRBCLVELX-MAUKXSAKSA-N 1 3 290.451 3.690 20 0 CHADHO C[C@@H](CN1CCC2(CC[NH2+]2)CC1)c1cccc2ccccc21 ZINC001235105969 1130712400 /nfs/dbraw/zinc/71/24/00/1130712400.db2.gz JALFDSZPEYZXBM-INIZCTEOSA-N 1 3 294.442 3.771 20 0 CHADHO C[C@H](N[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc[nH]1 ZINC000781515911 1130723021 /nfs/dbraw/zinc/72/30/21/1130723021.db2.gz AVYONHUWZKGVCK-XYJFISCASA-N 1 3 297.446 3.718 20 0 CHADHO C[C@H](N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc[nH]1 ZINC000781515911 1130723026 /nfs/dbraw/zinc/72/30/26/1130723026.db2.gz AVYONHUWZKGVCK-XYJFISCASA-N 1 3 297.446 3.718 20 0 CHADHO Clc1ccccc1CN1CCC([C@H]2CCCC[NH2+]2)CC1 ZINC001235232381 1130725513 /nfs/dbraw/zinc/72/55/13/1130725513.db2.gz HVIQCTMTSGBWPO-QGZVFWFLSA-N 1 3 292.854 3.694 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)C[N@@H+]2CCC[C@@H](CN)C2)cc1 ZINC001235672845 1130763771 /nfs/dbraw/zinc/76/37/71/1130763771.db2.gz IOGXCQBDFKJLAE-AEFFLSMTSA-N 1 3 288.479 3.659 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCC[C@@H](CN)C2)cc1 ZINC001235672845 1130763774 /nfs/dbraw/zinc/76/37/74/1130763774.db2.gz IOGXCQBDFKJLAE-AEFFLSMTSA-N 1 3 288.479 3.659 20 0 CHADHO Cc1ccc(-c2ccc(CN3CCC[C@H](C[NH3+])C3)cc2)cc1 ZINC001235675158 1130765886 /nfs/dbraw/zinc/76/58/86/1130765886.db2.gz JYUYGZXFAIMQRE-GOSISDBHSA-N 1 3 294.442 3.833 20 0 CHADHO Cc1cccc(-c2ccc(CN3CCC[C@H](C[NH3+])C3)cc2)c1 ZINC001235677118 1130765939 /nfs/dbraw/zinc/76/59/39/1130765939.db2.gz YLYACKINFIASGZ-GOSISDBHSA-N 1 3 294.442 3.833 20 0 CHADHO C[C@@H](C[N@@H+]1CCC[C@H](CN)C1)c1cccc2ccccc21 ZINC001235675324 1130766650 /nfs/dbraw/zinc/76/66/50/1130766650.db2.gz VQKGUASDKMXFAQ-JKSUJKDBSA-N 1 3 282.431 3.614 20 0 CHADHO C[C@@H](C[N@H+]1CCC[C@H](CN)C1)c1cccc2ccccc21 ZINC001235675324 1130766655 /nfs/dbraw/zinc/76/66/55/1130766655.db2.gz VQKGUASDKMXFAQ-JKSUJKDBSA-N 1 3 282.431 3.614 20 0 CHADHO CC1([NH3+])CCN(Cc2ccccc2-c2ccccc2)CC1 ZINC001235750015 1130777128 /nfs/dbraw/zinc/77/71/28/1130777128.db2.gz YTGKBSYDRWMFSM-UHFFFAOYSA-N 1 3 280.415 3.667 20 0 CHADHO CCN(Cc1cccc(C(C)(C)C)c1)C1CC[NH2+]CC1 ZINC001235762951 1130777993 /nfs/dbraw/zinc/77/79/93/1130777993.db2.gz XESSXFBXZSZQHG-UHFFFAOYSA-N 1 3 274.452 3.558 20 0 CHADHO Cc1cc(CN2CC(CC[NH3+])C2)ccc1Oc1ccccc1 ZINC001235918126 1130804240 /nfs/dbraw/zinc/80/42/40/1130804240.db2.gz AGCMRFZVDGHWSG-UHFFFAOYSA-N 1 3 296.414 3.568 20 0 CHADHO CC[C@@H](c1ccccc1)N(C)CC[C@H]1CCCC[NH2+]1 ZINC001235960674 1130819130 /nfs/dbraw/zinc/81/91/30/1130819130.db2.gz WTYMWAJISIBTCF-SJORKVTESA-N 1 3 260.425 3.602 20 0 CHADHO C[C@H]1C[C@@H](N)C[N@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001236046408 1130836788 /nfs/dbraw/zinc/83/67/88/1130836788.db2.gz GGPOLPFVGNTJHF-MAUKXSAKSA-N 1 3 280.415 3.523 20 0 CHADHO C[C@H]1C[C@@H](N)C[N@@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001236046408 1130836792 /nfs/dbraw/zinc/83/67/92/1130836792.db2.gz GGPOLPFVGNTJHF-MAUKXSAKSA-N 1 3 280.415 3.523 20 0 CHADHO CCCN(Cc1cc(C)cc(SC)c1)C1CC[NH2+]CC1 ZINC001236184336 1130881135 /nfs/dbraw/zinc/88/11/35/1130881135.db2.gz ISZJBVYKOLQPLL-UHFFFAOYSA-N 1 3 292.492 3.681 20 0 CHADHO CCC[N@H+](Cc1cc(C)cc(SC)c1)C1CCNCC1 ZINC001236184336 1130881143 /nfs/dbraw/zinc/88/11/43/1130881143.db2.gz ISZJBVYKOLQPLL-UHFFFAOYSA-N 1 3 292.492 3.681 20 0 CHADHO CCC[N@@H+](Cc1cc(C)cc(SC)c1)C1CCNCC1 ZINC001236184336 1130881150 /nfs/dbraw/zinc/88/11/50/1130881150.db2.gz ISZJBVYKOLQPLL-UHFFFAOYSA-N 1 3 292.492 3.681 20 0 CHADHO CCCN(Cc1ccc(F)c(C2CC2)c1)C1CC[NH2+]CC1 ZINC001236184698 1130881317 /nfs/dbraw/zinc/88/13/17/1130881317.db2.gz LWWVOVYIXVWXNY-UHFFFAOYSA-N 1 3 290.426 3.667 20 0 CHADHO CCC[N@H+](Cc1ccc(C)c(Cl)c1C)C1CCNCC1 ZINC001236184802 1130881603 /nfs/dbraw/zinc/88/16/03/1130881603.db2.gz UXBCCOXGYWJCAP-UHFFFAOYSA-N 1 3 294.870 3.921 20 0 CHADHO CCC[N@@H+](Cc1ccc(C)c(Cl)c1C)C1CCNCC1 ZINC001236184802 1130881608 /nfs/dbraw/zinc/88/16/08/1130881608.db2.gz UXBCCOXGYWJCAP-UHFFFAOYSA-N 1 3 294.870 3.921 20 0 CHADHO CCCN(Cc1ccc(C)c(Cl)c1C)C1CC[NH2+]CC1 ZINC001236184802 1130881615 /nfs/dbraw/zinc/88/16/15/1130881615.db2.gz UXBCCOXGYWJCAP-UHFFFAOYSA-N 1 3 294.870 3.921 20 0 CHADHO CN(Cc1ccc(C(C)(C)C)cc1)C1(C)CC[NH2+]CC1 ZINC001236222327 1130894936 /nfs/dbraw/zinc/89/49/36/1130894936.db2.gz HRZVLJFVCXXWTK-UHFFFAOYSA-N 1 3 274.452 3.558 20 0 CHADHO C[N@H+](Cc1ccc(C(C)(C)C)cc1)C1(C)CCNCC1 ZINC001236222327 1130894940 /nfs/dbraw/zinc/89/49/40/1130894940.db2.gz HRZVLJFVCXXWTK-UHFFFAOYSA-N 1 3 274.452 3.558 20 0 CHADHO C[N@@H+](Cc1ccc(C(C)(C)C)cc1)C1(C)CCNCC1 ZINC001236222327 1130894942 /nfs/dbraw/zinc/89/49/42/1130894942.db2.gz HRZVLJFVCXXWTK-UHFFFAOYSA-N 1 3 274.452 3.558 20 0 CHADHO CCCCc1ccc(CN(C)C2(C)CC[NH2+]CC2)cc1 ZINC001236226067 1130897525 /nfs/dbraw/zinc/89/75/25/1130897525.db2.gz GQLRHZQTVJYUKI-UHFFFAOYSA-N 1 3 274.452 3.603 20 0 CHADHO CCCCc1ccc(C[N@H+](C)C2(C)CCNCC2)cc1 ZINC001236226067 1130897531 /nfs/dbraw/zinc/89/75/31/1130897531.db2.gz GQLRHZQTVJYUKI-UHFFFAOYSA-N 1 3 274.452 3.603 20 0 CHADHO CCCCc1ccc(C[N@@H+](C)C2(C)CCNCC2)cc1 ZINC001236226067 1130897538 /nfs/dbraw/zinc/89/75/38/1130897538.db2.gz GQLRHZQTVJYUKI-UHFFFAOYSA-N 1 3 274.452 3.603 20 0 CHADHO CCN(Cc1cccc(-c2ccccc2)c1)C[C@H]1CC[NH2+]C1 ZINC001236407150 1130931433 /nfs/dbraw/zinc/93/14/33/1130931433.db2.gz CNSLYAMWVOKJHM-SFHVURJKSA-N 1 3 294.442 3.785 20 0 CHADHO CC(C)=CCCC1=CC[C@H](CN(C)[C@@H]2[C@H]3C[NH2+]C[C@H]32)CC1 ZINC001236411148 1130931931 /nfs/dbraw/zinc/93/19/31/1130931931.db2.gz MYXBJKPMYYWSOL-INDMIFKZSA-N 1 3 288.479 3.609 20 0 CHADHO Cc1c(C)c(C)c(C[N@H+]2CCC[C@H](N)[C@@H]2C)c(C)c1C ZINC001236421399 1130936252 /nfs/dbraw/zinc/93/62/52/1130936252.db2.gz QRRJPLBXVFBYAG-WMZOPIPTSA-N 1 3 274.452 3.540 20 0 CHADHO Cc1c(C)c(C)c(C[N@@H+]2CCC[C@H](N)[C@@H]2C)c(C)c1C ZINC001236421399 1130936258 /nfs/dbraw/zinc/93/62/58/1130936258.db2.gz QRRJPLBXVFBYAG-WMZOPIPTSA-N 1 3 274.452 3.540 20 0 CHADHO C[C@@]1(C[NH3+])CCN(Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001236604809 1130984152 /nfs/dbraw/zinc/98/41/52/1130984152.db2.gz OKFRJINKPOVIRD-IBGZPJMESA-N 1 3 298.405 3.663 20 0 CHADHO Cc1cc(CN(C2CCC2)C2CC[NH2+]CC2)cc(C)c1F ZINC001236638266 1130986532 /nfs/dbraw/zinc/98/65/32/1130986532.db2.gz XSMGUZLGBBOCGM-UHFFFAOYSA-N 1 3 290.426 3.549 20 0 CHADHO Cc1cc(C[N@H+](C2CCC2)C2CCNCC2)cc(C)c1F ZINC001236638266 1130986536 /nfs/dbraw/zinc/98/65/36/1130986536.db2.gz XSMGUZLGBBOCGM-UHFFFAOYSA-N 1 3 290.426 3.549 20 0 CHADHO Cc1cc(C[N@@H+](C2CCC2)C2CCNCC2)cc(C)c1F ZINC001236638266 1130986539 /nfs/dbraw/zinc/98/65/39/1130986539.db2.gz XSMGUZLGBBOCGM-UHFFFAOYSA-N 1 3 290.426 3.549 20 0 CHADHO Cc1cc(F)ccc1[C@H](C)[NH2+][C@H]1CCC[C@@H](N(C)C)C1 ZINC000815586158 1131003498 /nfs/dbraw/zinc/00/34/98/1131003498.db2.gz ARDPKKYXXAOBCP-CWRNSKLLSA-N 1 3 278.415 3.658 20 0 CHADHO CCCN(Cc1csc2ccccc12)C[C@@H]1CC[NH2+]C1 ZINC001236835848 1131018191 /nfs/dbraw/zinc/01/81/91/1131018191.db2.gz PXQWYMYLJMFBOH-CQSZACIVSA-N 1 3 288.460 3.723 20 0 CHADHO CCCN(Cc1ccc(C(C)C)cc1)C[C@H]1CC[NH2+]C1 ZINC001236835608 1131018908 /nfs/dbraw/zinc/01/89/08/1131018908.db2.gz NWNPMDYPHMFSLK-KRWDZBQOSA-N 1 3 274.452 3.632 20 0 CHADHO C[C@@]1(C[NH3+])CCCN(Cc2cccc(-c3ccccc3)c2)C1 ZINC001237058097 1131044031 /nfs/dbraw/zinc/04/40/31/1131044031.db2.gz PHZSOTKRRAYBTN-FQEVSTJZSA-N 1 3 294.442 3.914 20 0 CHADHO C[NH+]1CCC2(CCCN(Cc3sccc3Cl)C2)CC1 ZINC000798956909 1131064759 /nfs/dbraw/zinc/06/47/59/1131064759.db2.gz PLQMYLNRBMMDDY-UHFFFAOYSA-N 1 3 298.883 3.709 20 0 CHADHO C[C@@H]1C[C@H](N)C[N@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001237203627 1131071332 /nfs/dbraw/zinc/07/13/32/1131071332.db2.gz JJLWRAZSUHLRAI-YPMHNXCESA-N 1 3 298.883 3.632 20 0 CHADHO C[C@@H]1C[C@H](N)C[N@@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001237203627 1131071326 /nfs/dbraw/zinc/07/13/26/1131071326.db2.gz JJLWRAZSUHLRAI-YPMHNXCESA-N 1 3 298.883 3.632 20 0 CHADHO CCN1CCC[C@@H](C[NH2+][C@H]2CC(C)(C)Cc3occc32)C1 ZINC001116293568 1131140166 /nfs/dbraw/zinc/14/01/66/1131140166.db2.gz SGOLPDYPYRLKCA-HOCLYGCPSA-N 1 3 290.451 3.615 20 0 CHADHO CCC[N@H+](CC)Cc1ccc2c(c1)C(C(C)C)=NCC2 ZINC001237880940 1131146444 /nfs/dbraw/zinc/14/64/44/1131146444.db2.gz KIKLBQUFCITYTA-UHFFFAOYSA-N 1 3 272.436 3.920 20 0 CHADHO CCC[N@@H+](CC)Cc1ccc2c(c1)C(C(C)C)=NCC2 ZINC001237880940 1131146447 /nfs/dbraw/zinc/14/64/47/1131146447.db2.gz KIKLBQUFCITYTA-UHFFFAOYSA-N 1 3 272.436 3.920 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+]3C[C@@H]4[C@H](C3)C4(C)C)cc21 ZINC001237888080 1131148906 /nfs/dbraw/zinc/14/89/06/1131148906.db2.gz ZPVLEMUZLPXYOS-HDICACEKSA-N 1 3 296.458 3.776 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+]3C[C@@H]4[C@H](C3)C4(C)C)cc21 ZINC001237888080 1131148908 /nfs/dbraw/zinc/14/89/08/1131148908.db2.gz ZPVLEMUZLPXYOS-HDICACEKSA-N 1 3 296.458 3.776 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(CN)nc2C)s1 ZINC000817895386 1131186578 /nfs/dbraw/zinc/18/65/78/1131186578.db2.gz URFDJEUUCOYGMR-WCQYABFASA-N 1 3 289.448 3.630 20 0 CHADHO N[C@@H]1C[C@@H]([NH2+]CCSCc2ccccc2)c2ccccc21 ZINC000817896888 1131186646 /nfs/dbraw/zinc/18/66/46/1131186646.db2.gz YCHQXIQMODDGJN-QZTJIDSGSA-N 1 3 298.455 3.654 20 0 CHADHO C[C@H](NCc1ccc(CC[NH3+])cc1)c1cccc(Cl)c1 ZINC000817946926 1131189687 /nfs/dbraw/zinc/18/96/87/1131189687.db2.gz ICVPKSURHNKYJW-ZDUSSCGKSA-N 1 3 288.822 3.692 20 0 CHADHO CCOc1cccc([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000817962156 1131192454 /nfs/dbraw/zinc/19/24/54/1131192454.db2.gz GOGMOHOPCCQDHL-HUUCEWRRSA-N 1 3 298.430 3.956 20 0 CHADHO CCCCC[C@H]([NH2+][C@@H]1CCNC[C@@H]1C)C(C)(C)C ZINC000817969957 1131193779 /nfs/dbraw/zinc/19/37/79/1131193779.db2.gz IMKHPYHLMZEPFF-ZNMIVQPWSA-N 1 3 254.462 3.569 20 0 CHADHO C1CC2(C1)C[C@@H]([NH2+][C@@H]1CC[C@H]3CCCC[C@@H]3C1)CCN2 ZINC000817985065 1131194770 /nfs/dbraw/zinc/19/47/70/1131194770.db2.gz GFFITFXQTLVWCA-VQHPVUNQSA-N 1 3 276.468 3.610 20 0 CHADHO CCCCCC(C)(C)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246229036 1131415596 /nfs/dbraw/zinc/41/55/96/1131415596.db2.gz HZUSNEQQGLTZJG-FICVDOATSA-N 1 3 252.446 3.608 20 0 CHADHO Cc1ccc(C[NH+]2CCC3(CN(C)C3)CC2)c2ccccc12 ZINC001138018460 1131451457 /nfs/dbraw/zinc/45/14/57/1131451457.db2.gz YITNHQFXPJNUIZ-UHFFFAOYSA-N 1 3 294.442 3.676 20 0 CHADHO C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@@H](C)CCN ZINC001246302204 1131454748 /nfs/dbraw/zinc/45/47/48/1131454748.db2.gz WPAZGVGBLWPVSS-MNOVXSKESA-N 1 3 289.250 3.641 20 0 CHADHO CC(C)C[C@@H](C)C[C@@H](C)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246332459 1131473692 /nfs/dbraw/zinc/47/36/92/1131473692.db2.gz MEVQNONUQLUQKQ-MTSZKFMLSA-N 1 3 266.473 3.710 20 0 CHADHO CC[C@H](C[C@@H](C)CC)NC[C@]1(CC2CC2)CCC[NH2+]1 ZINC001246463065 1131511619 /nfs/dbraw/zinc/51/16/19/1131511619.db2.gz VJIZKHFTZDEWCU-USXIJHARSA-N 1 3 266.473 3.713 20 0 CHADHO CCN(CC)CCC[NH2+][C@H]1CCc2cc(Cl)ccc2C1 ZINC001171089533 1131512646 /nfs/dbraw/zinc/51/26/46/1131512646.db2.gz AOWCLRLINNENIT-KRWDZBQOSA-N 1 3 294.870 3.519 20 0 CHADHO CCOc1cccc([C@H](C)NCc2ccccc2C[NH2+]C)c1 ZINC000844923320 1131607961 /nfs/dbraw/zinc/60/79/61/1131607961.db2.gz FJCHWMGDJZRORT-HNNXBMFYSA-N 1 3 298.430 3.656 20 0 CHADHO CCCCC[C@H](CCC)[N@@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001246564303 1131628691 /nfs/dbraw/zinc/62/86/91/1131628691.db2.gz MNHZRLPECFKWPV-JYJNAYRXSA-N 1 3 254.462 3.795 20 0 CHADHO CCCCC[C@H](CCC)[N@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001246564303 1131628697 /nfs/dbraw/zinc/62/86/97/1131628697.db2.gz MNHZRLPECFKWPV-JYJNAYRXSA-N 1 3 254.462 3.795 20 0 CHADHO C[C@]1(CN)CCCC[N@@H+](C2CCC(C(F)(F)F)CC2)C1 ZINC001246587233 1131698871 /nfs/dbraw/zinc/69/88/71/1131698871.db2.gz WFXDYJSTKKUMRO-JXQTWKCFSA-N 1 3 292.389 3.558 20 0 CHADHO C[C@]1(CN)CCCC[N@H+](C2CCC(C(F)(F)F)CC2)C1 ZINC001246587233 1131698873 /nfs/dbraw/zinc/69/88/73/1131698873.db2.gz WFXDYJSTKKUMRO-JXQTWKCFSA-N 1 3 292.389 3.558 20 0 CHADHO C[C@]1(C[NH3+])CCCCN(C2CCC(C(F)(F)F)CC2)C1 ZINC001246587233 1131698877 /nfs/dbraw/zinc/69/88/77/1131698877.db2.gz WFXDYJSTKKUMRO-JXQTWKCFSA-N 1 3 292.389 3.558 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[N@@H+]1C[C@H](CN)CC[C@H]1C ZINC001246590676 1131707157 /nfs/dbraw/zinc/70/71/57/1131707157.db2.gz KOXSXBBJXLGTDG-FZKCQIBNSA-N 1 3 254.462 3.506 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[N@H+]1C[C@H](CN)CC[C@H]1C ZINC001246590676 1131707161 /nfs/dbraw/zinc/70/71/61/1131707161.db2.gz KOXSXBBJXLGTDG-FZKCQIBNSA-N 1 3 254.462 3.506 20 0 CHADHO CC(C)[N@H+]([C@H]1CC[C@@H](C)[C@H](C)C1)[C@@H]1CCCNCC1 ZINC001246595927 1131710317 /nfs/dbraw/zinc/71/03/17/1131710317.db2.gz UFKAVLUQOMPHCP-VQHPVUNQSA-N 1 3 266.473 3.664 20 0 CHADHO CC(C)[N@@H+]([C@H]1CC[C@@H](C)[C@H](C)C1)[C@@H]1CCCNCC1 ZINC001246595927 1131710322 /nfs/dbraw/zinc/71/03/22/1131710322.db2.gz UFKAVLUQOMPHCP-VQHPVUNQSA-N 1 3 266.473 3.664 20 0 CHADHO CCCC[C@H](CC(C)C)[N@@H+]1C[C@@H](CF)[C@H](C2(N)CC2)C1 ZINC001246689309 1131782495 /nfs/dbraw/zinc/78/24/95/1131782495.db2.gz INTDLKHXRBRWHH-BZUAXINKSA-N 1 3 284.463 3.600 20 0 CHADHO CCCC[C@H](CC(C)C)[N@H+]1C[C@@H](CF)[C@H](C2(N)CC2)C1 ZINC001246689309 1131782501 /nfs/dbraw/zinc/78/25/01/1131782501.db2.gz INTDLKHXRBRWHH-BZUAXINKSA-N 1 3 284.463 3.600 20 0 CHADHO CCC(C)(C)C1CCC(N2CCCC3(C[NH2+]C3)C2)CC1 ZINC001246791525 1131783829 /nfs/dbraw/zinc/78/38/29/1131783829.db2.gz KXDKGRCVVGMKPT-UHFFFAOYSA-N 1 3 278.484 3.667 20 0 CHADHO CCC(C)(C)C1CCC([N@@H+]2CCCC3(CNC3)C2)CC1 ZINC001246791525 1131783835 /nfs/dbraw/zinc/78/38/35/1131783835.db2.gz KXDKGRCVVGMKPT-UHFFFAOYSA-N 1 3 278.484 3.667 20 0 CHADHO CCC(C)(C)C1CCC([N@H+]2CCCC3(CNC3)C2)CC1 ZINC001246791525 1131783839 /nfs/dbraw/zinc/78/38/39/1131783839.db2.gz KXDKGRCVVGMKPT-UHFFFAOYSA-N 1 3 278.484 3.667 20 0 CHADHO C(CN1CCCC2(CCC2)C1)C[N@@H+]1CCCC2(CCC2)C1 ZINC000348194061 1131895787 /nfs/dbraw/zinc/89/57/87/1131895787.db2.gz PLSMYNCFUIFNPD-UHFFFAOYSA-N 1 3 290.495 3.909 20 0 CHADHO C(CN1CCCC2(CCC2)C1)C[N@H+]1CCCC2(CCC2)C1 ZINC000348194061 1131895798 /nfs/dbraw/zinc/89/57/98/1131895798.db2.gz PLSMYNCFUIFNPD-UHFFFAOYSA-N 1 3 290.495 3.909 20 0 CHADHO C[C@@H]([NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)C1(C)CC1 ZINC000716639065 1132029325 /nfs/dbraw/zinc/02/93/25/1132029325.db2.gz RNDOBBAHCMLEFS-LULLPPNCSA-N 1 3 298.474 3.818 20 0 CHADHO CC/C=C\CN[C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716693637 1132029621 /nfs/dbraw/zinc/02/96/21/1132029621.db2.gz PKCXEMACMXKXRN-LJYNCLAQSA-N 1 3 284.447 3.595 20 0 CHADHO CC/C=C\CN[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716693637 1132029628 /nfs/dbraw/zinc/02/96/28/1132029628.db2.gz PKCXEMACMXKXRN-LJYNCLAQSA-N 1 3 284.447 3.595 20 0 CHADHO CC/C=C\C[NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000716693637 1132029635 /nfs/dbraw/zinc/02/96/35/1132029635.db2.gz PKCXEMACMXKXRN-LJYNCLAQSA-N 1 3 284.447 3.595 20 0 CHADHO C[C@@H]([NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)C1(C)CC1 ZINC000716639057 1132029693 /nfs/dbraw/zinc/02/96/93/1132029693.db2.gz RNDOBBAHCMLEFS-BVBHFADKSA-N 1 3 298.474 3.818 20 0 CHADHO C[C@H]1CCCC[C@@H]1[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001171617532 1132066059 /nfs/dbraw/zinc/06/60/59/1132066059.db2.gz MXIHFMCLJKSYAT-ZFWWWQNUSA-N 1 3 266.473 3.806 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cc(F)cc(Cl)c1)C2 ZINC001172098842 1132122977 /nfs/dbraw/zinc/12/29/77/1132122977.db2.gz GTGQJFJCDOONCG-PHZGNYQRSA-N 1 3 296.817 3.584 20 0 CHADHO CN(Cc1ccc(Cl)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172125927 1132124673 /nfs/dbraw/zinc/12/46/73/1132124673.db2.gz RVWUDDLTHQFYPW-FVQHAEBGSA-N 1 3 292.854 3.787 20 0 CHADHO CN(Cc1ccc(Cl)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172125927 1132124676 /nfs/dbraw/zinc/12/46/76/1132124676.db2.gz RVWUDDLTHQFYPW-FVQHAEBGSA-N 1 3 292.854 3.787 20 0 CHADHO CCN(Cc1ccc(F)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172128591 1132128280 /nfs/dbraw/zinc/12/82/80/1132128280.db2.gz SOACLEDMOCQTPI-PIIMJCKOSA-N 1 3 290.426 3.663 20 0 CHADHO CCN(Cc1ccc(F)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172128591 1132128284 /nfs/dbraw/zinc/12/82/84/1132128284.db2.gz SOACLEDMOCQTPI-PIIMJCKOSA-N 1 3 290.426 3.663 20 0 CHADHO Cc1ccccc1[C@H](C)N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172110752 1132130323 /nfs/dbraw/zinc/13/03/23/1132130323.db2.gz ONNXRUGQLAPQTR-LUKYLMHMSA-N 1 3 272.436 3.661 20 0 CHADHO Cc1ccccc1[C@H](C)N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172110752 1132130326 /nfs/dbraw/zinc/13/03/26/1132130326.db2.gz ONNXRUGQLAPQTR-LUKYLMHMSA-N 1 3 272.436 3.661 20 0 CHADHO CC[N@H+](Cc1ccccc1F)[C@@H]1C[C@H]2CCC[C@@H](C1)N2C ZINC001172120235 1132132614 /nfs/dbraw/zinc/13/26/14/1132132614.db2.gz BERKIGIGUZQOSK-BJWYYQGGSA-N 1 3 290.426 3.663 20 0 CHADHO CC[N@@H+](Cc1ccccc1F)[C@@H]1C[C@H]2CCC[C@@H](C1)N2C ZINC001172120235 1132132618 /nfs/dbraw/zinc/13/26/18/1132132618.db2.gz BERKIGIGUZQOSK-BJWYYQGGSA-N 1 3 290.426 3.663 20 0 CHADHO CC(C)P(CC[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2C)C(C)C ZINC001172111873 1132134614 /nfs/dbraw/zinc/13/46/14/1132134614.db2.gz XMKIPZLQZFZOFO-BJWYYQGGSA-N 1 3 298.455 3.890 20 0 CHADHO CC[C@@H](C)OCC[C@@H](C)[NH2+]C1CCN(C2CCCC2)CC1 ZINC001172343748 1132177837 /nfs/dbraw/zinc/17/78/37/1132177837.db2.gz RKCLJFXNPNJLNX-HZPDHXFCSA-N 1 3 296.499 3.577 20 0 CHADHO CN1CC[C@@H]2C[N@@H+]([C@@H]3CCC[C@@H](c4ccccc4)C3)C[C@@H]2C1 ZINC001172540520 1132276313 /nfs/dbraw/zinc/27/63/13/1132276313.db2.gz ILMUPLKDLOPEKG-YSTOQKLRSA-N 1 3 298.474 3.596 20 0 CHADHO CN1CC[C@@H]2C[N@H+]([C@@H]3CCC[C@@H](c4ccccc4)C3)C[C@@H]2C1 ZINC001172540520 1132276319 /nfs/dbraw/zinc/27/63/19/1132276319.db2.gz ILMUPLKDLOPEKG-YSTOQKLRSA-N 1 3 298.474 3.596 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@@H+]2CC[C@H]3CCC[C@@H]3C2)c1 ZINC001232145224 1132428367 /nfs/dbraw/zinc/42/83/67/1132428367.db2.gz YQIMIRWMOGEAKI-IAGOWNOFSA-N 1 3 290.426 3.509 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@H+]2CC[C@H]3CCC[C@@H]3C2)c1 ZINC001232145224 1132428371 /nfs/dbraw/zinc/42/83/71/1132428371.db2.gz YQIMIRWMOGEAKI-IAGOWNOFSA-N 1 3 290.426 3.509 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)c1 ZINC001232146715 1132428509 /nfs/dbraw/zinc/42/85/09/1132428509.db2.gz ZWEDBQNMIHHUAE-WMZOPIPTSA-N 1 3 290.426 3.652 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)c1 ZINC001232146715 1132428511 /nfs/dbraw/zinc/42/85/11/1132428511.db2.gz ZWEDBQNMIHHUAE-WMZOPIPTSA-N 1 3 290.426 3.652 20 0 CHADHO CC[C@H]1CC[C@@H]([N@H+](CCCN)C2CCCCC2)C1 ZINC001173265665 1132431694 /nfs/dbraw/zinc/43/16/94/1132431694.db2.gz UUMARGQPWSJHOW-GOEBONIOSA-N 1 3 252.446 3.549 20 0 CHADHO CC[C@H]1CC[C@@H]([N@@H+](CCCN)C2CCCCC2)C1 ZINC001173265665 1132431699 /nfs/dbraw/zinc/43/16/99/1132431699.db2.gz UUMARGQPWSJHOW-GOEBONIOSA-N 1 3 252.446 3.549 20 0 CHADHO CC[C@H]1CC[C@H](N2CCC([NH3+])(c3cccc(F)c3)CC2)C1 ZINC001173269125 1132434516 /nfs/dbraw/zinc/43/45/16/1132434516.db2.gz FSFZCJQNLGOCLI-YOEHRIQHSA-N 1 3 290.426 3.654 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+][C@H]1CCCC2(CCCCC2)C1 ZINC001173341980 1132468815 /nfs/dbraw/zinc/46/88/15/1132468815.db2.gz UKWXUEAQWNYKAL-DLBZAZTESA-N 1 3 278.484 3.953 20 0 CHADHO CCCC1CCC(C[NH2+]C[C@@H]2CCCCN(C)C2)CC1 ZINC001203136144 1132526838 /nfs/dbraw/zinc/52/68/38/1132526838.db2.gz LQCHSYFOBCIVHC-ABHNRTSZSA-N 1 3 280.500 3.914 20 0 CHADHO [NH3+][C@@H]1CCCN(Cc2ccc3c(c2)Cc2ccccc2-3)CC1 ZINC001205110712 1133531470 /nfs/dbraw/zinc/53/14/70/1133531470.db2.gz YZCPNBJIQOLLQH-GOSISDBHSA-N 1 3 292.426 3.571 20 0 CHADHO CCC(C)(C)c1ccc(CN2CCC[C@@H]([NH3+])CC2)cc1 ZINC001205117366 1133531879 /nfs/dbraw/zinc/53/18/79/1133531879.db2.gz OYARFVHUJRRNRB-QGZVFWFLSA-N 1 3 274.452 3.687 20 0 CHADHO C[C@@H]1c2ccccc2CCN1Cc1cc2c(s1)CC[NH2+]C2 ZINC001205164628 1133539120 /nfs/dbraw/zinc/53/91/20/1133539120.db2.gz JSACXPUJCZEJDD-CYBMUJFWSA-N 1 3 298.455 3.513 20 0 CHADHO C[C@@H]1CN(Cc2cc3c(s2)C[NH2+]CC3)Cc2ccccc21 ZINC001205164417 1133539814 /nfs/dbraw/zinc/53/98/14/1133539814.db2.gz FSAZPDRAHTUUKX-CYBMUJFWSA-N 1 3 298.455 3.513 20 0 CHADHO Cc1ccc(-c2ccc(CN3CCC[C@@](C)([NH3+])CC3)cc2)o1 ZINC001205281798 1133554740 /nfs/dbraw/zinc/55/47/40/1133554740.db2.gz YIMKZTPHYNHYFX-LJQANCHMSA-N 1 3 298.430 3.958 20 0 CHADHO CCSc1ccccc1CN1CCC[C@](C)([NH3+])CC1 ZINC001205296406 1133556134 /nfs/dbraw/zinc/55/61/34/1133556134.db2.gz OMDSFMVWAASEEZ-INIZCTEOSA-N 1 3 278.465 3.502 20 0 CHADHO Cc1c(C[N@H+]2CCNCC[C@@H]2C)cccc1-c1ccccc1 ZINC001205333311 1133563553 /nfs/dbraw/zinc/56/35/53/1133563553.db2.gz ZTRVRQKBTLWUDZ-INIZCTEOSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1c(C[N@@H+]2CCNCC[C@@H]2C)cccc1-c1ccccc1 ZINC001205333311 1133563558 /nfs/dbraw/zinc/56/35/58/1133563558.db2.gz ZTRVRQKBTLWUDZ-INIZCTEOSA-N 1 3 294.442 3.846 20 0 CHADHO C[C@H](CC[NH2+]CCc1cccc(Cl)c1)N1CCCCC1 ZINC001205391400 1133573606 /nfs/dbraw/zinc/57/36/06/1133573606.db2.gz NDHXERVAJLNMCH-OAHLLOKOSA-N 1 3 294.870 3.737 20 0 CHADHO C[C@H](CCNCCc1cccc(Cl)c1)[NH+]1CCCCC1 ZINC001205391400 1133573609 /nfs/dbraw/zinc/57/36/09/1133573609.db2.gz NDHXERVAJLNMCH-OAHLLOKOSA-N 1 3 294.870 3.737 20 0 CHADHO CC1CCN(CCC[NH2+][C@@H]2CC[C@H](C)[C@H](C)C2)CC1 ZINC000084982623 1133582686 /nfs/dbraw/zinc/58/26/86/1133582686.db2.gz JXGMPWGWCOOPPO-GVDBMIGSSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@@H]1CCC[C@@H](C[NH2+]CC(C)(C)CN2CCCC2)C1 ZINC001205646158 1133598366 /nfs/dbraw/zinc/59/83/66/1133598366.db2.gz YRMYFNLMUGMGJS-HZPDHXFCSA-N 1 3 266.473 3.524 20 0 CHADHO C[C@H]1[C@@H](C[NH3+])CCCN1Cc1cccc2c(F)cccc12 ZINC001205914490 1133630380 /nfs/dbraw/zinc/63/03/80/1133630380.db2.gz MMHVVNJVTHOLCH-UONOGXRCSA-N 1 3 286.394 3.538 20 0 CHADHO CCC(C)(C)c1ccc(CN2CCC[C@@H](C[NH3+])[C@H]2C)cc1 ZINC001205915631 1133630499 /nfs/dbraw/zinc/63/04/99/1133630499.db2.gz QBHYTVOJOALMKM-WBVHZDCISA-N 1 3 288.479 3.933 20 0 CHADHO C[C@H]1CNCC[N@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001206277592 1133681231 /nfs/dbraw/zinc/68/12/31/1133681231.db2.gz VASLSXAKSCEHBI-AWEZNQCLSA-N 1 3 294.398 3.627 20 0 CHADHO C[C@H]1CNCC[N@@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001206277592 1133681233 /nfs/dbraw/zinc/68/12/33/1133681233.db2.gz VASLSXAKSCEHBI-AWEZNQCLSA-N 1 3 294.398 3.627 20 0 CHADHO Cc1ccc(F)c(CN2CCC[C@](C)(C[NH3+])CC2)c1Cl ZINC001206303206 1133686724 /nfs/dbraw/zinc/68/67/24/1133686724.db2.gz CWHHECHSOJKFMN-INIZCTEOSA-N 1 3 298.833 3.738 20 0 CHADHO Cc1ccc(Cl)c(CN2CCC[C@@](C)(C[NH3+])CC2)c1F ZINC001206303700 1133687174 /nfs/dbraw/zinc/68/71/74/1133687174.db2.gz GCWMMMVHENTKTB-MRXNPFEDSA-N 1 3 298.833 3.738 20 0 CHADHO Cc1cc(F)cc(CN2CCC[C@](C)(C[NH3+])CC2)c1Cl ZINC001206326846 1133689824 /nfs/dbraw/zinc/68/98/24/1133689824.db2.gz PSVYWUNHWUKXMX-INIZCTEOSA-N 1 3 298.833 3.738 20 0 CHADHO CC/C=C\CCC[N@H+](C(C)C)[C@@H]1CCCNCC1 ZINC001206580499 1133722376 /nfs/dbraw/zinc/72/23/76/1133722376.db2.gz DACYALWUTPIKKF-OGZRUICASA-N 1 3 252.446 3.585 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@@H+]1CCCC[C@@H](CN)C1 ZINC001206606581 1133726560 /nfs/dbraw/zinc/72/65/60/1133726560.db2.gz PYWPPOWDSWDBMO-IRXDYDNUSA-N 1 3 298.515 3.669 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@H+]1CCCC[C@@H](CN)C1 ZINC001206606581 1133726565 /nfs/dbraw/zinc/72/65/65/1133726565.db2.gz PYWPPOWDSWDBMO-IRXDYDNUSA-N 1 3 298.515 3.669 20 0 CHADHO C[C@H](CC[N@H+]1C[C@@H](CN)CC[C@H]1C)CC(C)(C)C ZINC001206760926 1133743927 /nfs/dbraw/zinc/74/39/27/1133743927.db2.gz OGMNEGGPDVROSS-RBSFLKMASA-N 1 3 254.462 3.508 20 0 CHADHO C[C@@H]1CC[C@@H](CN)C[N@@H+]1CC1(c2ccccc2)CCCC1 ZINC001206760536 1133743452 /nfs/dbraw/zinc/74/34/52/1133743452.db2.gz JCRAOKMRKWHCLY-SJORKVTESA-N 1 3 286.463 3.558 20 0 CHADHO C[C@@H]1CC[C@@H](CN)C[N@H+]1CC1(c2ccccc2)CCCC1 ZINC001206760536 1133743457 /nfs/dbraw/zinc/74/34/57/1133743457.db2.gz JCRAOKMRKWHCLY-SJORKVTESA-N 1 3 286.463 3.558 20 0 CHADHO C[C@H](CC[N@@H+]1C[C@@H](CN)CC[C@H]1C)CC(C)(C)C ZINC001206760926 1133743923 /nfs/dbraw/zinc/74/39/23/1133743923.db2.gz OGMNEGGPDVROSS-RBSFLKMASA-N 1 3 254.462 3.508 20 0 CHADHO C[C@H](CC[N@@H+]1C[C@H](CN)CC[C@H]1C)CC(C)(C)C ZINC001206760924 1133743897 /nfs/dbraw/zinc/74/38/97/1133743897.db2.gz OGMNEGGPDVROSS-KFWWJZLASA-N 1 3 254.462 3.508 20 0 CHADHO C[C@H](CC[N@H+]1C[C@H](CN)CC[C@H]1C)CC(C)(C)C ZINC001206760924 1133743902 /nfs/dbraw/zinc/74/39/02/1133743902.db2.gz OGMNEGGPDVROSS-KFWWJZLASA-N 1 3 254.462 3.508 20 0 CHADHO CC1([NH+]2CCCC2)CCN(CCC2CCCCC2)CC1 ZINC001207261005 1133783383 /nfs/dbraw/zinc/78/33/83/1133783383.db2.gz GVXDDUJZJUZRQQ-UHFFFAOYSA-N 1 3 278.484 3.907 20 0 CHADHO CCCN1C[C@@H]2C[NH+](CC[C@H]3CC=C(C)C3(C)C)C[C@H]2C1 ZINC001207274622 1133785375 /nfs/dbraw/zinc/78/53/75/1133785375.db2.gz DDRNFSHSERVDMF-KZNAEPCWSA-N 1 3 290.495 3.643 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@H]1CCC[C@@H](C2CC2)C1 ZINC001207858151 1133854931 /nfs/dbraw/zinc/85/49/31/1133854931.db2.gz FOSZGPATCCVLOF-UAGQMJEPSA-N 1 3 266.473 3.665 20 0 CHADHO CCN(Cc1cccc(F)c1F)CC1(C)CC[NH+](C)CC1 ZINC001208112151 1133876316 /nfs/dbraw/zinc/87/63/16/1133876316.db2.gz RYVHYQJZSODBHU-UHFFFAOYSA-N 1 3 296.405 3.519 20 0 CHADHO CC/C=C\CCCCC[N@@H+]1C[C@H]2CN(CCC)C[C@H]2C1 ZINC001208193894 1133904028 /nfs/dbraw/zinc/90/40/28/1133904028.db2.gz GXESVTSFDICLAR-SPCWZHTESA-N 1 3 278.484 3.787 20 0 CHADHO CC/C=C\CCCCC[N@H+]1C[C@H]2CN(CCC)C[C@H]2C1 ZINC001208193894 1133904032 /nfs/dbraw/zinc/90/40/32/1133904032.db2.gz GXESVTSFDICLAR-SPCWZHTESA-N 1 3 278.484 3.787 20 0 CHADHO CC/C=C\CCCCCN1C[C@@H]2C[N@H+](CCC)C[C@@H]2C1 ZINC001208193894 1133904036 /nfs/dbraw/zinc/90/40/36/1133904036.db2.gz GXESVTSFDICLAR-SPCWZHTESA-N 1 3 278.484 3.787 20 0 CHADHO CC/C=C\CCCCCN1C[C@@H]2C[N@@H+](CCC)C[C@@H]2C1 ZINC001208193894 1133904043 /nfs/dbraw/zinc/90/40/43/1133904043.db2.gz GXESVTSFDICLAR-SPCWZHTESA-N 1 3 278.484 3.787 20 0 CHADHO C[NH2+]Cc1cccc(Nc2ccnc(C3CCC3)c2)c1F ZINC001216223467 1134810872 /nfs/dbraw/zinc/81/08/72/1134810872.db2.gz VCYYSOMQMFMFDU-UHFFFAOYSA-N 1 3 285.366 3.951 20 0 CHADHO CC[C@@H](NC1CC[NH+](CC2CC2)CC1)c1cccc(C)c1 ZINC000353454281 529681782 /nfs/dbraw/zinc/68/17/82/529681782.db2.gz JMHONMHUNVQOFW-LJQANCHMSA-N 1 3 286.463 3.910 20 0 CHADHO C[N@@H+]1CC[C@H](N[C@@H]2CCCc3ccccc32)[C@@H]2CCC[C@@H]21 ZINC000353453211 529807001 /nfs/dbraw/zinc/80/70/01/529807001.db2.gz FDMPLUIJUZJSGG-RDGPPVDQSA-N 1 3 284.447 3.526 20 0 CHADHO C[N@H+]1CC[C@H](N[C@@H]2CCCc3ccccc32)[C@@H]2CCC[C@@H]21 ZINC000353453211 529807002 /nfs/dbraw/zinc/80/70/02/529807002.db2.gz FDMPLUIJUZJSGG-RDGPPVDQSA-N 1 3 284.447 3.526 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000093212586 260273217 /nfs/dbraw/zinc/27/32/17/260273217.db2.gz DKEDPEYPSYGBHD-JQFCIGGWSA-N 1 3 260.425 3.731 20 0 CHADHO CN(C)Cc1ccc(C[NH2+][C@@H]2CCCC23CCCC3)cc1 ZINC000574263131 335004966 /nfs/dbraw/zinc/00/49/66/335004966.db2.gz KUHKMZOQUZRDNR-GOSISDBHSA-N 1 3 286.463 3.951 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)[NH2+][C@H]2CCC[C@@H](N)C2)cc1 ZINC000574290124 335007718 /nfs/dbraw/zinc/00/77/18/335007718.db2.gz HJQPJJBDGGTVHQ-OLMNPRSZSA-N 1 3 274.452 3.601 20 0 CHADHO C[NH+](C)Cc1ccc(CN[C@H](c2ccccc2)C2CC2)cc1 ZINC000171128103 335056293 /nfs/dbraw/zinc/05/62/93/335056293.db2.gz CYVINEUZOVKOKE-HXUWFJFHSA-N 1 3 294.442 3.989 20 0 CHADHO CN(C)Cc1ccc(C[NH2+][C@H](c2ccccc2)C2CC2)cc1 ZINC000171128103 335056295 /nfs/dbraw/zinc/05/62/95/335056295.db2.gz CYVINEUZOVKOKE-HXUWFJFHSA-N 1 3 294.442 3.989 20 0 CHADHO C[C@@H](CC[NH2+]Cc1cccc2cc[nH]c21)N1CCCCC1 ZINC000344371142 533609210 /nfs/dbraw/zinc/60/92/10/533609210.db2.gz DOLKYVBFBDQTPL-HNNXBMFYSA-N 1 3 285.435 3.522 20 0 CHADHO C[C@@H](C[NH2+][C@@H]1CCCc2cc(F)ccc21)CN1CCCC1 ZINC000341762981 130027895 /nfs/dbraw/zinc/02/78/95/130027895.db2.gz WWFJIMMHXJTKKP-KBXCAEBGSA-N 1 3 290.426 3.525 20 0 CHADHO CC1=C[C@@H](C)C[C@@H](C[NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000575097991 335064842 /nfs/dbraw/zinc/06/48/42/335064842.db2.gz XKQZKZHWWZDCCM-NVXWUHKLSA-N 1 3 290.495 3.975 20 0 CHADHO Cc1ccc(C)c([C@H](C)NC2CC[NH+](C(C)C)CC2)c1 ZINC000020189242 171054234 /nfs/dbraw/zinc/05/42/34/171054234.db2.gz IIWXIWHQEWVPOU-INIZCTEOSA-N 1 3 274.452 3.827 20 0 CHADHO CC(C)[NH+]1CCC(N[C@@H]2CCCc3ccccc32)CC1 ZINC000020189387 171055997 /nfs/dbraw/zinc/05/59/97/171055997.db2.gz MPXIQHDPSDOTFR-GOSISDBHSA-N 1 3 272.436 3.526 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)c1ccc(F)cc1)CN1CCCCC1 ZINC000038041766 174042901 /nfs/dbraw/zinc/04/29/01/174042901.db2.gz KFXAHBKCQMMYIG-GJZGRUSLSA-N 1 3 278.415 3.598 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)c1cccs1)CN1CCCCC1 ZINC000038041732 174043328 /nfs/dbraw/zinc/04/33/28/174043328.db2.gz FCYDXHWALHDBEZ-KBPBESRZSA-N 1 3 266.454 3.521 20 0 CHADHO CCCC[NH+]1CCC(N[C@H]2CCCc3ccccc32)CC1 ZINC000037150224 260071176 /nfs/dbraw/zinc/07/11/76/260071176.db2.gz PEYHSEVWXNBSOR-IBGZPJMESA-N 1 3 286.463 3.918 20 0 CHADHO Cc1cccc(CNC[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000192926001 227386324 /nfs/dbraw/zinc/38/63/24/227386324.db2.gz CKQLKOFXAZLCAE-HXUWFJFHSA-N 1 3 294.442 3.607 20 0 CHADHO Cc1cccc(CNC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000192926001 227386329 /nfs/dbraw/zinc/38/63/29/227386329.db2.gz CKQLKOFXAZLCAE-HXUWFJFHSA-N 1 3 294.442 3.607 20 0 CHADHO CC(C)C[C@@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccccc1 ZINC000037649389 260115206 /nfs/dbraw/zinc/11/52/06/260115206.db2.gz DBPKWUUGGDONMT-QFBILLFUSA-N 1 3 286.463 3.848 20 0 CHADHO CC(C)C[C@@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccccc1 ZINC000037649389 260115207 /nfs/dbraw/zinc/11/52/07/260115207.db2.gz DBPKWUUGGDONMT-QFBILLFUSA-N 1 3 286.463 3.848 20 0 CHADHO CC(C)C[C@@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccccc1 ZINC000037649391 260115452 /nfs/dbraw/zinc/11/54/52/260115452.db2.gz DBPKWUUGGDONMT-VQIMIIECSA-N 1 3 286.463 3.848 20 0 CHADHO CC(C)C[C@@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1ccccc1 ZINC000037649391 260115454 /nfs/dbraw/zinc/11/54/54/260115454.db2.gz DBPKWUUGGDONMT-VQIMIIECSA-N 1 3 286.463 3.848 20 0 CHADHO N[C@@H]1CCC[C@@H]([NH2+]C2CCC(c3ccccc3)CC2)C1 ZINC000093211224 260273139 /nfs/dbraw/zinc/27/31/39/260273139.db2.gz LENXAQPDWIYRHD-GPQLOAJWSA-N 1 3 272.436 3.572 20 0 CHADHO C[C@H]([NH3+])c1ccc(CNCc2ccc(C(F)F)cc2)cc1 ZINC000517891652 260315059 /nfs/dbraw/zinc/31/50/59/260315059.db2.gz BFBAVVKRJCGKJQ-LBPRGKRZSA-N 1 3 290.357 3.934 20 0 CHADHO CC(C)c1ccc([C@@H](C)N[C@H]2CCC[NH2+]CC2)cc1 ZINC000129024337 260380970 /nfs/dbraw/zinc/38/09/70/260380970.db2.gz WOKIJJNWYVJXJN-PBHICJAKSA-N 1 3 260.425 3.603 20 0 CHADHO Cc1cccc(CC[C@H](C)N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000130188111 260394892 /nfs/dbraw/zinc/39/48/92/260394892.db2.gz WGPFRQYEUVPRHV-YTQUADARSA-N 1 3 286.463 3.533 20 0 CHADHO Cc1cccc(CC[C@H](C)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000130188111 260394894 /nfs/dbraw/zinc/39/48/94/260394894.db2.gz WGPFRQYEUVPRHV-YTQUADARSA-N 1 3 286.463 3.533 20 0 CHADHO Cc1cccc(CC[C@H](C)[NH2+][C@H]2CCN3CCC[C@@H]3C2)c1 ZINC000130188111 260394895 /nfs/dbraw/zinc/39/48/95/260394895.db2.gz WGPFRQYEUVPRHV-YTQUADARSA-N 1 3 286.463 3.533 20 0 CHADHO CC[C@H](c1ccc(F)cc1)N(C)C[C@@H]1CCC[N@H+](C)C1 ZINC000152467728 261064325 /nfs/dbraw/zinc/06/43/25/261064325.db2.gz RBDBHVOXEIJBHP-RHSMWYFYSA-N 1 3 278.415 3.550 20 0 CHADHO CC[C@H](c1ccc(F)cc1)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000152467728 261064326 /nfs/dbraw/zinc/06/43/26/261064326.db2.gz RBDBHVOXEIJBHP-RHSMWYFYSA-N 1 3 278.415 3.550 20 0 CHADHO C[C@H](NCCC[N@H+](C)Cc1ccccc1)c1ccccc1 ZINC000019913240 262205804 /nfs/dbraw/zinc/20/58/04/262205804.db2.gz ZOTQZBRAMBYFHA-KRWDZBQOSA-N 1 3 282.431 3.859 20 0 CHADHO C[C@H](NCCC[N@@H+](C)Cc1ccccc1)c1ccccc1 ZINC000019913240 262205805 /nfs/dbraw/zinc/20/58/05/262205805.db2.gz ZOTQZBRAMBYFHA-KRWDZBQOSA-N 1 3 282.431 3.859 20 0 CHADHO CSc1ccc([C@@H](C)[NH2+]CCCN2CCCC2)cc1 ZINC000020129159 262230138 /nfs/dbraw/zinc/23/01/38/262230138.db2.gz LSTXCKOVTCAHHQ-CQSZACIVSA-N 1 3 278.465 3.545 20 0 CHADHO CC(C)N(C)CCC[NH2+]Cc1cccc2ccccc21 ZINC000221783196 262296267 /nfs/dbraw/zinc/29/62/67/262296267.db2.gz XUERLTGNNSPCLX-UHFFFAOYSA-N 1 3 270.420 3.660 20 0 CHADHO CC(C)=CCN[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000188443786 262296713 /nfs/dbraw/zinc/29/67/13/262296713.db2.gz FAPVVGIBZKFGJF-SJLPKXTDSA-N 1 3 272.436 3.595 20 0 CHADHO CC(C)=CCN[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000188443786 262296714 /nfs/dbraw/zinc/29/67/14/262296714.db2.gz FAPVVGIBZKFGJF-SJLPKXTDSA-N 1 3 272.436 3.595 20 0 CHADHO CC(C)[C@@H]1C[C@H](NCCC[NH+](C(C)C)C(C)C)CS1 ZINC000488454832 262325329 /nfs/dbraw/zinc/32/53/29/262325329.db2.gz ZTEYUEMCTFVBIM-HOTGVXAUSA-N 1 3 286.529 3.615 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@H]1C[C@@H](C)c2ccccc21 ZINC000311720987 262339785 /nfs/dbraw/zinc/33/97/85/262339785.db2.gz PCTVMWVKJLIYJS-PBHICJAKSA-N 1 3 260.425 3.555 20 0 CHADHO CCCC[C@H]([NH2+]C[C@@H](C)CN(C)C)c1ccccc1 ZINC000311854320 262342608 /nfs/dbraw/zinc/34/26/08/262342608.db2.gz TUSBPGRUHSMJMU-WBVHZDCISA-N 1 3 262.441 3.705 20 0 CHADHO CCCC[C@H](NC[C@@H](C)C[NH+](C)C)c1ccccc1 ZINC000311854320 262342609 /nfs/dbraw/zinc/34/26/09/262342609.db2.gz TUSBPGRUHSMJMU-WBVHZDCISA-N 1 3 262.441 3.705 20 0 CHADHO CCN(CC)CCC[NH2+][C@H]1C[C@@H](C)c2ccccc21 ZINC000311903386 262343991 /nfs/dbraw/zinc/34/39/91/262343991.db2.gz QVHKQONYPQSKRE-PBHICJAKSA-N 1 3 260.425 3.556 20 0 CHADHO C[C@H]([NH2+]CCCN1CCCC1)c1cccc2ccccc21 ZINC000021013047 262373626 /nfs/dbraw/zinc/37/36/26/262373626.db2.gz JOSIYBNCBJUMTC-INIZCTEOSA-N 1 3 282.431 3.976 20 0 CHADHO C[C@H](NCCC[NH+]1CCCC1)c1cccc2ccccc21 ZINC000021013047 262373627 /nfs/dbraw/zinc/37/36/27/262373627.db2.gz JOSIYBNCBJUMTC-INIZCTEOSA-N 1 3 282.431 3.976 20 0 CHADHO CCN(Cc1ccccc1Cl)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000414668663 263026316 /nfs/dbraw/zinc/02/63/16/263026316.db2.gz AMMVPPIAIXSFRL-UONOGXRCSA-N 1 3 280.843 3.550 20 0 CHADHO C[NH2+]C1CCN(CC2CCC(c3ccccc3)CC2)CC1 ZINC000414680130 263031627 /nfs/dbraw/zinc/03/16/27/263031627.db2.gz YCOGBRIHAAKVPW-UHFFFAOYSA-N 1 3 286.463 3.644 20 0 CHADHO CNC1CC[NH+](CC2CCC(c3ccccc3)CC2)CC1 ZINC000414680130 263031628 /nfs/dbraw/zinc/03/16/28/263031628.db2.gz YCOGBRIHAAKVPW-UHFFFAOYSA-N 1 3 286.463 3.644 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)N(CCC[NH3+])C1CC1 ZINC000414748973 263038008 /nfs/dbraw/zinc/03/80/08/263038008.db2.gz OYVBKEXDYOJOHU-CQSZACIVSA-N 1 3 268.404 3.714 20 0 CHADHO Cc1ccc(-c2ccc(C[NH2+]C3CCNCC3)s2)cc1 ZINC000414782486 263045991 /nfs/dbraw/zinc/04/59/91/263045991.db2.gz DUTGKLOMHOBUKB-UHFFFAOYSA-N 1 3 286.444 3.565 20 0 CHADHO CC(C)[C@H]([NH3+])CN[C@H]1CCC[C@@H]1c1ccccc1Cl ZINC000414789134 263048338 /nfs/dbraw/zinc/04/83/38/263048338.db2.gz FBKWTFCMBGRBPM-BMFZPTHFSA-N 1 3 280.843 3.549 20 0 CHADHO [NH3+]C[C@@H]1CCCC[C@@H]1NCc1cc2ccccc2s1 ZINC000414795724 263050270 /nfs/dbraw/zinc/05/02/70/263050270.db2.gz HACJDQFFWKPUSF-ZFWWWQNUSA-N 1 3 274.433 3.508 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+]Cc1cc2ccccc2s1 ZINC000414795724 263050271 /nfs/dbraw/zinc/05/02/71/263050271.db2.gz HACJDQFFWKPUSF-ZFWWWQNUSA-N 1 3 274.433 3.508 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CNCc2ccc(F)c(Cl)c2)cc1 ZINC000414812312 263053395 /nfs/dbraw/zinc/05/33/95/263053395.db2.gz RBAHNHHHGVGJPW-LLVKDONJSA-N 1 3 292.785 3.789 20 0 CHADHO Cc1cc(C)c(CNCc2ccc([C@H](C)[NH3+])cc2)c(C)c1 ZINC000414812370 263053482 /nfs/dbraw/zinc/05/34/82/263053482.db2.gz RCIQRFRIZHAAKZ-INIZCTEOSA-N 1 3 282.431 3.921 20 0 CHADHO CC(C)Oc1ccc(CNCc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000414816219 263054062 /nfs/dbraw/zinc/05/40/62/263054062.db2.gz ZNYBJZWOLITPQE-HNNXBMFYSA-N 1 3 298.430 3.783 20 0 CHADHO CC[C@@H](Cc1ccc(Cl)cc1Cl)NCC[C@H](C)[NH3+] ZINC000414823054 263055475 /nfs/dbraw/zinc/05/54/75/263055475.db2.gz ODAMGUWEEHEYDC-GWCFXTLKSA-N 1 3 289.250 3.641 20 0 CHADHO CC[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+]CC[C@H](C)N ZINC000414823054 263055476 /nfs/dbraw/zinc/05/54/76/263055476.db2.gz ODAMGUWEEHEYDC-GWCFXTLKSA-N 1 3 289.250 3.641 20 0 CHADHO Clc1ccccc1[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCCNC1 ZINC000414829319 263056201 /nfs/dbraw/zinc/05/62/01/263056201.db2.gz NRBWMFXQTIEMDM-QRTARXTBSA-N 1 3 292.854 3.565 20 0 CHADHO [NH3+]C1(CN[C@@H]2CCC[C@@H]2c2ccccc2)CCCCC1 ZINC000414848031 263064332 /nfs/dbraw/zinc/06/43/32/263064332.db2.gz VPQQTJFCWLWHAO-IAGOWNOFSA-N 1 3 272.436 3.574 20 0 CHADHO Cc1cc(C[NH2+]CC2(N)CCCCCC2)cc2cccnc12 ZINC000414862538 263075759 /nfs/dbraw/zinc/07/57/59/263075759.db2.gz VIQSLXRSUGEENZ-UHFFFAOYSA-N 1 3 297.446 3.685 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+][C@H]1CCCNCC1 ZINC000414906321 263113170 /nfs/dbraw/zinc/11/31/70/263113170.db2.gz ARKUPRXUPKNDHZ-MSOLQXFVSA-N 1 3 274.452 3.520 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCN[C@@H](C)C2)C[C@@H](c2ccccc2)C1 ZINC000414927867 263133343 /nfs/dbraw/zinc/13/33/43/263133343.db2.gz AGZBNKSNSDKNFP-JAQSECSASA-N 1 3 286.463 3.689 20 0 CHADHO CC1(c2ccccc2)CCC([NH2+][C@@H]2CCC[C@@H](N)C2)CC1 ZINC000414928992 263135222 /nfs/dbraw/zinc/13/52/22/263135222.db2.gz QXBDKGSACGNRQD-TXQGORRRSA-N 1 3 286.463 3.746 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H]1CCCC[C@H](c2ccccc2)C1 ZINC000414943705 263153012 /nfs/dbraw/zinc/15/30/12/263153012.db2.gz OIFSPUNKPCEEIC-LULLPPNCSA-N 1 3 286.463 3.691 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H]1CCCC[C@H](c2ccccc2)C1 ZINC000414943703 263153043 /nfs/dbraw/zinc/15/30/43/263153043.db2.gz OIFSPUNKPCEEIC-BVBHFADKSA-N 1 3 286.463 3.691 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCNC[C@@H]2C)C[C@@H](c2ccccc2)C1 ZINC000414944944 263154272 /nfs/dbraw/zinc/15/42/72/263154272.db2.gz QSUIPHKOPPICPC-PLOWYNNNSA-N 1 3 286.463 3.546 20 0 CHADHO C[C@@H](CC1CC1)N[C@@H](C[NH3+])c1ccc2ccccc2c1 ZINC000414946356 263155246 /nfs/dbraw/zinc/15/52/46/263155246.db2.gz TVKXEBSMYAENOF-UGSOOPFHSA-N 1 3 268.404 3.618 20 0 CHADHO C[C@H]1C[C@H]([NH2+]CC2CCC(c3ccccc3)CC2)CCN1 ZINC000414947897 263155956 /nfs/dbraw/zinc/15/59/56/263155956.db2.gz LKBRHIMYGVBTMV-NHFHULPWSA-N 1 3 286.463 3.691 20 0 CHADHO CC(C)C[C@H](C[NH2+]C1(C)CCNCC1)c1ccccc1 ZINC000414948738 263157593 /nfs/dbraw/zinc/15/75/93/263157593.db2.gz YXSZSDXSXRVASN-QGZVFWFLSA-N 1 3 274.452 3.548 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2c2ccc(Cl)cc2)CCN1 ZINC000414953859 263159423 /nfs/dbraw/zinc/15/94/23/263159423.db2.gz RZVZEXFXHYFZNJ-VDNDLQMASA-N 1 3 292.854 3.706 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2CCc2ccccc2)CCN1 ZINC000414960694 263165997 /nfs/dbraw/zinc/16/59/97/263165997.db2.gz YHVXFMAVXMLDIP-OWYHZJEWSA-N 1 3 286.463 3.518 20 0 CHADHO Cc1ccccc1-c1cccc(C[NH2+][C@H]2CCNC[C@H]2C)c1 ZINC000414966368 263169348 /nfs/dbraw/zinc/16/93/48/263169348.db2.gz WNYNWNJSMFKRQN-UZLBHIALSA-N 1 3 294.442 3.750 20 0 CHADHO C[C@H]1CNCC[C@@H]1[NH2+]Cc1cc(-c2ccccc2)cs1 ZINC000414966348 263169379 /nfs/dbraw/zinc/16/93/79/263169379.db2.gz WLUCLMUIEYHYKI-GUYCJALGSA-N 1 3 286.444 3.503 20 0 CHADHO Clc1cccc(Cl)c1CNCCC[C@H]1CCC[NH2+]1 ZINC000414979069 263179382 /nfs/dbraw/zinc/17/93/82/263179382.db2.gz UOCDSFLQJMDQHN-NSHDSACASA-N 1 3 287.234 3.615 20 0 CHADHO CC[C@H](Cc1ccc(Cl)cc1Cl)NC[C@@H]([NH3+])CC ZINC000414981039 263180189 /nfs/dbraw/zinc/18/01/89/263180189.db2.gz BGFCLMKETYKBKC-QWHCGFSZSA-N 1 3 289.250 3.641 20 0 CHADHO [NH3+][C@H]1CCC[C@@H](CNCc2c(Cl)cccc2Cl)C1 ZINC000414989119 263185842 /nfs/dbraw/zinc/18/58/42/263185842.db2.gz GSINYJNGBRWADR-MNOVXSKESA-N 1 3 287.234 3.601 20 0 CHADHO [NH3+][C@H]1CCC[C@H](CNCc2c(Cl)cccc2Cl)C1 ZINC000414989120 263186204 /nfs/dbraw/zinc/18/62/04/263186204.db2.gz GSINYJNGBRWADR-QWRGUYRKSA-N 1 3 287.234 3.601 20 0 CHADHO C[C@H](CCCC[NH3+])NCc1cc(Cl)ccc1Cl ZINC000415017488 263255672 /nfs/dbraw/zinc/25/56/72/263255672.db2.gz RZHDPBHVRSDPJM-SNVBAGLBSA-N 1 3 275.223 3.601 20 0 CHADHO [NH3+]CCC[C@H](NCc1ccc(Cl)cc1)c1ccccc1 ZINC000415061946 263258596 /nfs/dbraw/zinc/25/85/96/263258596.db2.gz ZHDPIHPXSTYYKV-KRWDZBQOSA-N 1 3 288.822 3.910 20 0 CHADHO Cc1ccc(CN[C@H](CCC[NH3+])c2ccccc2)cc1C ZINC000415062494 263258864 /nfs/dbraw/zinc/25/88/64/263258864.db2.gz FKGPZOLBYQXZGP-LJQANCHMSA-N 1 3 282.431 3.873 20 0 CHADHO Cc1ccc(CN[C@@H](CCC[NH3+])c2ccccc2)c(C)c1 ZINC000415069622 263259464 /nfs/dbraw/zinc/25/94/64/263259464.db2.gz SQWFEKDYAOBAIO-IBGZPJMESA-N 1 3 282.431 3.873 20 0 CHADHO Cc1cccc(CN[C@@H](CCC[NH3+])c2ccccc2)c1C ZINC000415068878 263259778 /nfs/dbraw/zinc/25/97/78/263259778.db2.gz RPRXCJGDXCOXBR-IBGZPJMESA-N 1 3 282.431 3.873 20 0 CHADHO CC(C)c1ccc([C@@H](NC2CC[NH2+]CC2)C(C)C)cc1 ZINC000415074268 263264990 /nfs/dbraw/zinc/26/49/90/263264990.db2.gz CEMNCBLZLXTMRM-SFHVURJKSA-N 1 3 274.452 3.849 20 0 CHADHO CC(C)c1ccc([C@@H]([NH2+]C2CCNCC2)C(C)C)cc1 ZINC000415074268 263264992 /nfs/dbraw/zinc/26/49/92/263264992.db2.gz CEMNCBLZLXTMRM-SFHVURJKSA-N 1 3 274.452 3.849 20 0 CHADHO CC[C@@H](N[C@@H]1CCC[NH2+]CC1)c1ccc(Cl)cc1 ZINC000129000827 264313109 /nfs/dbraw/zinc/31/31/09/264313109.db2.gz UCXQZXFJWXRXSA-HUUCEWRRSA-N 1 3 266.816 3.523 20 0 CHADHO C[C@@H](C[NH2+]CCCN1CCC(C)CC1)c1ccc(F)cc1 ZINC000525875219 264869670 /nfs/dbraw/zinc/86/96/70/264869670.db2.gz OFNCBEPWQOMUEX-INIZCTEOSA-N 1 3 292.442 3.641 20 0 CHADHO C[C@@H](CNCCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000525875219 264869672 /nfs/dbraw/zinc/86/96/72/264869672.db2.gz OFNCBEPWQOMUEX-INIZCTEOSA-N 1 3 292.442 3.641 20 0 CHADHO CC[C@H](NCC1(C)CC[NH+](C)CC1)c1ccc(F)cc1F ZINC000356832664 266183473 /nfs/dbraw/zinc/18/34/73/266183473.db2.gz FELLOAGMGHEHEH-INIZCTEOSA-N 1 3 296.405 3.737 20 0 CHADHO CC[N@H+](CC[C@H]1CCCCN1C)Cc1cccc(F)c1 ZINC000356853186 266190947 /nfs/dbraw/zinc/19/09/47/266190947.db2.gz OAIGCTCLAIPZOI-QGZVFWFLSA-N 1 3 278.415 3.522 20 0 CHADHO CC[N@@H+](CC[C@H]1CCCCN1C)Cc1cccc(F)c1 ZINC000356853186 266190950 /nfs/dbraw/zinc/19/09/50/266190950.db2.gz OAIGCTCLAIPZOI-QGZVFWFLSA-N 1 3 278.415 3.522 20 0 CHADHO C[C@H](CC[NH2+]C1CCC2(CC2)CC1)N1CCCCC1 ZINC000362914425 267060452 /nfs/dbraw/zinc/06/04/52/267060452.db2.gz UAGHBLNIOITQQW-OAHLLOKOSA-N 1 3 264.457 3.563 20 0 CHADHO CC[C@@H](c1ccccc1)[NH+]1CCC2(CCCN2C)CC1 ZINC000369384820 267239416 /nfs/dbraw/zinc/23/94/16/267239416.db2.gz UPIMNAXHJMULEK-KRWDZBQOSA-N 1 3 272.436 3.698 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H]([NH2+][C@H]2CCN3CCC[C@@H]3C2)C1 ZINC000370477717 267320925 /nfs/dbraw/zinc/32/09/25/267320925.db2.gz QAULIHDZGHNSEV-HAGHYFMRSA-N 1 3 298.474 3.713 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H](N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)C1 ZINC000370477717 267320926 /nfs/dbraw/zinc/32/09/26/267320926.db2.gz QAULIHDZGHNSEV-HAGHYFMRSA-N 1 3 298.474 3.713 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H](N[C@H]2CC[N@H+]3CCC[C@@H]3C2)C1 ZINC000370477717 267320928 /nfs/dbraw/zinc/32/09/28/267320928.db2.gz QAULIHDZGHNSEV-HAGHYFMRSA-N 1 3 298.474 3.713 20 0 CHADHO CC(C)[C@H]([NH2+]CCCN(C)C1CCCCC1)C1CC1 ZINC000531687992 328021430 /nfs/dbraw/zinc/02/14/30/328021430.db2.gz ZWZIVZUWWDJGSK-KRWDZBQOSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)[C@@H]([NH2+]CCCN(C)C1CCCCC1)C1CC1 ZINC000531687993 328021460 /nfs/dbraw/zinc/02/14/60/328021460.db2.gz ZWZIVZUWWDJGSK-QGZVFWFLSA-N 1 3 266.473 3.665 20 0 CHADHO c1ccc([C@@H](CC2CC2)NCCC[NH+]2CCCCC2)cc1 ZINC000531689283 328024280 /nfs/dbraw/zinc/02/42/80/328024280.db2.gz CQLXCPDYRMIECV-LJQANCHMSA-N 1 3 286.463 3.993 20 0 CHADHO CC1=C[C@H](C)C[C@H](C[NH2+]C2CCN(CC(C)C)CC2)C1 ZINC000575030807 328230141 /nfs/dbraw/zinc/23/01/41/328230141.db2.gz XSSKJFLNXIOILY-RDJZCZTQSA-N 1 3 278.484 3.689 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CNCc2ccc(Cl)c(F)c2)cc1 ZINC000414802528 328231251 /nfs/dbraw/zinc/23/12/51/328231251.db2.gz BVTJKXQNTCGLEY-LLVKDONJSA-N 1 3 292.785 3.789 20 0 CHADHO C[C@@H](N[C@@H](C)CC[NH+](C)C)c1cccc(C2CC2)c1 ZINC000340208692 328247796 /nfs/dbraw/zinc/24/77/96/328247796.db2.gz FYQHBKVCUNDEMK-UONOGXRCSA-N 1 3 260.425 3.555 20 0 CHADHO C[C@H](CCC1CCCCC1)[NH2+][C@H]1CCC[C@H](N)C1 ZINC000414928609 328273346 /nfs/dbraw/zinc/27/33/46/328273346.db2.gz QIWYHDBFDFQNFP-KBMXLJTQSA-N 1 3 252.446 3.595 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+]C2CCC(C)(c3ccccc3)CC2)CCN1 ZINC000414955844 328280012 /nfs/dbraw/zinc/28/00/12/328280012.db2.gz UTQTVNYBQYEESI-IZIZEDOESA-N 1 3 286.463 3.617 20 0 CHADHO Cc1ccsc1CN[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415084336 328302790 /nfs/dbraw/zinc/30/27/90/328302790.db2.gz OTUSGAHRCXOPPJ-JKSUJKDBSA-N 1 3 286.444 3.639 20 0 CHADHO CCSc1ccc([C@H](C)NC[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000534496747 328304710 /nfs/dbraw/zinc/30/47/10/328304710.db2.gz VAICCWUGKMOYHX-GJZGRUSLSA-N 1 3 292.492 3.791 20 0 CHADHO CCSc1ccc([C@H](C)NC[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000534496747 328304711 /nfs/dbraw/zinc/30/47/11/328304711.db2.gz VAICCWUGKMOYHX-GJZGRUSLSA-N 1 3 292.492 3.791 20 0 CHADHO Cc1cc(C)c([C@@H](C)N[C@H](C)CC[NH+](C)C)cc1C ZINC000049553641 328371703 /nfs/dbraw/zinc/37/17/03/328371703.db2.gz LBHAEQABRORASY-HZPDHXFCSA-N 1 3 262.441 3.603 20 0 CHADHO Cc1cc(C)c([C@H](C)N[C@H](C)CC[NH+](C)C)cc1C ZINC000049553642 328371866 /nfs/dbraw/zinc/37/18/66/328371866.db2.gz LBHAEQABRORASY-CVEARBPZSA-N 1 3 262.441 3.603 20 0 CHADHO C/C(=C/c1ccccc1)C[NH2+]C1CCN(CC2CC2)CC1 ZINC000255663267 327002955 /nfs/dbraw/zinc/00/29/55/327002955.db2.gz NZKOBZBUKVSYHL-SSZFMOIBSA-N 1 3 284.447 3.554 20 0 CHADHO Cc1cc(N2C[C@@H]([NH+]3CCCC3)C[C@@H]2C)c2ccccc2n1 ZINC000557735455 327023545 /nfs/dbraw/zinc/02/35/45/327023545.db2.gz YTMACBCRUUNDQQ-HOTGVXAUSA-N 1 3 295.430 3.606 20 0 CHADHO CCCN1CCC([NH2+]Cc2ccc(C(F)F)cc2)CC1 ZINC000131310346 327161340 /nfs/dbraw/zinc/16/13/40/327161340.db2.gz KMNPXYDOIFJTMY-UHFFFAOYSA-N 1 3 282.378 3.588 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@H]2CCCC[C@H]2Cc2ccccc2)C1 ZINC000564470822 327197013 /nfs/dbraw/zinc/19/70/13/327197013.db2.gz PWDGWJCFCVVAQU-RDGPPVDQSA-N 1 3 286.463 3.647 20 0 CHADHO CC(C)C[C@H](C)C[NH2+]C[C@@H]1CCCN(CC(C)C)C1 ZINC000584258736 327202769 /nfs/dbraw/zinc/20/27/69/327202769.db2.gz FUMCIRSWFPGIAX-IRXDYDNUSA-N 1 3 268.489 3.626 20 0 CHADHO C[C@@H](c1ccc2ccccc2c1)N1CC[C@@]2(CC[NH2+]C2)C1 ZINC000261807949 327353113 /nfs/dbraw/zinc/35/31/13/327353113.db2.gz ZKODUUBDZUYHMX-HNAYVOBHSA-N 1 3 280.415 3.586 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](N[C@@H](c2ccc(F)cc2)C2CCC2)C1 ZINC000565226646 327527911 /nfs/dbraw/zinc/52/79/11/327527911.db2.gz MFADSHRWHGEOJT-BRWVUGGUSA-N 1 3 276.399 3.526 20 0 CHADHO CC[NH+](CC)C[C@H](C)Nc1cc(C)nc2ccccc21 ZINC000041677279 328714880 /nfs/dbraw/zinc/71/48/80/328714880.db2.gz XRWWLMSJNJQAMU-AWEZNQCLSA-N 1 3 271.408 3.685 20 0 CHADHO CCCN1CCC([N@H+](C)Cc2ccc(SC)cc2)CC1 ZINC000171930887 329082228 /nfs/dbraw/zinc/08/22/28/329082228.db2.gz RBZUUEWWBQYCTJ-UHFFFAOYSA-N 1 3 292.492 3.715 20 0 CHADHO CCCN1CCC([N@@H+](C)Cc2ccc(SC)cc2)CC1 ZINC000171930887 329082229 /nfs/dbraw/zinc/08/22/29/329082229.db2.gz RBZUUEWWBQYCTJ-UHFFFAOYSA-N 1 3 292.492 3.715 20 0 CHADHO Cc1c2ccccc2oc1C[NH2+][C@@H]1CCN(C)[C@H]2CCC[C@H]21 ZINC000583709256 329093369 /nfs/dbraw/zinc/09/33/69/329093369.db2.gz SNPMIYVZCOHQNF-BBWFWOEESA-N 1 3 298.430 3.704 20 0 CHADHO CC1=C[C@H](C)C[C@@H](C[N@@H+]2CC[C@@H](CN(C)CC3CC3)C2)C1 ZINC000582479474 329095250 /nfs/dbraw/zinc/09/52/50/329095250.db2.gz YNXGVPZIWSMLKQ-ZYSHUDEJSA-N 1 3 290.495 3.643 20 0 CHADHO CC1=C[C@H](C)C[C@@H](C[N@H+]2CC[C@@H](CN(C)CC3CC3)C2)C1 ZINC000582479474 329095251 /nfs/dbraw/zinc/09/52/51/329095251.db2.gz YNXGVPZIWSMLKQ-ZYSHUDEJSA-N 1 3 290.495 3.643 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]CCC2CCCCCC2)C1 ZINC000394621107 329126035 /nfs/dbraw/zinc/12/60/35/329126035.db2.gz LNNLSBNGBAZEHZ-QGZVFWFLSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@H](NCCCC[NH+]1CCC(C)CC1)c1ccsc1 ZINC000178106341 329196065 /nfs/dbraw/zinc/19/60/65/329196065.db2.gz GQVJETWIODXVPR-HNNXBMFYSA-N 1 3 280.481 3.911 20 0 CHADHO Cc1nc(C)c([C@@H](C)[NH2+]C[C@H]2CCCN(C(C)C)C2)s1 ZINC000178750430 329200271 /nfs/dbraw/zinc/20/02/71/329200271.db2.gz ANDOYULKJARJPH-IUODEOHRSA-N 1 3 295.496 3.531 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H]1CCCC[C@@H]1C(C)C ZINC000422708670 330151342 /nfs/dbraw/zinc/15/13/42/330151342.db2.gz CEWSQDCMCVLUIG-YXJHDRRASA-N 1 3 289.467 3.714 20 0 CHADHO NC[C@H]1CCCC[C@H]1[NH2+]CCCCCOC1CCCCC1 ZINC000422710148 330151575 /nfs/dbraw/zinc/15/15/75/330151575.db2.gz LAICYMDDYLZTPN-SJLPKXTDSA-N 1 3 296.499 3.613 20 0 CHADHO C[C@H](N[C@H](c1ccc(Cl)cc1)C1CCCC1)C1C[NH2+]C1 ZINC000422746911 330152984 /nfs/dbraw/zinc/15/29/84/330152984.db2.gz XNBPABYFHONOKZ-SJCJKPOMSA-N 1 3 292.854 3.769 20 0 CHADHO C[C@H]([NH2+][C@H](CC1CCCCC1)C(C)(C)C)C1CNC1 ZINC000422748448 330153120 /nfs/dbraw/zinc/15/31/20/330153120.db2.gz UQQBFADPKWSVBZ-XJKSGUPXSA-N 1 3 266.473 3.569 20 0 CHADHO C[C@@H](N[C@@H](C)CCCC[NH3+])c1ccc(F)cc1Cl ZINC000422752093 330153301 /nfs/dbraw/zinc/15/33/01/330153301.db2.gz GWCBWUBPQZUVLZ-WDEREUQCSA-N 1 3 272.795 3.647 20 0 CHADHO Cc1ccc([C@H](C)CN[C@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000422756278 330153713 /nfs/dbraw/zinc/15/37/13/330153713.db2.gz GSTPSQQHCKQJCC-ZMYBRWDISA-N 1 3 280.415 3.833 20 0 CHADHO CC(C)(CN[C@@H]1C[C@@H]([NH3+])c2ccccc21)c1cccc(F)c1 ZINC000422762883 330153928 /nfs/dbraw/zinc/15/39/28/330153928.db2.gz OOTURZMRTPIGCN-QZTJIDSGSA-N 1 3 298.405 3.838 20 0 CHADHO Cc1ccc(CN[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC000422763958 330154027 /nfs/dbraw/zinc/15/40/27/330154027.db2.gz PDDBSMNDUCUHGR-RTBURBONSA-N 1 3 280.415 3.578 20 0 CHADHO CC(C)[C@H](N[C@H](C)C[C@H](C)[NH3+])c1ccc(Cl)cc1 ZINC000422787899 330155173 /nfs/dbraw/zinc/15/51/73/330155173.db2.gz AKEWWBQHOOUQGZ-ZOWXZIJZSA-N 1 3 268.832 3.753 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](c1ccc(F)cc1)C(C)(C)C ZINC000422787283 330155232 /nfs/dbraw/zinc/15/52/32/330155232.db2.gz UMWMPFCXKQQTIJ-ZOWXZIJZSA-N 1 3 266.404 3.628 20 0 CHADHO CC(C)[C@H](N[C@@H](C)C[C@H](C)[NH3+])c1ccc(Cl)cc1 ZINC000422787896 330155299 /nfs/dbraw/zinc/15/52/99/330155299.db2.gz AKEWWBQHOOUQGZ-HUBLWGQQSA-N 1 3 268.832 3.753 20 0 CHADHO C[C@@H]1CCNCC[C@@H]1[NH2+]C1CCC(c2ccccc2)CC1 ZINC000422801254 330155558 /nfs/dbraw/zinc/15/55/58/330155558.db2.gz BOBKAKIKHPNCLC-HJZRJOMTSA-N 1 3 286.463 3.691 20 0 CHADHO CC(C)[C@H](C[NH2+][C@H]1CCCC[C@H]1CN)c1ccccc1 ZINC000422808744 330155861 /nfs/dbraw/zinc/15/58/61/330155861.db2.gz LLKLJEOFLFFMFB-BZSNNMDCSA-N 1 3 274.452 3.533 20 0 CHADHO [NH3+][C@@H]1C[C@H](NCC2(c3ccccc3)CCC2)c2ccccc21 ZINC000422803601 330156000 /nfs/dbraw/zinc/15/60/00/330156000.db2.gz CZHXWVCZLOVPCB-MOPGFXCFSA-N 1 3 292.426 3.843 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2CN[C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000422809877 330156014 /nfs/dbraw/zinc/15/60/14/330156014.db2.gz SOIUKBFDVNMFAB-BTHPGYMESA-N 1 3 298.474 3.617 20 0 CHADHO CC[C@H](N[C@@H](C)[C@H]1CCC[NH2+]C1)c1ccc(Cl)cc1 ZINC000422825557 330156525 /nfs/dbraw/zinc/15/65/25/330156525.db2.gz PZKKKLUQFVNUFP-NOLJZWGESA-N 1 3 280.843 3.769 20 0 CHADHO CC(C)(C[NH2+][C@H]1CCC[C@H]1CN)Cc1cccc(Cl)c1 ZINC000422872563 330158250 /nfs/dbraw/zinc/15/82/50/330158250.db2.gz HOWQBFQYVOKHBA-HOCLYGCPSA-N 1 3 294.870 3.626 20 0 CHADHO Fc1cccc([C@@H](N[C@H]2CCC[NH2+]CC2)C2CCCC2)c1 ZINC000422879352 330158911 /nfs/dbraw/zinc/15/89/11/330158911.db2.gz VETIXEKFLCLOBT-ROUUACIJSA-N 1 3 290.426 3.789 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C ZINC000422927644 330160852 /nfs/dbraw/zinc/16/08/52/330160852.db2.gz ZKRDKFFOYWLDBF-NQMOMTLDSA-N 1 3 280.843 3.753 20 0 CHADHO Cc1cccc(C)c1CCN[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422925217 330160899 /nfs/dbraw/zinc/16/08/99/330160899.db2.gz AQJXEMMSGRONTQ-MOPGFXCFSA-N 1 3 280.415 3.580 20 0 CHADHO CCC(CC)[C@H](N[C@@H](C)C[C@H](C)[NH3+])c1cccs1 ZINC000422944481 330162099 /nfs/dbraw/zinc/16/20/99/330162099.db2.gz ZUGAVZHURLPDOT-HUBLWGQQSA-N 1 3 268.470 3.941 20 0 CHADHO c1ccc(C2CC(N[C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)C2)cc1 ZINC000422968671 330164716 /nfs/dbraw/zinc/16/47/16/330164716.db2.gz RTRBKUSCIKASKP-ZCFHBRKKSA-N 1 3 298.474 3.833 20 0 CHADHO CC(C)[C@@H]1CCc2ccccc2[C@@H]1N[C@@H](C)[C@@H]1CC[NH2+]C1 ZINC000423049263 330167097 /nfs/dbraw/zinc/16/70/97/330167097.db2.gz JSUHHASWYQRQFO-LKCYJCQHSA-N 1 3 286.463 3.534 20 0 CHADHO CC(C)[C@@H]1CCc2ccccc2[C@@H]1N[C@@H](C)[C@H]1CC[NH2+]C1 ZINC000423049264 330167213 /nfs/dbraw/zinc/16/72/13/330167213.db2.gz JSUHHASWYQRQFO-PCODUJHASA-N 1 3 286.463 3.534 20 0 CHADHO CC(C)c1ccc2c(c1)[C@H](N[C@H](C)C[C@H](C)[NH3+])CC2 ZINC000423065861 330168237 /nfs/dbraw/zinc/16/82/37/330168237.db2.gz VJJBNOLNNDIVDF-OGHNNQOOSA-N 1 3 260.425 3.513 20 0 CHADHO Cc1cc(C[NH2+][C@H]2CCC[C@@H]2N)ccc1-c1ccccc1 ZINC000423066774 330168321 /nfs/dbraw/zinc/16/83/21/330168321.db2.gz XVMPBMUZSULZSI-OALUTQOASA-N 1 3 280.415 3.631 20 0 CHADHO C1CC12CCC([NH2+][C@@H]1CCC[C@H]1[C@H]1CCCCN1)CC2 ZINC000423077066 330168428 /nfs/dbraw/zinc/16/84/28/330168428.db2.gz SHAZDHXTVDUMLW-GVDBMIGSSA-N 1 3 276.468 3.610 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]C1CCC2(CCCCC2)CC1 ZINC000423076775 330168631 /nfs/dbraw/zinc/16/86/31/330168631.db2.gz ZSOBFDHLPISNEB-KBPBESRZSA-N 1 3 252.446 3.595 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000423092884 330169371 /nfs/dbraw/zinc/16/93/71/330169371.db2.gz DTQOHWNRDXBDIJ-LAQRGFTBSA-N 1 3 290.426 3.569 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@H]1N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423095426 330169542 /nfs/dbraw/zinc/16/95/42/330169542.db2.gz MBPDTCFRKAJCTQ-MWQQHZPXSA-N 1 3 292.854 3.836 20 0 CHADHO [NH3+][C@H]1CCC[C@H]1N[C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000423100591 330170197 /nfs/dbraw/zinc/17/01/97/330170197.db2.gz MYUBHDWBKQKRKO-LWWSYDQCSA-N 1 3 299.245 3.709 20 0 CHADHO Cc1ccccc1[C@H]1C[C@H](N[C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)C1 ZINC000423111955 330170886 /nfs/dbraw/zinc/17/08/86/330170886.db2.gz WZKCZGDHRMDRJS-FLFBIERCSA-N 1 3 298.474 3.751 20 0 CHADHO Cc1csc(CN[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC000423146387 330172495 /nfs/dbraw/zinc/17/24/95/330172495.db2.gz AMBNJBKTVVJMPK-DOTOQJQBSA-N 1 3 286.444 3.639 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]C[C@H]1CCCC[C@@H]1c1ccccc1 ZINC000423153557 330173087 /nfs/dbraw/zinc/17/30/87/330173087.db2.gz HTGBOIGNPVQZLI-CWLKWCNXSA-N 1 3 274.452 3.676 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]C[C@H]1CCCC[C@H]1c1ccccc1 ZINC000423153559 330173168 /nfs/dbraw/zinc/17/31/68/330173168.db2.gz HTGBOIGNPVQZLI-ONIAQPFYSA-N 1 3 274.452 3.676 20 0 CHADHO [NH3+][C@@H]1C[C@H](NC[C@H]2CCC[C@H]2C2CC2)c2ccccc21 ZINC000423169662 330174192 /nfs/dbraw/zinc/17/41/92/330174192.db2.gz JYTJKUPNPFUKMK-NONVJHHQSA-N 1 3 270.420 3.547 20 0 CHADHO [NH3+]C1(CN[C@H]2CC[C@H](c3ccccc3)C2)CCCCC1 ZINC000423175316 330174720 /nfs/dbraw/zinc/17/47/20/330174720.db2.gz DQNLMUVRCGYNDT-IRXDYDNUSA-N 1 3 272.436 3.574 20 0 CHADHO C[C@H](N[C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1)[C@H]1CC[NH2+]C1 ZINC000423175855 330174804 /nfs/dbraw/zinc/17/48/04/330174804.db2.gz FKVHMTXMFYOIRR-PWXKEOIMSA-N 1 3 292.854 3.564 20 0 CHADHO c1ccc(C[C@H]([NH2+]C2CCNCC2)C2CCCCC2)cc1 ZINC000423183033 330175546 /nfs/dbraw/zinc/17/55/46/330175546.db2.gz KVFTXYDIJITFHJ-IBGZPJMESA-N 1 3 286.463 3.520 20 0 CHADHO C[C@@H](NCCC[NH3+])c1ccc(-c2c(F)cccc2F)cc1 ZINC000423189652 330175697 /nfs/dbraw/zinc/17/56/97/330175697.db2.gz NAAGDPQGUSRZHG-GFCCVEGCSA-N 1 3 290.357 3.631 20 0 CHADHO CC(C)C[C@H](NCCC[NH3+])c1cccc(C(F)(F)F)c1 ZINC000423195544 330176192 /nfs/dbraw/zinc/17/61/92/330176192.db2.gz SWPHNDZIEHZSMX-AWEZNQCLSA-N 1 3 288.357 3.731 20 0 CHADHO CNCCC[NH2+][C@H]1CCC[C@@H](c2cccc(Cl)c2)C1 ZINC000423199166 330176576 /nfs/dbraw/zinc/17/65/76/330176576.db2.gz JJHWMORVIRBPTL-ZBFHGGJFSA-N 1 3 280.843 3.565 20 0 CHADHO C[NH2+]CCCN[C@H]1CCC[C@@H](c2cccc(Cl)c2)C1 ZINC000423199166 330176578 /nfs/dbraw/zinc/17/65/78/330176578.db2.gz JJHWMORVIRBPTL-ZBFHGGJFSA-N 1 3 280.843 3.565 20 0 CHADHO CCC[C@@H](NC[C@@H]1CCC[NH2+]C1)c1ccc(Cl)cc1 ZINC000423209293 330177610 /nfs/dbraw/zinc/17/76/10/330177610.db2.gz IXSBKVUEMJDLNK-CZUORRHYSA-N 1 3 280.843 3.770 20 0 CHADHO C[C@H](NC[C@H]1CCC[NH2+]C1)c1ccc(F)c2ccccc21 ZINC000423216911 330178819 /nfs/dbraw/zinc/17/88/19/330178819.db2.gz SNKUJVOWLBVRNX-KBPBESRZSA-N 1 3 286.394 3.629 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCNC1)c1ccc(F)c2ccccc21 ZINC000423216911 330178821 /nfs/dbraw/zinc/17/88/21/330178821.db2.gz SNKUJVOWLBVRNX-KBPBESRZSA-N 1 3 286.394 3.629 20 0 CHADHO C[C@H](NC[C@@H]1CCC[NH2+]C1)c1ccc(F)c2ccccc21 ZINC000423216913 330178841 /nfs/dbraw/zinc/17/88/41/330178841.db2.gz SNKUJVOWLBVRNX-UONOGXRCSA-N 1 3 286.394 3.629 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCNC1)c1ccc(F)c2ccccc21 ZINC000423216913 330178843 /nfs/dbraw/zinc/17/88/43/330178843.db2.gz SNKUJVOWLBVRNX-UONOGXRCSA-N 1 3 286.394 3.629 20 0 CHADHO CCCc1ccc([C@H](C)N[C@@H](C)[C@H]2CCC[NH2+]C2)cc1 ZINC000423217827 330179020 /nfs/dbraw/zinc/17/90/20/330179020.db2.gz QOLZODTYEFCQNU-MPGHIAIKSA-N 1 3 274.452 3.678 20 0 CHADHO C[C@@H](NCC[C@H](C)[NH3+])c1ccc(-c2cccs2)cc1 ZINC000423224861 330179990 /nfs/dbraw/zinc/17/99/90/330179990.db2.gz CYEBHTGNQJMXRC-QWHCGFSZSA-N 1 3 274.433 3.803 20 0 CHADHO C[C@H]([NH3+])CCN[C@@H](C)c1ccc(-c2ccccc2F)s1 ZINC000423228324 330180277 /nfs/dbraw/zinc/18/02/77/330180277.db2.gz ZDNJUEWINMKCJA-RYUDHWBXSA-N 1 3 292.423 3.942 20 0 CHADHO C[C@H](NCC[C@H]1CC[NH2+]C1)c1cc(Cl)sc1Cl ZINC000423254508 330183254 /nfs/dbraw/zinc/18/32/54/330183254.db2.gz YGWOSMNXERRBQN-DTWKUNHWSA-N 1 3 293.263 3.705 20 0 CHADHO Cc1ccsc1[C@H](C)N[C@H](C[NH3+])C1CCCCC1 ZINC000423259161 330183535 /nfs/dbraw/zinc/18/35/35/330183535.db2.gz DDFYZWHWHORPCK-GXTWGEPZSA-N 1 3 266.454 3.615 20 0 CHADHO CC[C@H](CSc1ccc(Cl)cc1)N[C@@H](C[NH3+])C1CC1 ZINC000423277470 330185092 /nfs/dbraw/zinc/18/50/92/330185092.db2.gz OEMKGPNPPYFETP-HIFRSBDPSA-N 1 3 298.883 3.538 20 0 CHADHO CC(C)[C@H]([NH3+])CN[C@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000423278290 330185461 /nfs/dbraw/zinc/18/54/61/330185461.db2.gz QMWLRWCERZGDBR-CWRNSKLLSA-N 1 3 280.843 3.549 20 0 CHADHO COc1ccccc1-c1ccc([C@@H](C)[NH2+]CC(C)(C)N)cc1 ZINC000423289527 330186386 /nfs/dbraw/zinc/18/63/86/330186386.db2.gz XJPJZJNXUIMQJX-CQSZACIVSA-N 1 3 298.430 3.750 20 0 CHADHO CC(C)C[C@@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccccn1 ZINC000423292014 330187320 /nfs/dbraw/zinc/18/73/20/330187320.db2.gz KYFDNBMGLRPEGK-DNVCBOLYSA-N 1 3 297.446 3.978 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2cccs2)cc1 ZINC000423293198 330187771 /nfs/dbraw/zinc/18/77/71/330187771.db2.gz QGODFZZKUSYPIV-NEPJUHHUSA-N 1 3 260.406 3.619 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc(F)cc2)cc1 ZINC000423294504 330187873 /nfs/dbraw/zinc/18/78/73/330187873.db2.gz UNEGSEVDRXJRTH-OLZOCXBDSA-N 1 3 272.367 3.696 20 0 CHADHO C[C@H](C[NH3+])CN[C@H](C)c1ccc(OCc2ccccc2)cc1 ZINC000423294845 330188105 /nfs/dbraw/zinc/18/81/05/330188105.db2.gz CWOZGIFNVWQENG-HZPDHXFCSA-N 1 3 298.430 3.511 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2CCCc3ccccc32)cc1 ZINC000423294969 330188366 /nfs/dbraw/zinc/18/83/66/330188366.db2.gz VXDSSQFYGOLOOJ-IFXJQAMLSA-N 1 3 280.415 3.874 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2ccccc2)cc1 ZINC000423296802 330188533 /nfs/dbraw/zinc/18/85/33/330188533.db2.gz ZWKIAKZAJXVZFI-KGLIPLIRSA-N 1 3 254.377 3.557 20 0 CHADHO C[C@@H](C[NH3+])CN[C@H](c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000423296956 330188619 /nfs/dbraw/zinc/18/86/19/330188619.db2.gz ICBGMYYTDOLVPJ-XPTSAGLGSA-N 1 3 287.234 3.629 20 0 CHADHO C[C@@H]([NH2+]C[C@@H](N)C1CC1)c1ccc(-c2cccs2)cc1 ZINC000423323180 330190574 /nfs/dbraw/zinc/19/05/74/330190574.db2.gz ONKXWJVQQZDCRY-MLGOLLRUSA-N 1 3 286.444 3.803 20 0 CHADHO C[C@H](NCC1=CC[NH2+]CC1)c1ccc(Cl)cc1Cl ZINC000423333206 330191545 /nfs/dbraw/zinc/19/15/45/330191545.db2.gz DXJRSPIHDQUSPF-JTQLQIEISA-N 1 3 285.218 3.564 20 0 CHADHO C[C@@H]([NH2+]CC1(N)CCC1)c1ccc(-c2cccs2)cc1 ZINC000423343491 330192206 /nfs/dbraw/zinc/19/22/06/330192206.db2.gz ZWAKUWKEWJBBEY-CYBMUJFWSA-N 1 3 286.444 3.947 20 0 CHADHO C[C@@H]1CC[C@@H](NC[C@@]2(C)CCC[NH2+]C2)c2ccccc21 ZINC000423343859 330192426 /nfs/dbraw/zinc/19/24/26/330192426.db2.gz XKMUYXZTDLTMDU-OLMNPRSZSA-N 1 3 272.436 3.604 20 0 CHADHO C[C@@H]1CC[C@@H]([NH2+]C[C@@]2(C)CCCNC2)c2ccccc21 ZINC000423343859 330192427 /nfs/dbraw/zinc/19/24/27/330192427.db2.gz XKMUYXZTDLTMDU-OLMNPRSZSA-N 1 3 272.436 3.604 20 0 CHADHO CC(C)[C@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)CNC3)C1 ZINC000423364496 330194412 /nfs/dbraw/zinc/19/44/12/330194412.db2.gz AULXNIPPYBPDAF-MAUKXSAKSA-N 1 3 272.436 3.594 20 0 CHADHO CC(C)Cc1cccc([C@H](C)[NH2+][C@@H]2CCN[C@H](C)C2)c1 ZINC000423372980 330195328 /nfs/dbraw/zinc/19/53/28/330195328.db2.gz GMUPCYMBSPODKK-RVKKMQEKSA-N 1 3 274.452 3.676 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@H]1CCN[C@@H](C)C1 ZINC000423371392 330195369 /nfs/dbraw/zinc/19/53/69/330195369.db2.gz FLUWRUMQWXQEBX-DEYYWGMASA-N 1 3 297.446 3.584 20 0 CHADHO c1ccc([C@H](NCc2ccc3c(c2)C[NH2+]C3)C2CC2)cc1 ZINC000423398899 330195974 /nfs/dbraw/zinc/19/59/74/330195974.db2.gz UIYXYXLXIYMHDS-IBGZPJMESA-N 1 3 278.399 3.531 20 0 CHADHO C[C@@H]1C[C@@H](N[C@H](CC(C)(C)C)c2ccccc2)CC[NH2+]1 ZINC000423401109 330196036 /nfs/dbraw/zinc/19/60/36/330196036.db2.gz WVSVKVKJBIXZKM-HYVNUMGLSA-N 1 3 274.452 3.894 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@H](CC(C)(C)C)c2ccccc2)CCN1 ZINC000423401109 330196038 /nfs/dbraw/zinc/19/60/38/330196038.db2.gz WVSVKVKJBIXZKM-HYVNUMGLSA-N 1 3 274.452 3.894 20 0 CHADHO CC[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1cccc(C)c1 ZINC000423401144 330196286 /nfs/dbraw/zinc/19/62/86/330196286.db2.gz VUIPWTCQLFQOLI-LJQANCHMSA-N 1 3 280.415 3.839 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)CCN1 ZINC000423401769 330196400 /nfs/dbraw/zinc/19/64/00/330196400.db2.gz XIPOHZGCHYUAKK-JEBQAFNWSA-N 1 3 290.426 3.787 20 0 CHADHO CC(C)Sc1ccc([C@H](C)[NH2+][C@@H]2CCNC[C@H]2C)cc1 ZINC000423405934 330196618 /nfs/dbraw/zinc/19/66/18/330196618.db2.gz UJMACRNPQSLPMS-JKIFEVAISA-N 1 3 292.492 3.836 20 0 CHADHO CC(C)CC[C@H](N[C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccoc1 ZINC000423428979 330198455 /nfs/dbraw/zinc/19/84/55/330198455.db2.gz GZQJATUPGFPZDY-OKZBNKHCSA-N 1 3 290.451 3.735 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1ccc(Cl)cc1 ZINC000423379809 330198974 /nfs/dbraw/zinc/19/89/74/330198974.db2.gz NHRGXNVNWGNZTJ-DFBGVHRSSA-N 1 3 266.816 3.521 20 0 CHADHO C[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1cc2c(s1)CCC2 ZINC000423385021 330199602 /nfs/dbraw/zinc/19/96/02/330199602.db2.gz LGODDTCZWYRAAC-LBPRGKRZSA-N 1 3 298.455 3.691 20 0 CHADHO FC(F)(F)[C@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)CNC3)C1 ZINC000423389104 330200015 /nfs/dbraw/zinc/20/00/15/330200015.db2.gz NYMWIGFCMJTEEG-LSDHHAIUSA-N 1 3 298.352 3.501 20 0 CHADHO CC(C)Cc1cccc([C@H](C)[NH2+][C@@H]2CCNC[C@H]2C)c1 ZINC000423387139 330200094 /nfs/dbraw/zinc/20/00/94/330200094.db2.gz HPWDTKBOMUHBMJ-RVKKMQEKSA-N 1 3 274.452 3.534 20 0 CHADHO CCSc1ccc([C@H](C)N[C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000423390661 330200430 /nfs/dbraw/zinc/20/04/30/330200430.db2.gz PBTIARHAXSVSEG-AEGPPILISA-N 1 3 278.465 3.719 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2CCC(C)(C)c3ccccc32)CCN1 ZINC000423394443 330200771 /nfs/dbraw/zinc/20/07/71/330200771.db2.gz ZRMZNIREDFSCGN-CPUCHLNUSA-N 1 3 272.436 3.529 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000423395778 330200944 /nfs/dbraw/zinc/20/09/44/330200944.db2.gz NNPGYIZWRAJCSY-KBRIMQKVSA-N 1 3 292.442 3.891 20 0 CHADHO C[C@H](N)[C@H](C)[NH2+][C@@H](C)c1ccc(-c2ccccc2F)s1 ZINC000423448132 330202561 /nfs/dbraw/zinc/20/25/61/330202561.db2.gz PTIWDGUHZYBTLM-SRVKXCTJSA-N 1 3 292.423 3.941 20 0 CHADHO C[C@@H](CCC[NH3+])N[C@@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000423451974 330202881 /nfs/dbraw/zinc/20/28/81/330202881.db2.gz JCJLOXGNZSBCGC-TVQRCGJNSA-N 1 3 287.234 3.698 20 0 CHADHO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@H](C)[C@@H](C)N ZINC000423452443 330203123 /nfs/dbraw/zinc/20/31/23/330203123.db2.gz WIFDXRAGGYLPSH-UTUOFQBUSA-N 1 3 289.448 3.505 20 0 CHADHO C[C@H](NCCC[C@H]1CCC[NH2+]1)c1ccccc1Cl ZINC000423486463 330206732 /nfs/dbraw/zinc/20/67/32/330206732.db2.gz SUOCMTCNFGMIDY-STQMWFEESA-N 1 3 266.816 3.523 20 0 CHADHO [NH3+]C[C@@H]1CC[C@H](N[C@@H]2CCc3cc(Cl)cc(Cl)c32)C1 ZINC000423485687 330206832 /nfs/dbraw/zinc/20/68/32/330206832.db2.gz BDGIKLQBNXLGGX-LJWDBELGSA-N 1 3 299.245 3.698 20 0 CHADHO CC[C@@H](N)C[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C(C)C ZINC000423486664 330206926 /nfs/dbraw/zinc/20/69/26/330206926.db2.gz ZYDHIOQQRJMEHY-ZIAGYGMSSA-N 1 3 288.357 3.729 20 0 CHADHO C[C@H](c1ccccc1)[C@H](C)[NH2+][C@@H]1CNC[C@H]1c1ccccc1 ZINC000423501363 330208319 /nfs/dbraw/zinc/20/83/19/330208319.db2.gz DIVBDVNAHUEETE-CPLUKWAASA-N 1 3 294.442 3.524 20 0 CHADHO COc1cccc([C@@H](C)N[C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000423501704 330208490 /nfs/dbraw/zinc/20/84/90/330208490.db2.gz LMYSCLQMTWJAKN-BEFAXECRSA-N 1 3 298.430 3.826 20 0 CHADHO Cc1cncc([C@H](C)N[C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000423519706 330209713 /nfs/dbraw/zinc/20/97/13/330209713.db2.gz QETAQHYTTSAWRT-YJBOKZPZSA-N 1 3 283.419 3.521 20 0 CHADHO COc1ccc([C@@H](C)[NH2+][C@@H]2CCCCNC2)c2ccccc12 ZINC000423570796 330212039 /nfs/dbraw/zinc/21/20/39/330212039.db2.gz XDBHTORJVSRSIG-HUUCEWRRSA-N 1 3 298.430 3.641 20 0 CHADHO C[C@@H]([NH2+][C@H]1CCCCNC1)c1cccc2ccccc21 ZINC000423563208 330212176 /nfs/dbraw/zinc/21/21/76/330212176.db2.gz RDHUUGZXRIMJHU-ZBFHGGJFSA-N 1 3 268.404 3.633 20 0 CHADHO CCC(F)(F)C(C)(C)C[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000527670295 330269882 /nfs/dbraw/zinc/26/98/82/330269882.db2.gz NFDIDDDRGPRPKF-CHWSQXEVSA-N 1 3 276.415 3.520 20 0 CHADHO CC(C)c1cccc([C@@H](C)NC[C@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000527850773 330288273 /nfs/dbraw/zinc/28/82/73/330288273.db2.gz NZTYWPYVYPCWRB-HZPDHXFCSA-N 1 3 286.463 3.945 20 0 CHADHO CC(C)c1cccc([C@@H](C)NC[C@H]2CC[N@H+](C3CC3)C2)c1 ZINC000527850773 330288274 /nfs/dbraw/zinc/28/82/74/330288274.db2.gz NZTYWPYVYPCWRB-HZPDHXFCSA-N 1 3 286.463 3.945 20 0 CHADHO CC(C)c1cccc([C@@H](C)NC[C@@H]2CCC[N@H+](C)C2)c1 ZINC000527861495 330289277 /nfs/dbraw/zinc/28/92/77/330289277.db2.gz LNYTUUFKGGXONE-CVEARBPZSA-N 1 3 274.452 3.802 20 0 CHADHO CC(C)c1cccc([C@@H](C)NC[C@@H]2CCC[N@@H+](C)C2)c1 ZINC000527861495 330289278 /nfs/dbraw/zinc/28/92/78/330289278.db2.gz LNYTUUFKGGXONE-CVEARBPZSA-N 1 3 274.452 3.802 20 0 CHADHO Fc1cccc(C2CC(NCCC[NH+]3CCCCC3)C2)c1 ZINC000036843473 330293213 /nfs/dbraw/zinc/29/32/13/330293213.db2.gz PQOTYDXTSDPFHF-UHFFFAOYSA-N 1 3 290.426 3.537 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC[C@H]2CC=CCC2)CC1 ZINC000527988770 330299006 /nfs/dbraw/zinc/29/90/06/330299006.db2.gz YOQQACLVIFKIAE-HNNXBMFYSA-N 1 3 264.457 3.585 20 0 CHADHO CCCc1ccc([C@@H](C)NC[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000044534923 330329973 /nfs/dbraw/zinc/32/99/73/330329973.db2.gz WJJLQZXHTXKZKN-WBVHZDCISA-N 1 3 274.452 3.632 20 0 CHADHO CCCc1ccc([C@@H](C)NC[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000044534923 330329974 /nfs/dbraw/zinc/32/99/74/330329974.db2.gz WJJLQZXHTXKZKN-WBVHZDCISA-N 1 3 274.452 3.632 20 0 CHADHO CC[C@@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccc(Cl)cc1 ZINC000044534525 330329998 /nfs/dbraw/zinc/32/99/98/330329998.db2.gz GLGNASSGKSZMHC-XJKSGUPXSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1 ZINC000044534525 330329999 /nfs/dbraw/zinc/32/99/99/330329999.db2.gz GLGNASSGKSZMHC-XJKSGUPXSA-N 1 3 280.843 3.723 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCCC[C@H]1N)c1ccc(C(F)(F)F)cc1 ZINC000424337464 330343647 /nfs/dbraw/zinc/34/36/47/330343647.db2.gz RVBHCTCKGBGCOL-ZLKJLUDKSA-N 1 3 286.341 3.626 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCCC[C@H]1N)c1ccc(OC(F)F)cc1 ZINC000424373203 330348237 /nfs/dbraw/zinc/34/82/37/330348237.db2.gz JCWUVMNDZKBIOI-QLFBSQMISA-N 1 3 298.377 3.599 20 0 CHADHO Cc1cc2c(cc1C)[C@@H]([NH2+][C@@H]1CCCC[C@H]1N)CCS2 ZINC000424374456 330348393 /nfs/dbraw/zinc/34/83/93/330348393.db2.gz LCVMBILKHQUKOV-OWCLPIDISA-N 1 3 290.476 3.700 20 0 CHADHO CCSc1ccccc1[C@H](C)[NH2+][C@@H]1CCCC[C@H]1N ZINC000424378158 330348954 /nfs/dbraw/zinc/34/89/54/330348954.db2.gz SJDPJAACAKAKTH-NWANDNLSSA-N 1 3 278.465 3.719 20 0 CHADHO CC[C@@H]1CCC[C@@H]([NH2+]CCCN2CCC(C)CC2)C1 ZINC000071107112 330351138 /nfs/dbraw/zinc/35/11/38/330351138.db2.gz IRMCTJNSMZXMSC-IAGOWNOFSA-N 1 3 266.473 3.667 20 0 CHADHO c1cc(CN2C3CCC2CC3)cc(C[NH+]2C3CCC2CC3)c1 ZINC000533237432 330354438 /nfs/dbraw/zinc/35/44/38/330354438.db2.gz ZGEZCCNXMUEVEF-UHFFFAOYSA-N 1 3 296.458 3.940 20 0 CHADHO C[C@@H]1CC[N@H+](CC[C@@H]2CCCN2C)[C@H](c2ccco2)C1 ZINC000089614610 330386557 /nfs/dbraw/zinc/38/65/57/330386557.db2.gz ZADSIBSGUHAVKF-PMPSAXMXSA-N 1 3 276.424 3.537 20 0 CHADHO C[C@@H]1CC[N@@H+](CC[C@@H]2CCCN2C)[C@H](c2ccco2)C1 ZINC000089614610 330386558 /nfs/dbraw/zinc/38/65/58/330386558.db2.gz ZADSIBSGUHAVKF-PMPSAXMXSA-N 1 3 276.424 3.537 20 0 CHADHO C[C@H]1CC[C@H](N[C@@H]2C[C@H](C)[N@@H+](C)C[C@@H]2C)c2ccccc21 ZINC000090796134 330396318 /nfs/dbraw/zinc/39/63/18/330396318.db2.gz WWORSJKFUUTNEC-UNTXSKPGSA-N 1 3 286.463 3.943 20 0 CHADHO C[C@H]1CC[C@H](N[C@@H]2C[C@H](C)[N@H+](C)C[C@@H]2C)c2ccccc21 ZINC000090796134 330396319 /nfs/dbraw/zinc/39/63/19/330396319.db2.gz WWORSJKFUUTNEC-UNTXSKPGSA-N 1 3 286.463 3.943 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1N[C@@H]1CCCc2cc(F)ccc21 ZINC000090964340 330397424 /nfs/dbraw/zinc/39/74/24/330397424.db2.gz NSNHKKMVHSZSBZ-HLNSBACISA-N 1 3 290.426 3.521 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1N[C@@H]1CCCc2cc(F)ccc21 ZINC000090964340 330397425 /nfs/dbraw/zinc/39/74/25/330397425.db2.gz NSNHKKMVHSZSBZ-HLNSBACISA-N 1 3 290.426 3.521 20 0 CHADHO CCCN(CCC)CCC[NH2+]C1CCC(C(F)F)CC1 ZINC000442764217 330781527 /nfs/dbraw/zinc/78/15/27/330781527.db2.gz CPNMHMUOSDYWIY-UHFFFAOYSA-N 1 3 290.442 3.912 20 0 CHADHO CSCC1CCC([NH2+]CC[C@@H](C)N2CCCCC2)CC1 ZINC000449240831 330908929 /nfs/dbraw/zinc/90/89/29/330908929.db2.gz PCNXHKOTTFRPNG-KLAILNCOSA-N 1 3 298.540 3.762 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H]2CC[C@H](C)c3ccsc32)C1 ZINC000453069669 331086378 /nfs/dbraw/zinc/08/63/78/331086378.db2.gz UHMJGMCEUASMER-GUTXKFCHSA-N 1 3 278.465 3.618 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H]2CC[C@H](C)c3ccsc32)C1 ZINC000453069669 331086379 /nfs/dbraw/zinc/08/63/79/331086379.db2.gz UHMJGMCEUASMER-GUTXKFCHSA-N 1 3 278.465 3.618 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H]2CC[C@H](C)c3ccsc32)C1 ZINC000453069669 331086380 /nfs/dbraw/zinc/08/63/80/331086380.db2.gz UHMJGMCEUASMER-GUTXKFCHSA-N 1 3 278.465 3.618 20 0 CHADHO CC/C=C\CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000453317466 331115760 /nfs/dbraw/zinc/11/57/60/331115760.db2.gz KSWKDQZITLHNKO-VTSPJMBVSA-N 1 3 284.447 3.738 20 0 CHADHO CC/C=C\CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000453317466 331115761 /nfs/dbraw/zinc/11/57/61/331115761.db2.gz KSWKDQZITLHNKO-VTSPJMBVSA-N 1 3 284.447 3.738 20 0 CHADHO CC(C)(C)N1CCC([NH2+]C[C@@H]2C[C@H]2c2ccccc2)CC1 ZINC000459390651 331279660 /nfs/dbraw/zinc/27/96/60/331279660.db2.gz NHIRFPVLXYHWEX-WMZOPIPTSA-N 1 3 286.463 3.643 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC000459435976 331281221 /nfs/dbraw/zinc/28/12/21/331281221.db2.gz XYYTWDFCEIBQAL-ZWKOTPCHSA-N 1 3 272.436 3.526 20 0 CHADHO C[NH+](C)Cc1cccc(CNCc2ccc(C3CC3)cc2)c1 ZINC000459469779 331283345 /nfs/dbraw/zinc/28/33/45/331283345.db2.gz STTAGTKWHJLMLU-UHFFFAOYSA-N 1 3 294.442 3.915 20 0 CHADHO CN1CCC2(CCC[N@@H+]2Cc2ccc(C3CC3)cc2)CC1 ZINC000459514291 331285613 /nfs/dbraw/zinc/28/56/13/331285613.db2.gz OQLXWFUKIRYJBS-UHFFFAOYSA-N 1 3 284.447 3.624 20 0 CHADHO CN1CCC2(CCC[N@H+]2Cc2ccc(C3CC3)cc2)CC1 ZINC000459514291 331285614 /nfs/dbraw/zinc/28/56/14/331285614.db2.gz OQLXWFUKIRYJBS-UHFFFAOYSA-N 1 3 284.447 3.624 20 0 CHADHO c1cc(N2CCC([NH2+]CC3(C4CCC4)CCC3)CC2)ccn1 ZINC000459601144 331290110 /nfs/dbraw/zinc/29/01/10/331290110.db2.gz WIZKUFMQLBGSGX-UHFFFAOYSA-N 1 3 299.462 3.610 20 0 CHADHO C(CN[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)CC1CCCCC1 ZINC000166140181 331306682 /nfs/dbraw/zinc/30/66/82/331306682.db2.gz BQUFEXVNWJQDSF-IAGOWNOFSA-N 1 3 264.457 3.563 20 0 CHADHO C(CN[C@@H]1CC[N@H+]2CCC[C@@H]2C1)CC1CCCCC1 ZINC000166140181 331306683 /nfs/dbraw/zinc/30/66/83/331306683.db2.gz BQUFEXVNWJQDSF-IAGOWNOFSA-N 1 3 264.457 3.563 20 0 CHADHO C(C[NH2+][C@@H]1CCN2CCC[C@@H]2C1)CC1CCCCC1 ZINC000166140181 331306684 /nfs/dbraw/zinc/30/66/84/331306684.db2.gz BQUFEXVNWJQDSF-IAGOWNOFSA-N 1 3 264.457 3.563 20 0 CHADHO C[NH2+]CCC1CCN(Cc2ccc(C(C)(C)C)s2)CC1 ZINC000166176641 331306834 /nfs/dbraw/zinc/30/68/34/331306834.db2.gz QYNMBJKQAJBJBS-UHFFFAOYSA-N 1 3 294.508 3.867 20 0 CHADHO Cc1cccc2c1ncc(C)c2N1CCC(C[NH+](C)C)CC1 ZINC000462510102 331323038 /nfs/dbraw/zinc/32/30/38/331323038.db2.gz KLUZXHRIZQHKLM-UHFFFAOYSA-N 1 3 297.446 3.630 20 0 CHADHO CN1CCC[C@H]1CC[NH2+][C@@H]1CCCCC12CCCC2 ZINC000463444239 331347607 /nfs/dbraw/zinc/34/76/07/331347607.db2.gz MEDCLFYVEXVJLX-JKSUJKDBSA-N 1 3 264.457 3.563 20 0 CHADHO C[C@H](CC1CCCC1)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000468512793 331436295 /nfs/dbraw/zinc/43/62/95/331436295.db2.gz YFVMYEKCIUSOFV-CYBMUJFWSA-N 1 3 266.473 3.854 20 0 CHADHO C1CC([C@@H]2CC[C@@H]2[NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000510747587 332915082 /nfs/dbraw/zinc/91/50/82/332915082.db2.gz GKPDURRZGMWSPY-ROUUACIJSA-N 1 3 276.468 3.562 20 0 CHADHO C[C@@H](CC[NH2+][C@@H]1CCC12CCCC2)N1CCCCC1 ZINC000474046017 331565200 /nfs/dbraw/zinc/56/52/00/331565200.db2.gz RMIJSDTXJYZDSD-JKSUJKDBSA-N 1 3 264.457 3.563 20 0 CHADHO C[C@H]1CC[C@H](C[NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000475567563 331637717 /nfs/dbraw/zinc/63/77/17/331637717.db2.gz CZXPNOHPHAWIND-HOTGVXAUSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@H](C[NH2+]CC(C)(C)CN1CCCC1)c1ccc(F)cc1 ZINC000480926656 331791755 /nfs/dbraw/zinc/79/17/55/331791755.db2.gz LIYUWXNKRUXQEV-OAHLLOKOSA-N 1 3 292.442 3.641 20 0 CHADHO CC(C)(C[NH2+]C[C@H]1C[C@H]1c1ccccc1)CN1CCCC1 ZINC000480921986 331791764 /nfs/dbraw/zinc/79/17/64/331791764.db2.gz UUZGPMVONVIDRR-MSOLQXFVSA-N 1 3 286.463 3.502 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]([NH2+][C@@H]3CCN4CCC[C@@H]4C3)C2)cc1 ZINC000488364966 332002271 /nfs/dbraw/zinc/00/22/71/332002271.db2.gz ICXIXLMEUNXKON-IYWMVGAKSA-N 1 3 298.474 3.929 20 0 CHADHO c1ccc([C@@H]2CCC[C@H](N[C@@H]3CC[N@@H+]4CCC[C@@H]4C3)C2)cc1 ZINC000488364966 332002273 /nfs/dbraw/zinc/00/22/73/332002273.db2.gz ICXIXLMEUNXKON-IYWMVGAKSA-N 1 3 298.474 3.929 20 0 CHADHO c1ccc([C@@H]2CCC[C@H](N[C@@H]3CC[N@H+]4CCC[C@@H]4C3)C2)cc1 ZINC000488364966 332002274 /nfs/dbraw/zinc/00/22/74/332002274.db2.gz ICXIXLMEUNXKON-IYWMVGAKSA-N 1 3 298.474 3.929 20 0 CHADHO C[C@H](CC[NH2+][C@H]1CS[C@H](C(C)(C)C)C1)N1CCCCC1 ZINC000488562385 332017640 /nfs/dbraw/zinc/01/76/40/332017640.db2.gz SIPFOBHUOZCSPS-OAGGEKHMSA-N 1 3 298.540 3.761 20 0 CHADHO C[C@H](CCN[C@H]1CS[C@H](C(C)(C)C)C1)[NH+]1CCCCC1 ZINC000488562385 332017642 /nfs/dbraw/zinc/01/76/42/332017642.db2.gz SIPFOBHUOZCSPS-OAGGEKHMSA-N 1 3 298.540 3.761 20 0 CHADHO C[C@H]1CN(CCC[N@@H+]2C[C@H](C)CC2(C)C)C(C)(C)C1 ZINC000489356508 332048384 /nfs/dbraw/zinc/04/83/84/332048384.db2.gz FQMDQIMUXBEEPO-HUUCEWRRSA-N 1 3 266.473 3.617 20 0 CHADHO C[C@H]1CN(CCC[N@H+]2C[C@H](C)CC2(C)C)C(C)(C)C1 ZINC000489356508 332048385 /nfs/dbraw/zinc/04/83/85/332048385.db2.gz FQMDQIMUXBEEPO-HUUCEWRRSA-N 1 3 266.473 3.617 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+]CC2CCN(Cc3cccs3)CC2)[C@H]1C ZINC000494876923 332489190 /nfs/dbraw/zinc/48/91/90/332489190.db2.gz FUXNWKHJKPIYBB-JKIFEVAISA-N 1 3 292.492 3.594 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC12CCCC2)[C@H]1CCCN(C2CCC2)C1 ZINC000249119476 334328376 /nfs/dbraw/zinc/32/83/76/334328376.db2.gz SOGJDBMKPTUXFA-BQFCYCMXSA-N 1 3 290.495 3.952 20 0 CHADHO c1ccc(CN2C[C@@H]3CCCC[C@@H]([NH2+]C4CCC4)[C@H]3C2)cc1 ZINC000513656745 333029726 /nfs/dbraw/zinc/02/97/26/333029726.db2.gz XBWNRRMEQNUSPT-YSIASYRMSA-N 1 3 298.474 3.819 20 0 CHADHO CC(C)CC[C@H]([NH2+]C[C@@H](C)CN1CCCC1)C1CC1 ZINC000311551837 333069902 /nfs/dbraw/zinc/06/99/02/333069902.db2.gz LDFAEZFEHMVWDZ-WBVHZDCISA-N 1 3 266.473 3.523 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](CCC(C)C)C2CC2)C1 ZINC000517042772 333090620 /nfs/dbraw/zinc/09/06/20/333090620.db2.gz ADVJPZKPNVNIMB-DOTOQJQBSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)C[C@H](C[NH2+][C@H](C)C[C@@H](C)N)c1ccccc1 ZINC000517371883 333098078 /nfs/dbraw/zinc/09/80/78/333098078.db2.gz JWZYDMXITKDJRG-BFYDXBDKSA-N 1 3 262.441 3.532 20 0 CHADHO C/C(=C/c1ccccc1)C[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000521236553 333116057 /nfs/dbraw/zinc/11/60/57/333116057.db2.gz KLRWAUXIMCVACE-GTVARFKMSA-N 1 3 286.463 3.800 20 0 CHADHO CC(C)N(C)CCC[NH2+]CC[C@@H](C)c1ccccc1 ZINC000219375132 333148175 /nfs/dbraw/zinc/14/81/75/333148175.db2.gz HCNVXDFWNWFEGB-MRXNPFEDSA-N 1 3 262.441 3.500 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@H]1CC[C@@H](C)c2ccccc21 ZINC000222912327 333201831 /nfs/dbraw/zinc/20/18/31/333201831.db2.gz CGADDBONSWXZFN-CPUCHLNUSA-N 1 3 260.425 3.555 20 0 CHADHO CCc1ccc(CN[C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)s1 ZINC000225135122 333231534 /nfs/dbraw/zinc/23/15/34/333231534.db2.gz BHEXUCJLOHMOMP-YESZJQIVSA-N 1 3 292.492 3.711 20 0 CHADHO C[C@@H]1C[C@@H](N[C@H](c2ccc(Cl)cc2)C2CC2)CC[N@@H+]1C ZINC000227297820 333279825 /nfs/dbraw/zinc/27/98/25/333279825.db2.gz CSTGYHICZNBFQO-DQYPLSBCSA-N 1 3 292.854 3.863 20 0 CHADHO C[C@@H]1C[C@@H](N[C@H](c2ccc(Cl)cc2)C2CC2)CC[N@H+]1C ZINC000227297820 333279827 /nfs/dbraw/zinc/27/98/27/333279827.db2.gz CSTGYHICZNBFQO-DQYPLSBCSA-N 1 3 292.854 3.863 20 0 CHADHO C[C@@H]1C[C@H](N[C@H](c2ccc(Cl)cc2)C2CC2)CC[N@@H+]1C ZINC000227297808 333279916 /nfs/dbraw/zinc/27/99/16/333279916.db2.gz CSTGYHICZNBFQO-JLZZUVOBSA-N 1 3 292.854 3.863 20 0 CHADHO C[C@@H]1C[C@H](N[C@H](c2ccc(Cl)cc2)C2CC2)CC[N@H+]1C ZINC000227297808 333279918 /nfs/dbraw/zinc/27/99/18/333279918.db2.gz CSTGYHICZNBFQO-JLZZUVOBSA-N 1 3 292.854 3.863 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CC[C@@H]1CCCC1(C)C ZINC000530210032 333528121 /nfs/dbraw/zinc/52/81/21/333528121.db2.gz KIQYKIGUNISUKF-HIFRSBDPSA-N 1 3 289.467 3.716 20 0 CHADHO CC[C@H]1CCC[C@@H]([NH2+]C2CC(C)(C)NC(C)(C)C2)C1 ZINC000071107011 333843454 /nfs/dbraw/zinc/84/34/54/333843454.db2.gz ZUHFDUWMYDYERL-UONOGXRCSA-N 1 3 266.473 3.854 20 0 CHADHO C/C(=C\c1ccccc1)CN[C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000175009996 335171206 /nfs/dbraw/zinc/17/12/06/335171206.db2.gz HDMXZCGSHWDWFU-HRSGCLKMSA-N 1 3 272.436 3.552 20 0 CHADHO C/C(=C\c1ccccc1)C[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000175009996 335171207 /nfs/dbraw/zinc/17/12/07/335171207.db2.gz HDMXZCGSHWDWFU-HRSGCLKMSA-N 1 3 272.436 3.552 20 0 CHADHO CC(C)[NH+]1CCC(N[C@@]2(C)CCCc3ccccc32)CC1 ZINC000546581254 334038879 /nfs/dbraw/zinc/03/88/79/334038879.db2.gz LTEPCNQSEORCIC-IBGZPJMESA-N 1 3 286.463 3.701 20 0 CHADHO CCCC[C@H](COC)NC1CC[NH+](C2CCCCC2)CC1 ZINC000133986768 334076705 /nfs/dbraw/zinc/07/67/05/334076705.db2.gz BIULIQPWMLATKT-QGZVFWFLSA-N 1 3 296.499 3.578 20 0 CHADHO CCCC[C@H](COC)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000133986768 334076707 /nfs/dbraw/zinc/07/67/07/334076707.db2.gz BIULIQPWMLATKT-QGZVFWFLSA-N 1 3 296.499 3.578 20 0 CHADHO C[N@H+](CC1CC1)C[C@@H]1CCN([C@H]2C=CCCCCC2)C1 ZINC000549464464 334194718 /nfs/dbraw/zinc/19/47/18/334194718.db2.gz CNLFKFZFGUWNIU-ROUUACIJSA-N 1 3 276.468 3.539 20 0 CHADHO C[N@@H+](CC1CC1)C[C@@H]1CCN([C@H]2C=CCCCCC2)C1 ZINC000549464464 334194720 /nfs/dbraw/zinc/19/47/20/334194720.db2.gz CNLFKFZFGUWNIU-ROUUACIJSA-N 1 3 276.468 3.539 20 0 CHADHO CN(CC1CC1)C[C@@H]1CC[N@@H+]([C@H]2C=CCCCCC2)C1 ZINC000549464464 334194721 /nfs/dbraw/zinc/19/47/21/334194721.db2.gz CNLFKFZFGUWNIU-ROUUACIJSA-N 1 3 276.468 3.539 20 0 CHADHO CN(CC1CC1)C[C@@H]1CC[N@H+]([C@H]2C=CCCCCC2)C1 ZINC000549464464 334194722 /nfs/dbraw/zinc/19/47/22/334194722.db2.gz CNLFKFZFGUWNIU-ROUUACIJSA-N 1 3 276.468 3.539 20 0 CHADHO Cc1cc(Cl)cc(C[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)c1 ZINC000549763865 334204357 /nfs/dbraw/zinc/20/43/57/334204357.db2.gz NYYKXUTYIPWZHN-HZPDHXFCSA-N 1 3 280.843 3.611 20 0 CHADHO CSc1cc(C)ccc1C[NH2+][C@@H]1C[C@H](C)N(C)C[C@H]1C ZINC000247034331 334274340 /nfs/dbraw/zinc/27/43/40/334274340.db2.gz LLDZLMIAFUHIBP-IJEWVQPXSA-N 1 3 292.492 3.535 20 0 CHADHO C(C1CCCCC1)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246447328 334257847 /nfs/dbraw/zinc/25/78/47/334257847.db2.gz DQADZARDUDACJO-FUHWJXTLSA-N 1 3 276.468 3.515 20 0 CHADHO C(C1CCCCC1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246447328 334257848 /nfs/dbraw/zinc/25/78/48/334257848.db2.gz DQADZARDUDACJO-FUHWJXTLSA-N 1 3 276.468 3.515 20 0 CHADHO CCOc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H](N(C)C)C2)cc1 ZINC000246837885 334270488 /nfs/dbraw/zinc/27/04/88/334270488.db2.gz BKSRYIRGCOMKHI-BHYGNILZSA-N 1 3 290.451 3.609 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H](C)C2CCCCC2)C1 ZINC000246878172 334271132 /nfs/dbraw/zinc/27/11/32/334271132.db2.gz CPGXIRYLKOORBA-HZPDHXFCSA-N 1 3 266.473 3.665 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN([C@H](C)c2ccccc2C)C1 ZINC000248014452 334293458 /nfs/dbraw/zinc/29/34/58/334293458.db2.gz LPDIDHCWKPFNJB-IAGOWNOFSA-N 1 3 274.452 3.720 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN([C@H](C)c2ccccc2C)C1 ZINC000248014452 334293460 /nfs/dbraw/zinc/29/34/60/334293460.db2.gz LPDIDHCWKPFNJB-IAGOWNOFSA-N 1 3 274.452 3.720 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+]([C@H](C)c2ccccc2C)C1 ZINC000248014452 334293462 /nfs/dbraw/zinc/29/34/62/334293462.db2.gz LPDIDHCWKPFNJB-IAGOWNOFSA-N 1 3 274.452 3.720 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+]([C@H](C)c2ccccc2C)C1 ZINC000248014452 334293464 /nfs/dbraw/zinc/29/34/64/334293464.db2.gz LPDIDHCWKPFNJB-IAGOWNOFSA-N 1 3 274.452 3.720 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+](C[C@H](C)Cc2ccccc2)C1 ZINC000248573009 334306688 /nfs/dbraw/zinc/30/66/88/334306688.db2.gz MOOVHOFWSOLDME-IEBWSBKVSA-N 1 3 288.479 3.529 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+](C[C@H](C)Cc2ccccc2)C1 ZINC000248573009 334306689 /nfs/dbraw/zinc/30/66/89/334306689.db2.gz MOOVHOFWSOLDME-IEBWSBKVSA-N 1 3 288.479 3.529 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN(C[C@H](C)Cc2ccccc2)C1 ZINC000248573009 334306691 /nfs/dbraw/zinc/30/66/91/334306691.db2.gz MOOVHOFWSOLDME-IEBWSBKVSA-N 1 3 288.479 3.529 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN(C[C@H](C)Cc2ccccc2)C1 ZINC000248573009 334306693 /nfs/dbraw/zinc/30/66/93/334306693.db2.gz MOOVHOFWSOLDME-IEBWSBKVSA-N 1 3 288.479 3.529 20 0 CHADHO C[C@@H](NCCCC[N@@H+]1CCCC[C@@H]1C)c1cccc(O)c1 ZINC000249511998 334335127 /nfs/dbraw/zinc/33/51/27/334335127.db2.gz IKAXWSXHDYYZTD-JKSUJKDBSA-N 1 3 290.451 3.697 20 0 CHADHO C[C@@H](NCCCC[N@H+]1CCCC[C@@H]1C)c1cccc(O)c1 ZINC000249511998 334335128 /nfs/dbraw/zinc/33/51/28/334335128.db2.gz IKAXWSXHDYYZTD-JKSUJKDBSA-N 1 3 290.451 3.697 20 0 CHADHO C[C@H](CCN[C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1)c1ccccc1 ZINC000251253820 334358972 /nfs/dbraw/zinc/35/89/72/334358972.db2.gz UXHZJVVKWSRGPE-QXCFHYIPSA-N 1 3 286.463 3.691 20 0 CHADHO COc1ccc([C@@H](C)[NH2+]CCCN2CCCC[C@H]2C)cc1 ZINC000252175608 334375718 /nfs/dbraw/zinc/37/57/18/334375718.db2.gz OXESROMZUYCIDW-HZPDHXFCSA-N 1 3 290.451 3.610 20 0 CHADHO [NH3+][C@@H]1C[C@H](N[C@H]2CCC[C@H](C(F)(F)F)C2)c2ccccc21 ZINC000252794176 334393328 /nfs/dbraw/zinc/39/33/28/334393328.db2.gz YKPGSNRFOIPTTM-AZHAFVHUSA-N 1 3 298.352 3.842 20 0 CHADHO c1ccc2c(c1)cccc2CN[C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000262065135 334527406 /nfs/dbraw/zinc/52/74/06/334527406.db2.gz FIAHUVNZWQACRY-XUVXKRRUSA-N 1 3 294.442 3.850 20 0 CHADHO CC(C)[NH2+]CCCN[C@@H](c1cccs1)C1CCCC1 ZINC000566614428 334657539 /nfs/dbraw/zinc/65/75/39/334657539.db2.gz SOIZTHKPPLMOMG-MRXNPFEDSA-N 1 3 280.481 3.957 20 0 CHADHO CC[C@H]1CCC[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000157562631 334775781 /nfs/dbraw/zinc/77/57/81/334775781.db2.gz WBADZZXPZNHWHQ-MAUKXSAKSA-N 1 3 278.484 3.952 20 0 CHADHO CC1=C[C@H](C)C[C@@H](C[N@@H+]2CC[C@H](C3CCN(C)CC3)C2)C1 ZINC000576438600 335203604 /nfs/dbraw/zinc/20/36/04/335203604.db2.gz RZEAGSXFMMUSNS-WDYCEAGBSA-N 1 3 290.495 3.643 20 0 CHADHO CC1=C[C@H](C)C[C@@H](C[N@H+]2CC[C@H](C3CCN(C)CC3)C2)C1 ZINC000576438600 335203605 /nfs/dbraw/zinc/20/36/05/335203605.db2.gz RZEAGSXFMMUSNS-WDYCEAGBSA-N 1 3 290.495 3.643 20 0 CHADHO CCN(CC)CCC[N@@H+]1CC[C@@H](c2cccc(C)c2)C1 ZINC000576719564 335240211 /nfs/dbraw/zinc/24/02/11/335240211.db2.gz BYEWQAOSMJTQRL-GOSISDBHSA-N 1 3 274.452 3.516 20 0 CHADHO CCN(CC)CCC[N@H+]1CC[C@@H](c2cccc(C)c2)C1 ZINC000576719564 335240212 /nfs/dbraw/zinc/24/02/12/335240212.db2.gz BYEWQAOSMJTQRL-GOSISDBHSA-N 1 3 274.452 3.516 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN([C@@H](C)CCc2ccccc2)C1 ZINC000176282207 335256448 /nfs/dbraw/zinc/25/64/48/335256448.db2.gz OREMQJXMFQRYOZ-HKUYNNGSSA-N 1 3 288.479 3.671 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN([C@@H](C)CCc2ccccc2)C1 ZINC000176282207 335256449 /nfs/dbraw/zinc/25/64/49/335256449.db2.gz OREMQJXMFQRYOZ-HKUYNNGSSA-N 1 3 288.479 3.671 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+]([C@@H](C)CCc2ccccc2)C1 ZINC000176282207 335256450 /nfs/dbraw/zinc/25/64/50/335256450.db2.gz OREMQJXMFQRYOZ-HKUYNNGSSA-N 1 3 288.479 3.671 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+]([C@@H](C)CCc2ccccc2)C1 ZINC000176282207 335256451 /nfs/dbraw/zinc/25/64/51/335256451.db2.gz OREMQJXMFQRYOZ-HKUYNNGSSA-N 1 3 288.479 3.671 20 0 CHADHO CC(C)(CN[C@@H]1C[C@H]([NH3+])c2ccccc21)c1cccs1 ZINC000157473201 519271064 /nfs/dbraw/zinc/27/10/64/519271064.db2.gz XUTRKZJQGLNTDZ-LSDHHAIUSA-N 1 3 286.444 3.760 20 0 CHADHO CC(C)N(Cc1cccc(Cl)c1)C[C@H]1CCC[NH2+]C1 ZINC000226436086 519655858 /nfs/dbraw/zinc/65/58/58/519655858.db2.gz QBLPSSMMRSAWHB-HNNXBMFYSA-N 1 3 280.843 3.550 20 0 CHADHO CC(C)[C@H](N[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000127846909 519821538 /nfs/dbraw/zinc/82/15/38/519821538.db2.gz BGPAQWZNTRRHPU-KSZLIROESA-N 1 3 272.436 3.600 20 0 CHADHO CC(C)[C@H](N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000127846909 519821539 /nfs/dbraw/zinc/82/15/39/519821539.db2.gz BGPAQWZNTRRHPU-KSZLIROESA-N 1 3 272.436 3.600 20 0 CHADHO CCCOc1ccc([C@@H](C)NC2CC[NH+](CC)CC2)cc1 ZINC000038097946 520414716 /nfs/dbraw/zinc/41/47/16/520414716.db2.gz ZAWHOKHWBLWRAU-OAHLLOKOSA-N 1 3 290.451 3.610 20 0 CHADHO CCN(CC)CCC[NH2+]C1CCC(C(C)C)CC1 ZINC000054554396 520621744 /nfs/dbraw/zinc/62/17/44/520621744.db2.gz LDKVMUMDVKESMT-UHFFFAOYSA-N 1 3 254.462 3.523 20 0 CHADHO CC[NH+](CC)Cc1ccc(CN[C@@H](C)c2ccncc2)cc1 ZINC000120578536 520750339 /nfs/dbraw/zinc/75/03/39/520750339.db2.gz AJIKHNNEQRZJTQ-INIZCTEOSA-N 1 3 297.446 3.774 20 0 CHADHO CC[C@@H]([NH2+]C1CCN(c2ccncc2)CC1)c1ccccc1 ZINC000298260349 522812600 /nfs/dbraw/zinc/81/26/00/522812600.db2.gz FLMCQKQHOODLAD-LJQANCHMSA-N 1 3 295.430 3.791 20 0 CHADHO CC[C@@H](NCC[C@H]1CCCC[N@@H+]1C)c1ccccc1 ZINC000052206364 522840439 /nfs/dbraw/zinc/84/04/39/522840439.db2.gz SAKWQDYGKWTFJR-IAGOWNOFSA-N 1 3 260.425 3.602 20 0 CHADHO CC[C@@H](NCC[C@H]1CCCC[N@H+]1C)c1ccccc1 ZINC000052206364 522840445 /nfs/dbraw/zinc/84/04/45/522840445.db2.gz SAKWQDYGKWTFJR-IAGOWNOFSA-N 1 3 260.425 3.602 20 0 CHADHO CC[C@@H](N[C@@H](C)CC[NH+](C)C)c1ccc(Cl)cc1 ZINC000049553196 522909790 /nfs/dbraw/zinc/90/97/90/522909790.db2.gz NPGCBGOBYVFACL-SWLSCSKDSA-N 1 3 268.832 3.721 20 0 CHADHO Cc1ccc(C[C@H](C)N[C@@H]2C[C@@H]([NH3+])c3ccccc32)s1 ZINC000227541143 524683262 /nfs/dbraw/zinc/68/32/62/524683262.db2.gz QUWDZANNGMCOQL-YMRXKLBXSA-N 1 3 286.444 3.722 20 0 CHADHO Cc1ccc(C[C@H](C)N[C@H]2C[C@H]([NH3+])c3ccccc32)s1 ZINC000157454903 524683785 /nfs/dbraw/zinc/68/37/85/524683785.db2.gz QUWDZANNGMCOQL-GOPGUHFVSA-N 1 3 286.444 3.722 20 0 CHADHO C[C@H]1C[C@H](NCc2ccc(C3CCC3)cc2)CC[N@@H+]1C ZINC000277285103 524923380 /nfs/dbraw/zinc/92/33/80/524923380.db2.gz SXKRIDXUQYEIAK-KBXCAEBGSA-N 1 3 272.436 3.526 20 0 CHADHO C[C@H]1C[C@H](NCc2ccc(C3CCC3)cc2)CC[N@H+]1C ZINC000277285103 524923390 /nfs/dbraw/zinc/92/33/90/524923390.db2.gz SXKRIDXUQYEIAK-KBXCAEBGSA-N 1 3 272.436 3.526 20 0 CHADHO Cc1cc(NC2CC[NH+](C3CCCCC3)CC2)ccn1 ZINC000274957152 525263907 /nfs/dbraw/zinc/26/39/07/525263907.db2.gz WBVWPVSXCCVSBQ-UHFFFAOYSA-N 1 3 273.424 3.599 20 0 CHADHO Cc1ccsc1[C@H](C)NC[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000125833730 525887057 /nfs/dbraw/zinc/88/70/57/525887057.db2.gz ROVLIPWLSNWMRH-GJZGRUSLSA-N 1 3 280.481 3.828 20 0 CHADHO Cc1ccsc1[C@H](C)NC[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000125833730 525887066 /nfs/dbraw/zinc/88/70/66/525887066.db2.gz ROVLIPWLSNWMRH-GJZGRUSLSA-N 1 3 280.481 3.828 20 0 CHADHO Cc1ccsc1[C@H](C)[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000125833730 525887072 /nfs/dbraw/zinc/88/70/72/525887072.db2.gz ROVLIPWLSNWMRH-GJZGRUSLSA-N 1 3 280.481 3.828 20 0 CHADHO Cc1ccc2cc(C[NH2+]C3CCN(C(C)C)CC3)ccc2n1 ZINC000187636490 526231119 /nfs/dbraw/zinc/23/11/19/526231119.db2.gz HBQSXXXCYRWWLB-UHFFFAOYSA-N 1 3 297.446 3.506 20 0 CHADHO Cc1nc(C)c([C@@H](C)[NH2+]C[C@@H](C)CN2CCCCC2)s1 ZINC000111361637 526746477 /nfs/dbraw/zinc/74/64/77/526746477.db2.gz AJPVFYHUDAIOTK-CHWSQXEVSA-N 1 3 295.496 3.533 20 0 CHADHO Cc1nc(C)c([C@H](C)[NH2+]C2CCN(C(C)(C)C)CC2)s1 ZINC000111361565 526752118 /nfs/dbraw/zinc/75/21/18/526752118.db2.gz JZSZDNVSMLFLPR-LBPRGKRZSA-N 1 3 295.496 3.673 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2cccc3cccnc32)C[C@H]1C ZINC000353746944 527835061 /nfs/dbraw/zinc/83/50/61/527835061.db2.gz LXSSLXJKRPCUDC-QAPCUYQASA-N 1 3 297.446 3.539 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2cccc3cccnc32)C[C@H]1C ZINC000353746944 527835064 /nfs/dbraw/zinc/83/50/64/527835064.db2.gz LXSSLXJKRPCUDC-QAPCUYQASA-N 1 3 297.446 3.539 20 0 CHADHO CC[N@@H+]1CC[C@H](N[C@H]2CCCc3ccc(C)cc32)[C@H](C)C1 ZINC000352611843 527889772 /nfs/dbraw/zinc/88/97/72/527889772.db2.gz KNWOXNDLGGOMIV-MNEFBYGVSA-N 1 3 286.463 3.692 20 0 CHADHO CC[N@H+]1CC[C@H](N[C@H]2CCCc3ccc(C)cc32)[C@H](C)C1 ZINC000352611843 527889776 /nfs/dbraw/zinc/88/97/76/527889776.db2.gz KNWOXNDLGGOMIV-MNEFBYGVSA-N 1 3 286.463 3.692 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]Cc2ccc3occc3c2)C1 ZINC000352766426 529024268 /nfs/dbraw/zinc/02/42/68/529024268.db2.gz WSZQSIBEZZNLNB-MRXNPFEDSA-N 1 3 286.419 3.643 20 0 CHADHO CC(C)[N@H+](C)Cc1ccccc1CN[C@@H](C)c1cccnc1 ZINC000112527194 1125486827 /nfs/dbraw/zinc/48/68/27/1125486827.db2.gz NKLDKZPDNBUMFG-INIZCTEOSA-N 1 3 297.446 3.773 20 0 CHADHO CC(C)[N@@H+](C)Cc1ccccc1CN[C@@H](C)c1cccnc1 ZINC000112527194 1125486831 /nfs/dbraw/zinc/48/68/31/1125486831.db2.gz NKLDKZPDNBUMFG-INIZCTEOSA-N 1 3 297.446 3.773 20 0 CHADHO CC[C@H]([NH2+]C[C@@H](C)CN1CCCCC1)c1ccsc1 ZINC000394347276 1119237950 /nfs/dbraw/zinc/23/79/50/1119237950.db2.gz DELPQEGWIJQSBN-ZBFHGGJFSA-N 1 3 280.481 3.911 20 0 CHADHO CCC(C)(C)C1CCC([N@@H+]2C[C@H](C)[C@H](CN)C2)CC1 ZINC000708852773 1119981852 /nfs/dbraw/zinc/98/18/52/1119981852.db2.gz NASBOWRNHZWGDL-QRNKSROTSA-N 1 3 266.473 3.508 20 0 CHADHO CCC(C)(C)C1CCC([N@H+]2C[C@H](C)[C@H](CN)C2)CC1 ZINC000708852773 1119981855 /nfs/dbraw/zinc/98/18/55/1119981855.db2.gz NASBOWRNHZWGDL-QRNKSROTSA-N 1 3 266.473 3.508 20 0 CHADHO CCCC1CCC([NH2+][C@@H]2CCC[C@H](N(C)C)C2)CC1 ZINC000715541002 1120110018 /nfs/dbraw/zinc/11/00/18/1120110018.db2.gz GUXRDCDCIKBPQN-BACDZXNISA-N 1 3 266.473 3.808 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@@H+]1CC[C@]2(C1)CCCNC2 ZINC001222141285 1120492791 /nfs/dbraw/zinc/49/27/91/1120492791.db2.gz JPHFZMQOIUTUMP-QZTJIDSGSA-N 1 3 278.484 3.835 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[N@H+]1CC[C@]2(C1)CCCNC2 ZINC001222141285 1120492794 /nfs/dbraw/zinc/49/27/94/1120492794.db2.gz JPHFZMQOIUTUMP-QZTJIDSGSA-N 1 3 278.484 3.835 20 0 CHADHO CCC[C@H](C)N1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000500073869 1120503860 /nfs/dbraw/zinc/50/38/60/1120503860.db2.gz JBGPKGFWQSQUMT-ULQDDVLXSA-N 1 3 266.473 3.761 20 0 CHADHO CCC[C@H](C)N1CCC[C@@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000500073869 1120503864 /nfs/dbraw/zinc/50/38/64/1120503864.db2.gz JBGPKGFWQSQUMT-ULQDDVLXSA-N 1 3 266.473 3.761 20 0 CHADHO C[C@H](C[C@@H]1CCCCC[NH2+]1)NC[C@H]1CCCCC1(F)F ZINC000390598679 1120574906 /nfs/dbraw/zinc/57/49/06/1120574906.db2.gz UBYCTOZYOIAHBP-KFWWJZLASA-N 1 3 288.426 3.712 20 0 CHADHO CC1=C(C)CN([C@H](C)CC[N@@H+]2CCC(C)=C(C)C2)CC1 ZINC000483380211 1120664563 /nfs/dbraw/zinc/66/45/63/1120664563.db2.gz PIOGPBQCCMSOFD-GOSISDBHSA-N 1 3 276.468 3.849 20 0 CHADHO CC1=C(C)CN([C@H](C)CC[N@H+]2CCC(C)=C(C)C2)CC1 ZINC000483380211 1120664570 /nfs/dbraw/zinc/66/45/70/1120664570.db2.gz PIOGPBQCCMSOFD-GOSISDBHSA-N 1 3 276.468 3.849 20 0 CHADHO C[C@@H](c1cc(F)ccc1F)N(C)CCCCCCC[NH3+] ZINC000842471567 1121624552 /nfs/dbraw/zinc/62/45/52/1121624552.db2.gz JKQGKLOGISACTG-ZDUSSCGKSA-N 1 3 284.394 3.867 20 0 CHADHO CC(C)CN1CCC[C@@H](C[NH2+][C@@H]2CCCC(C)(C)C2)C1 ZINC001201557502 1123123625 /nfs/dbraw/zinc/12/36/25/1123123625.db2.gz KHNBAQJSPPJCMV-DLBZAZTESA-N 1 3 280.500 3.913 20 0 CHADHO COc1c(C)cc([C@@H](C)NCC[C@@H]([NH3+])C(C)C)cc1Cl ZINC000854230467 1123478748 /nfs/dbraw/zinc/47/87/48/1123478748.db2.gz QVPSCJPEPDRVSA-IUODEOHRSA-N 1 3 298.858 3.681 20 0 CHADHO C[C@@H]1CCC[C@H](CC[N@H+]2CCC[C@@H](N(C)C)CC2)C1 ZINC000429531811 1123558030 /nfs/dbraw/zinc/55/80/30/1123558030.db2.gz WRDALCDVBXFXBG-BRWVUGGUSA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CCC[C@@H]2C=CCC2)CC1 ZINC000872107375 1124685400 /nfs/dbraw/zinc/68/54/00/1124685400.db2.gz LSMCBEOGAOMDAN-OAHLLOKOSA-N 1 3 264.457 3.585 20 0 CHADHO CC(C)C[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCN(C(C)C)C2)C1 ZINC000230770217 1125395543 /nfs/dbraw/zinc/39/55/43/1125395543.db2.gz PDTVREQOONSWSO-OKZBNKHCSA-N 1 3 280.500 3.911 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC[C@@]2(C)C[C@]2(F)Cl)CC1 ZINC000846031396 1131680500 /nfs/dbraw/zinc/68/05/00/1131680500.db2.gz IHESFVRNRRFLJJ-LSDHHAIUSA-N 1 3 290.854 3.544 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[N@@H+]1C[C@H](CN)CC[C@@H]1C ZINC001246594369 1131709324 /nfs/dbraw/zinc/70/93/24/1131709324.db2.gz VMYXGTXNUGELRM-VGWMRTNUSA-N 1 3 254.462 3.651 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[N@H+]1C[C@H](CN)CC[C@@H]1C ZINC001246594369 1131709326 /nfs/dbraw/zinc/70/93/26/1131709326.db2.gz VMYXGTXNUGELRM-VGWMRTNUSA-N 1 3 254.462 3.651 20 0 CHADHO C[NH2+]CC[C@H](C)N1CCC[C@H]1c1ccccc1SC ZINC001246884593 1131803437 /nfs/dbraw/zinc/80/34/37/1131803437.db2.gz BZNQXGJMLLWRAJ-ZFWWWQNUSA-N 1 3 278.465 3.543 20 0 CHADHO C[C@H]1CC[C@H]([NH2+]C2CC(C)(C)N(C)C(C)(C)C2)CC1 ZINC001171623072 1132067036 /nfs/dbraw/zinc/06/70/36/1132067036.db2.gz JOKMSKCBEQGRNO-HDJSIYSDSA-N 1 3 266.473 3.806 20 0 CHADHO CC(C)=CCC[C@H](C)CCN1CCCC[C@@](F)(C[NH3+])C1 ZINC001206336999 1133691952 /nfs/dbraw/zinc/69/19/52/1133691952.db2.gz QBOQRGRWGRLPAW-DLBZAZTESA-N 1 3 284.463 3.912 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H]2C[C@@H](c3ccccc3)C2(C)C)C1 ZINC000248634470 1125673446 /nfs/dbraw/zinc/67/34/46/1125673446.db2.gz JLWZNUVIVOXXOD-NJAFHUGGSA-N 1 3 286.463 3.500 20 0 CHADHO CC1([NH+]2CCCC2)CCC(NCc2ccc(Cl)o2)CC1 ZINC000886562435 1125691612 /nfs/dbraw/zinc/69/16/12/1125691612.db2.gz ZZNFSRUBQYEBLR-UHFFFAOYSA-N 1 3 296.842 3.820 20 0 CHADHO CCC1(N2CCC2)CC[NH+]([C@H]2CCc3ccccc32)CC1 ZINC000886715940 1125712128 /nfs/dbraw/zinc/71/21/28/1125712128.db2.gz JRWYKDJLRFFQDS-SFHVURJKSA-N 1 3 284.447 3.624 20 0 CHADHO C[C@@H]([NH3+])[C@@H]1CCCN(C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000262047627 1125750521 /nfs/dbraw/zinc/75/05/21/1125750521.db2.gz ZDMSFHSGDQSPDX-UMVBOHGHSA-N 1 3 280.843 3.503 20 0 CHADHO CCCC[C@H](N[C@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000643521937 1129443890 /nfs/dbraw/zinc/44/38/90/1129443890.db2.gz FQQYZKACYAPZMU-IRXDYDNUSA-N 1 3 260.425 3.650 20 0 CHADHO C[C@H](N[C@H]1CC12CC[NH2+]CC2)c1cc(Cl)ccc1Cl ZINC000643534452 1129444603 /nfs/dbraw/zinc/44/46/03/1129444603.db2.gz VLNOXIWBUGCIGL-HZMBPMFUSA-N 1 3 299.245 3.786 20 0 CHADHO CCCCC[C@@H](CCC)[NH+]1CCC2(CN(C)C2)CC1 ZINC001258672660 1129485791 /nfs/dbraw/zinc/48/57/91/1129485791.db2.gz DGJBPCWPZIFTTD-MRXNPFEDSA-N 1 3 266.473 3.763 20 0 CHADHO CCC(CC)(CC)C[NH2+]C1CCN(CC(C)C)CC1 ZINC000391186750 1129658945 /nfs/dbraw/zinc/65/89/45/1129658945.db2.gz SYBPTYDAWZSFJK-UHFFFAOYSA-N 1 3 268.489 3.913 20 0 CHADHO CC(C)CCC[C@H](C)[NH+]1CCC(N(C)C2CC2)CC1 ZINC001170088572 1130203973 /nfs/dbraw/zinc/20/39/73/1130203973.db2.gz VTQWEHYXPHJRMJ-HNNXBMFYSA-N 1 3 266.473 3.760 20 0 CHADHO CCCc1cccc(CN2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)c1 ZINC000482006577 1126738796 /nfs/dbraw/zinc/73/87/96/1126738796.db2.gz MFTLANPKNGFUEB-RTBURBONSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1cccc(CN2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c1 ZINC000482006577 1126738797 /nfs/dbraw/zinc/73/87/97/1126738797.db2.gz MFTLANPKNGFUEB-RTBURBONSA-N 1 3 286.463 3.555 20 0 CHADHO CC(C)=CCC[C@@H](C)CC[NH+]1CCC(N(C)C)CC1 ZINC000482064698 1126740742 /nfs/dbraw/zinc/74/07/42/1126740742.db2.gz BVKJHHQJNJYTMC-MRXNPFEDSA-N 1 3 266.473 3.785 20 0 CHADHO CC(C)=CCC[C@@H](C)CCN1CCC([NH+](C)C)CC1 ZINC000482064698 1126740743 /nfs/dbraw/zinc/74/07/43/1126740743.db2.gz BVKJHHQJNJYTMC-MRXNPFEDSA-N 1 3 266.473 3.785 20 0 CHADHO CC(C)[C@@H]1C[C@H](N[C@H](C)C[C@H](C)[NH3+])c2ccccc21 ZINC000629532222 1126756414 /nfs/dbraw/zinc/75/64/14/1126756414.db2.gz RMNTUERPGLUAFA-RMHZUWNSSA-N 1 3 260.425 3.586 20 0 CHADHO CCN1CC[C@H]([N@H+](C)Cc2ccc(Cl)s2)[C@H](C)C1 ZINC000174769810 1126772855 /nfs/dbraw/zinc/77/28/55/1126772855.db2.gz GGCYYGRZRZAVAY-YPMHNXCESA-N 1 3 286.872 3.564 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)Cc2ccc(Cl)s2)[C@H](C)C1 ZINC000174769810 1126772859 /nfs/dbraw/zinc/77/28/59/1126772859.db2.gz GGCYYGRZRZAVAY-YPMHNXCESA-N 1 3 286.872 3.564 20 0 CHADHO CCC[C@H](C)[C@H](CC)[NH2+][C@H]1CCC[C@@H](N(C)C)C1 ZINC000484466304 1126816806 /nfs/dbraw/zinc/81/68/06/1126816806.db2.gz JXCZSTYEQBCOCH-JONQDZQNSA-N 1 3 254.462 3.664 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCc3cc(Cl)ccc32)C1 ZINC000484467591 1126817042 /nfs/dbraw/zinc/81/70/42/1126817042.db2.gz AALNQNYLLPEOGJ-ZMSDIMECSA-N 1 3 292.854 3.790 20 0 CHADHO C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+][C@@H]1CCC[C@H](N(C)C)C1 ZINC000484480419 1126820737 /nfs/dbraw/zinc/82/07/37/1126820737.db2.gz NPVIXUSVKAXUCB-GMLZMKKNSA-N 1 3 290.426 3.521 20 0 CHADHO c1ccc2c(c1)CCCC[C@@H]2NC1CC[NH+](CC2CC2)CC1 ZINC001168370682 1126963916 /nfs/dbraw/zinc/96/39/16/1126963916.db2.gz DYAXLNIOOUFAHW-FQEVSTJZSA-N 1 3 298.474 3.918 20 0 CHADHO CC[C@@H](NC[C@H]1CCC[N@H+](CC)C1)c1cccs1 ZINC001319754036 1126983867 /nfs/dbraw/zinc/98/38/67/1126983867.db2.gz IXLLSTPDILHRDS-ZIAGYGMSSA-N 1 3 266.454 3.521 20 0 CHADHO CC[C@@H](NC[C@H]1CCC[N@@H+](CC)C1)c1cccs1 ZINC001319754036 1126983869 /nfs/dbraw/zinc/98/38/69/1126983869.db2.gz IXLLSTPDILHRDS-ZIAGYGMSSA-N 1 3 266.454 3.521 20 0 CHADHO Cc1cccc([C@H](C)NC2CC[NH+](C3CCC3)CC2)c1 ZINC000268975028 1127030914 /nfs/dbraw/zinc/03/09/14/1127030914.db2.gz GNRJMTKPCDNRSO-HNNXBMFYSA-N 1 3 272.436 3.663 20 0 CHADHO c1ccc(C2CCN(C3CC[NH+](CC4CC4)CC3)CC2)cc1 ZINC001168378780 1127161171 /nfs/dbraw/zinc/16/11/71/1127161171.db2.gz ULRJUVJUSSNOSG-UHFFFAOYSA-N 1 3 298.474 3.740 20 0 CHADHO CC[N@H+](CCCN(C)C)Cc1c(C)cc(Cl)cc1C ZINC001237354460 1131091253 /nfs/dbraw/zinc/09/12/53/1131091253.db2.gz YACLJYNBXVVPLI-UHFFFAOYSA-N 1 3 282.859 3.730 20 0 CHADHO CC[N@@H+](CCCN(C)C)Cc1c(C)cc(Cl)cc1C ZINC001237354460 1131091259 /nfs/dbraw/zinc/09/12/59/1131091259.db2.gz YACLJYNBXVVPLI-UHFFFAOYSA-N 1 3 282.859 3.730 20 0 CHADHO Cc1cc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)N3C)ccc1Cl ZINC000572324380 1127197718 /nfs/dbraw/zinc/19/77/18/1127197718.db2.gz VRWANIDUZLJGKL-XYPWUTKMSA-N 1 3 292.854 3.705 20 0 CHADHO Cc1cc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)N3C)ccc1Cl ZINC000572324380 1127197721 /nfs/dbraw/zinc/19/77/21/1127197721.db2.gz VRWANIDUZLJGKL-XYPWUTKMSA-N 1 3 292.854 3.705 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H]2CC[C@@H](C)c3ccccc32)C1 ZINC000360235278 1127493185 /nfs/dbraw/zinc/49/31/85/1127493185.db2.gz TXDYPMKRGJCQSE-MDZRGWNJSA-N 1 3 286.463 3.947 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H]2CC[C@@H](C)c3ccccc32)C1 ZINC000360235278 1127493187 /nfs/dbraw/zinc/49/31/87/1127493187.db2.gz TXDYPMKRGJCQSE-MDZRGWNJSA-N 1 3 286.463 3.947 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@@H]2CC[N@H+](C)[C@H](C)C2)c1C ZINC000361080009 1127536385 /nfs/dbraw/zinc/53/63/85/1127536385.db2.gz NVPNLNYOVZYPQL-CXAGYDPISA-N 1 3 299.462 3.665 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1C ZINC000361080009 1127536388 /nfs/dbraw/zinc/53/63/88/1127536388.db2.gz NVPNLNYOVZYPQL-CXAGYDPISA-N 1 3 299.462 3.665 20 0 CHADHO CSCc1cccc(C[NH2+][C@@H]2CCN(C)C(C)(C)C2)c1 ZINC000598977878 1127648979 /nfs/dbraw/zinc/64/89/79/1127648979.db2.gz PGGMQDOCDXFHMC-MRXNPFEDSA-N 1 3 292.492 3.512 20 0 CHADHO CC[C@@H]([NH2+]C1CCN(CC2CC2)CC1)c1ccsc1 ZINC000295950183 1127658324 /nfs/dbraw/zinc/65/83/24/1127658324.db2.gz LLKGUISWSJYLTA-MRXNPFEDSA-N 1 3 278.465 3.663 20 0 CHADHO CCc1ccc(CCN(C)C2CC[NH+](C(C)C)CC2)cc1 ZINC000604384217 1127703977 /nfs/dbraw/zinc/70/39/77/1127703977.db2.gz ZNULBTOYJJYJAT-UHFFFAOYSA-N 1 3 288.479 3.596 20 0 CHADHO CC[N@@H+]1CC[C@@H](NCc2csc3ccccc23)[C@@H](C)C1 ZINC000540195234 1127968644 /nfs/dbraw/zinc/96/86/44/1127968644.db2.gz OXNLTJCMIXMZAY-XJKSGUPXSA-N 1 3 288.460 3.721 20 0 CHADHO CC[N@H+]1CC[C@@H](NCc2csc3ccccc23)[C@@H](C)C1 ZINC000540195234 1127968646 /nfs/dbraw/zinc/96/86/46/1127968646.db2.gz OXNLTJCMIXMZAY-XJKSGUPXSA-N 1 3 288.460 3.721 20 0 CHADHO CCC(CC)(CC)C[N@@H+]1CC[C@H]2[C@H](CCCN2C)C1 ZINC000542018887 1128047935 /nfs/dbraw/zinc/04/79/35/1128047935.db2.gz GCGFHGMHGZTTIG-CVEARBPZSA-N 1 3 266.473 3.619 20 0 CHADHO CCC(CC)(CC)C[N@H+]1CC[C@H]2[C@H](CCCN2C)C1 ZINC000542018887 1128047938 /nfs/dbraw/zinc/04/79/38/1128047938.db2.gz GCGFHGMHGZTTIG-CVEARBPZSA-N 1 3 266.473 3.619 20 0 CHADHO CC[C@H](c1ccccc1)[C@H]1CCC[N@@H+]1C[C@@H]1CCCNC1 ZINC000469873904 1128056363 /nfs/dbraw/zinc/05/63/63/1128056363.db2.gz OJCKOMXSKLRRCO-BHIYHBOVSA-N 1 3 286.463 3.644 20 0 CHADHO CC[C@H](c1ccccc1)[C@H]1CCC[N@H+]1C[C@@H]1CCCNC1 ZINC000469873904 1128056367 /nfs/dbraw/zinc/05/63/67/1128056367.db2.gz OJCKOMXSKLRRCO-BHIYHBOVSA-N 1 3 286.463 3.644 20 0 CHADHO CCN1CCC[C@@H](C[NH2+]C[C@H](C)c2cccc(Cl)c2)C1 ZINC000470198545 1128065954 /nfs/dbraw/zinc/06/59/54/1128065954.db2.gz SQHPSNJUUCTQJS-GJZGRUSLSA-N 1 3 294.870 3.765 20 0 CHADHO C[C@@H](NCCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccns1 ZINC000924684162 1128109899 /nfs/dbraw/zinc/10/98/99/1128109899.db2.gz JFDHRDSOAKVNKG-RBSFLKMASA-N 1 3 295.496 3.552 20 0 CHADHO CC(C)C[C@H](NCCC(C)(C)[NH3+])c1cccs1 ZINC000925743054 1128140529 /nfs/dbraw/zinc/14/05/29/1128140529.db2.gz ZZERBGUQDSCDPI-LBPRGKRZSA-N 1 3 254.443 3.552 20 0 CHADHO Cc1ccc2c(c1)[C@H](N[C@@H]1CCC[C@@H]([NH+](C)C)C1)[C@H](C)C2 ZINC000493277486 1128137924 /nfs/dbraw/zinc/13/79/24/1128137924.db2.gz RGPXTPYPDFZADH-KLICCBINSA-N 1 3 286.463 3.691 20 0 CHADHO Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)[C@H](C)C2 ZINC000493277486 1128137925 /nfs/dbraw/zinc/13/79/25/1128137925.db2.gz RGPXTPYPDFZADH-KLICCBINSA-N 1 3 286.463 3.691 20 0 CHADHO Cc1cscc1CN[C@@H](C)c1cccc(C[NH+](C)C)c1 ZINC000926302245 1128165991 /nfs/dbraw/zinc/16/59/91/1128165991.db2.gz JAFGEDUBTMBCAD-AWEZNQCLSA-N 1 3 288.460 3.969 20 0 CHADHO Cc1cccc([C@H](C)[NH2+]CC[C@H](C)N2CCCCC2)c1 ZINC000542487346 1128179606 /nfs/dbraw/zinc/17/96/06/1128179606.db2.gz UXMHZXPGVHCHLM-IRXDYDNUSA-N 1 3 274.452 3.910 20 0 CHADHO Cc1cccc([C@@H](C)[NH2+]CC[C@H](C)N2CCCCC2)c1 ZINC000542487344 1128180059 /nfs/dbraw/zinc/18/00/59/1128180059.db2.gz UXMHZXPGVHCHLM-DLBZAZTESA-N 1 3 274.452 3.910 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1coc2ccccc12 ZINC000926753217 1128191954 /nfs/dbraw/zinc/19/19/54/1128191954.db2.gz LUYRHVYDJOSSHX-LSDHHAIUSA-N 1 3 286.419 3.815 20 0 CHADHO Cc1csc([C@@H](C)NC2CCC(C)([NH+]3CCC3)CC2)n1 ZINC000927036162 1128210050 /nfs/dbraw/zinc/21/00/50/1128210050.db2.gz FHTCDNKHZZRQIO-VQCLRJIVSA-N 1 3 293.480 3.509 20 0 CHADHO CCC[C@H](C)N1CCC([NH3+])(c2ccc(Cl)cc2)CC1 ZINC001257314629 1128231300 /nfs/dbraw/zinc/23/13/00/1128231300.db2.gz WZFRHHYEPCEFPP-ZDUSSCGKSA-N 1 3 280.843 3.778 20 0 CHADHO CCCC[C@H](CC)N1CCC([N@H+](C)C2CCOCC2)CC1 ZINC001257425500 1128358625 /nfs/dbraw/zinc/35/86/25/1128358625.db2.gz SKPALWRSRVDDJY-INIZCTEOSA-N 1 3 296.499 3.530 20 0 CHADHO CCCC[C@H](CC)N1CCC([N@@H+](C)C2CCOCC2)CC1 ZINC001257425500 1128358629 /nfs/dbraw/zinc/35/86/29/1128358629.db2.gz SKPALWRSRVDDJY-INIZCTEOSA-N 1 3 296.499 3.530 20 0 CHADHO Cc1ccc(C)c([C@@H](C)NC[C@@H](C)C[NH+]2CCCC2)c1 ZINC000062078160 1128436615 /nfs/dbraw/zinc/43/66/15/1128436615.db2.gz SKTPGEANPDZJIW-NVXWUHKLSA-N 1 3 274.452 3.686 20 0 CHADHO CCN1CC[C@@H](C[NH2+]C2CC(C)(C)CC(C)(C)C2)C1 ZINC000124768283 1128445413 /nfs/dbraw/zinc/44/54/13/1128445413.db2.gz RTANVGUPVZLGFO-AWEZNQCLSA-N 1 3 266.473 3.523 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCN(C(C)C)C2)cc1 ZINC000125976713 1128458697 /nfs/dbraw/zinc/45/86/97/1128458697.db2.gz UGKFDVBTXZFJEY-SJORKVTESA-N 1 3 274.452 3.766 20 0 CHADHO CCC[C@@H](C)CC[C@@H](C)[NH2+]CC[C@H]1CCCN1C ZINC001257470930 1128470182 /nfs/dbraw/zinc/47/01/82/1128470182.db2.gz MFGOBNGTRCYJPI-BZUAXINKSA-N 1 3 254.462 3.665 20 0 CHADHO C[NH+](C)CC[C@H](NCc1ccc2[nH]ccc2c1)C(C)(C)C ZINC000565218903 1128521823 /nfs/dbraw/zinc/52/18/23/1128521823.db2.gz SXVVUOGREUBBSI-KRWDZBQOSA-N 1 3 287.451 3.624 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCc1ccc(-c2ccccc2)s1 ZINC000570842164 1128633544 /nfs/dbraw/zinc/63/35/44/1128633544.db2.gz CAZCKUKUDTWXLV-QWHCGFSZSA-N 1 3 274.433 3.631 20 0 CHADHO Cc1cc(C)c(CN2CC[C@]3(C2)CCC[N@@H+](C)C3)cc1C ZINC000556933525 1128648238 /nfs/dbraw/zinc/64/82/38/1128648238.db2.gz LHMZWHFSJPSJIO-LJQANCHMSA-N 1 3 286.463 3.530 20 0 CHADHO Cc1cc(C)c(CN2CC[C@]3(C2)CCC[N@H+](C)C3)cc1C ZINC000556933525 1128648239 /nfs/dbraw/zinc/64/82/39/1128648239.db2.gz LHMZWHFSJPSJIO-LJQANCHMSA-N 1 3 286.463 3.530 20 0 CHADHO C[C@@H]1CCC[C@H](N2CCC([NH2+]C3CC(C)(C)C3)CC2)C1 ZINC000578524555 1128720067 /nfs/dbraw/zinc/72/00/67/1128720067.db2.gz JJMMPQXHEJQOSY-PBHICJAKSA-N 1 3 278.484 3.808 20 0 CHADHO CC1=C[C@H](C)C[C@H](C[NH2+]C[C@H]2CCCN(C(C)C)C2)C1 ZINC000578513865 1128720165 /nfs/dbraw/zinc/72/01/65/1128720165.db2.gz POSDZQTZSVWRDY-JQHSSLGASA-N 1 3 278.484 3.689 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H]2CCCCC23CCCC3)C1 ZINC000578650185 1128725428 /nfs/dbraw/zinc/72/54/28/1128725428.db2.gz GSZOFDCRRDRDQM-IRXDYDNUSA-N 1 3 278.484 3.811 20 0 CHADHO CCC[C@H]([NH2+][C@H]1CCNC2(CCC2)C1)C1CCCCC1 ZINC000643547034 1117793626 /nfs/dbraw/zinc/79/36/26/1117793626.db2.gz YSOXAPRIKNNAHJ-IRXDYDNUSA-N 1 3 278.484 4.000 20 0 CHADHO C[C@H]1CC[C@H](C[NH3+])CN1Cc1cccc(C(C)(C)C)c1 ZINC001206767586 1117818768 /nfs/dbraw/zinc/81/87/68/1117818768.db2.gz CCTPNOYAXJPDSU-GOEBONIOSA-N 1 3 274.452 3.543 20 0 CHADHO Cc1ccc([C@@H](N[C@H]2CC[N@@H+](C)C(C)(C)C2)C2CC2)cc1 ZINC000623352083 1117840230 /nfs/dbraw/zinc/84/02/30/1117840230.db2.gz ONQLTJKRLCQZEU-ZWKOTPCHSA-N 1 3 286.463 3.909 20 0 CHADHO Cc1ccc([C@@H](N[C@H]2CC[N@H+](C)C(C)(C)C2)C2CC2)cc1 ZINC000623352083 1117840236 /nfs/dbraw/zinc/84/02/36/1117840236.db2.gz ONQLTJKRLCQZEU-ZWKOTPCHSA-N 1 3 286.463 3.909 20 0 CHADHO C[C@@H](CC[NH2+]C[C@@H](C)C(C)(C)C)N1CCCCC1 ZINC000670269051 1117848332 /nfs/dbraw/zinc/84/83/32/1117848332.db2.gz LDXARHGUSLQCHE-CABCVRRESA-N 1 3 254.462 3.523 20 0 CHADHO C[N@@H+]1CC[C@H](NCc2cccc3ccsc32)CC1(C)C ZINC000623558752 1117871401 /nfs/dbraw/zinc/87/14/01/1117871401.db2.gz HSGNZDADABKKDP-HNNXBMFYSA-N 1 3 288.460 3.864 20 0 CHADHO C[N@H+]1CC[C@H](NCc2cccc3ccsc32)CC1(C)C ZINC000623558752 1117871407 /nfs/dbraw/zinc/87/14/07/1117871407.db2.gz HSGNZDADABKKDP-HNNXBMFYSA-N 1 3 288.460 3.864 20 0 CHADHO CN1CCCC[C@@H](C[NH2+]Cc2ccc3ccccc3c2)C1 ZINC000623655308 1117883459 /nfs/dbraw/zinc/88/34/59/1117883459.db2.gz UNVQKPOPYJKRLL-KRWDZBQOSA-N 1 3 282.431 3.661 20 0 CHADHO C[N@@H+]1CCCC[C@@H](CNCc2cccc3ccccc32)C1 ZINC000623654662 1117884252 /nfs/dbraw/zinc/88/42/52/1117884252.db2.gz FPULGHPWLSUZLP-INIZCTEOSA-N 1 3 282.431 3.661 20 0 CHADHO C[N@H+]1CCCC[C@@H](CNCc2cccc3ccccc32)C1 ZINC000623654662 1117884258 /nfs/dbraw/zinc/88/42/58/1117884258.db2.gz FPULGHPWLSUZLP-INIZCTEOSA-N 1 3 282.431 3.661 20 0 CHADHO CN1CCCC[C@@H](C[NH2+]Cc2cccc3ccccc32)C1 ZINC000623654662 1117884262 /nfs/dbraw/zinc/88/42/62/1117884262.db2.gz FPULGHPWLSUZLP-INIZCTEOSA-N 1 3 282.431 3.661 20 0 CHADHO CC(C)Oc1cccc([C@@H](C)[NH2+]CC[C@@H]2CCCN2C)c1 ZINC000179683878 1117909655 /nfs/dbraw/zinc/90/96/55/1117909655.db2.gz FZAVAMCPBADCGE-WBVHZDCISA-N 1 3 290.451 3.609 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H]1CCN(CC)C1)c1cc(C)ccc1C ZINC000623867010 1117947900 /nfs/dbraw/zinc/94/79/00/1117947900.db2.gz NGDSZVUDBBOWDQ-FUHWJXTLSA-N 1 3 274.452 3.686 20 0 CHADHO CC1(C)[C@@H](c2ccccc2)[C@@H]1NC1CC[NH+](CC2CC2)CC1 ZINC000624067739 1117978251 /nfs/dbraw/zinc/97/82/51/1117978251.db2.gz ACXUNYIPPSPVKE-OALUTQOASA-N 1 3 298.474 3.643 20 0 CHADHO Cc1cc([C@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)c(C)s1 ZINC000624119891 1117983768 /nfs/dbraw/zinc/98/37/68/1117983768.db2.gz LTVISMFLZXQBLL-ZFWWWQNUSA-N 1 3 280.481 3.747 20 0 CHADHO CSc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)cc1 ZINC000624120246 1117985343 /nfs/dbraw/zinc/98/53/43/1117985343.db2.gz UTSKGVBSRLKDJN-CABCVRRESA-N 1 3 292.492 3.791 20 0 CHADHO C[C@@H]1[C@H]([NH2+]C[C@@H]2CCCCN(C)C2)C[C@@H]1c1ccccc1 ZINC000624122313 1117985699 /nfs/dbraw/zinc/98/56/99/1117985699.db2.gz OCFFNVKPZWAHKS-PBWTXFEYSA-N 1 3 286.463 3.500 20 0 CHADHO Cc1cccc([C@H](C)NC[C@H]2CCCC[N@H+](C)C2)c1C ZINC000624120922 1117986036 /nfs/dbraw/zinc/98/60/36/1117986036.db2.gz KIGGADGZBYGEKK-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO Cc1cccc([C@H](C)NC[C@H]2CCCC[N@@H+](C)C2)c1C ZINC000624120922 1117986041 /nfs/dbraw/zinc/98/60/41/1117986041.db2.gz KIGGADGZBYGEKK-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO Cc1cccc([C@H](C)[NH2+]C[C@H]2CCCCN(C)C2)c1C ZINC000624120922 1117986042 /nfs/dbraw/zinc/98/60/42/1117986042.db2.gz KIGGADGZBYGEKK-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)C1CCC(F)(F)CC1 ZINC000624123192 1117986683 /nfs/dbraw/zinc/98/66/83/1117986683.db2.gz HRHIOWWRYNSXON-KGLIPLIRSA-N 1 3 288.426 3.522 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1cccc(C2CC2)c1 ZINC000624124162 1117987238 /nfs/dbraw/zinc/98/72/38/1117987238.db2.gz YRKQCLSSAZHREB-HZPDHXFCSA-N 1 3 286.463 3.947 20 0 CHADHO CC(C)CN1CCC([NH2+]C[C@@H](C)Cc2ccccc2)CC1 ZINC000182051846 1118012494 /nfs/dbraw/zinc/01/24/94/1118012494.db2.gz JQJXNZGUPLPWOV-KRWDZBQOSA-N 1 3 288.479 3.575 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H]2CCC(C)(C)c3ccccc32)C1 ZINC000037643689 1118033824 /nfs/dbraw/zinc/03/38/24/1118033824.db2.gz PYXDVDZFWHUHCQ-CRAIPNDOSA-N 1 3 286.463 3.731 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H]2CCC(C)(C)c3ccccc32)C1 ZINC000037643689 1118033829 /nfs/dbraw/zinc/03/38/29/1118033829.db2.gz PYXDVDZFWHUHCQ-CRAIPNDOSA-N 1 3 286.463 3.731 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H]2CCC(C)(C)c3ccccc32)C1 ZINC000037643689 1118033834 /nfs/dbraw/zinc/03/38/34/1118033834.db2.gz PYXDVDZFWHUHCQ-CRAIPNDOSA-N 1 3 286.463 3.731 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)c1cccc2ccccc21)CN(C)C ZINC000380423378 1118069730 /nfs/dbraw/zinc/06/97/30/1118069730.db2.gz IJAJHGKORJTMSV-GJZGRUSLSA-N 1 3 270.420 3.688 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H](C)CSC(C)(C)C)C1 ZINC000247130036 1118097235 /nfs/dbraw/zinc/09/72/35/1118097235.db2.gz VKPFGLUHCRMCTH-HUUCEWRRSA-N 1 3 286.529 3.617 20 0 CHADHO C[C@@H](CSC(C)(C)C)[NH2+]CCCN1CCCC[C@@H]1C ZINC000764635091 1118103874 /nfs/dbraw/zinc/10/38/74/1118103874.db2.gz ISWJGYKHSRJVET-GJZGRUSLSA-N 1 3 286.529 3.761 20 0 CHADHO CC/C=C\CCN1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC001167256530 1118123409 /nfs/dbraw/zinc/12/34/09/1118123409.db2.gz ZCPIQLZDNSXEIE-PYTPGESOSA-N 1 3 278.484 3.787 20 0 CHADHO CC/C=C\CCN1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC001167256533 1118123992 /nfs/dbraw/zinc/12/39/92/1118123992.db2.gz ZCPIQLZDNSXEIE-XDXAGZTOSA-N 1 3 278.484 3.787 20 0 CHADHO CC[C@H]([NH2+]C1CCN(CC2CCCCC2)CC1)C1CC1 ZINC000765453665 1118153059 /nfs/dbraw/zinc/15/30/59/1118153059.db2.gz QJEZIJRCPNZXOX-SFHVURJKSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@H](Cc1ccc(Cl)cc1)[NH2+][C@H]1CCC[C@H](N(C)C)C1 ZINC000715491956 1118279741 /nfs/dbraw/zinc/27/97/41/1118279741.db2.gz RPVDTCRILOPBHK-COXVUDFISA-N 1 3 294.870 3.733 20 0 CHADHO CC[C@H](C)C[C@H](CC)[NH2+][C@H]1CCC[C@H](N(C)C)C1 ZINC000715510949 1118308339 /nfs/dbraw/zinc/30/83/39/1118308339.db2.gz RLNJXOBEGRUFAW-VGWMRTNUSA-N 1 3 254.462 3.664 20 0 CHADHO CCCCCC[C@H](C)[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000040622466 1118312163 /nfs/dbraw/zinc/31/21/63/1118312163.db2.gz MOVFOPUFFDOOGI-JKSUJKDBSA-N 1 3 254.462 3.665 20 0 CHADHO Cc1ccc2c(c1)nccc2N[C@H]1CCCC[C@@H]1[NH+](C)C ZINC001168602796 1118368007 /nfs/dbraw/zinc/36/80/07/1118368007.db2.gz ZWQUXSATCZNRPT-WMZOPIPTSA-N 1 3 283.419 3.828 20 0 CHADHO C[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)c1ccc(-c2ccncc2)cc1 ZINC000580062714 1118370685 /nfs/dbraw/zinc/37/06/85/1118370685.db2.gz WNBIXMOMDNSLQL-ZOCIIQOWSA-N 1 3 295.430 3.669 20 0 CHADHO C[NH+](C)CC[C@@H](NCc1cc2ccccc2[nH]1)C(C)(C)C ZINC000683930271 1118448849 /nfs/dbraw/zinc/44/88/49/1118448849.db2.gz YIVYHCAONCKTPF-QGZVFWFLSA-N 1 3 287.451 3.624 20 0 CHADHO CC(C)[C@H](N[C@@H]1CC[NH2+]C[C@H]1C)c1ccc(Cl)cc1 ZINC000261582905 1118463266 /nfs/dbraw/zinc/46/32/66/1118463266.db2.gz GVTGEANQRANKJS-WQVCFCJDSA-N 1 3 280.843 3.625 20 0 CHADHO C[NH2+]Cc1ccc(Nc2ccnc(C(C)(C)C)c2)cc1 ZINC001211129338 1118469012 /nfs/dbraw/zinc/46/90/12/1118469012.db2.gz RHYUOKWMJWBECC-UHFFFAOYSA-N 1 3 269.392 3.842 20 0 CHADHO C[C@@H]([NH3+])[C@@H]1CCCN(Cc2ccc(-c3ccccc3)cc2)C1 ZINC000262001669 1118479044 /nfs/dbraw/zinc/47/90/44/1118479044.db2.gz VFWWKGCVSNQRGP-OXQOHEQNSA-N 1 3 294.442 3.913 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H](C)c2cccc(C3CC3)c2)C1 ZINC000580906658 1118519496 /nfs/dbraw/zinc/51/94/96/1118519496.db2.gz HVGMUEUXCMGCSL-HZPDHXFCSA-N 1 3 286.463 3.947 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H](C)c2cccc(C3CC3)c2)C1 ZINC000580906658 1118519497 /nfs/dbraw/zinc/51/94/97/1118519497.db2.gz HVGMUEUXCMGCSL-HZPDHXFCSA-N 1 3 286.463 3.947 20 0 CHADHO CC[N@H+](CCCN1CCCC1)Cc1ccc(SC)cc1 ZINC000349406446 1118577507 /nfs/dbraw/zinc/57/75/07/1118577507.db2.gz LMECOFUJHVZVQF-UHFFFAOYSA-N 1 3 292.492 3.716 20 0 CHADHO CC[N@@H+](CCCN1CCCC1)Cc1ccc(SC)cc1 ZINC000349406446 1118577508 /nfs/dbraw/zinc/57/75/08/1118577508.db2.gz LMECOFUJHVZVQF-UHFFFAOYSA-N 1 3 292.492 3.716 20 0 CHADHO Clc1cscc1CN1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000656784137 1118657801 /nfs/dbraw/zinc/65/78/01/1118657801.db2.gz YXAWUQGLPOXSOA-CYBMUJFWSA-N 1 3 298.883 3.613 20 0 CHADHO CCCCN1CCC([NH2+][C@H]2CCc3c2cccc3F)CC1 ZINC000211868295 1118763709 /nfs/dbraw/zinc/76/37/09/1118763709.db2.gz OFURFURJEZUBTE-SFHVURJKSA-N 1 3 290.426 3.667 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCC[C@@H]1CCCF)CN1CCCCC1 ZINC000510724395 1118796994 /nfs/dbraw/zinc/79/69/94/1118796994.db2.gz XNLLVCPHGPFBNF-BRWVUGGUSA-N 1 3 284.463 3.616 20 0 CHADHO C[C@H]([NH2+][C@@H]1CC[C@H]1C1CCC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000510947024 1118872257 /nfs/dbraw/zinc/87/22/57/1118872257.db2.gz XKHIRBKSUXYQQZ-QNDJGXFYSA-N 1 3 290.495 3.808 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCc1ccc(-c2ccc(F)cc2)s1 ZINC000563135068 1118923753 /nfs/dbraw/zinc/92/37/53/1118923753.db2.gz DSYJWRHZALBCNI-VXGBXAGGSA-N 1 3 292.423 3.770 20 0 CHADHO CC(C)CCN1CCC([NH2+]C[C@@H]2CCC(F)(F)C2)CC1 ZINC000926345163 1118959154 /nfs/dbraw/zinc/95/91/54/1118959154.db2.gz NTDJCVSBOGORGD-CQSZACIVSA-N 1 3 288.426 3.522 20 0 CHADHO Cc1ccoc1C[NH2+]C[C@H]1CCCN(Cc2ccccc2)C1 ZINC000380910187 1118964914 /nfs/dbraw/zinc/96/49/14/1118964914.db2.gz KVXBPILLPDLELZ-GOSISDBHSA-N 1 3 298.430 3.590 20 0 CHADHO C[N@H+](C1CCC(C(C)(C)C)CC1)[C@@H]1CCCNCC1 ZINC000226450381 1118971847 /nfs/dbraw/zinc/97/18/47/1118971847.db2.gz MRBCYXUJHHFHQH-HWOWSKLDSA-N 1 3 266.473 3.665 20 0 CHADHO C[N@@H+](C1CCC(C(C)(C)C)CC1)[C@@H]1CCCNCC1 ZINC000226450381 1118971849 /nfs/dbraw/zinc/97/18/49/1118971849.db2.gz MRBCYXUJHHFHQH-HWOWSKLDSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H]2C[C@@H](C)c3ccccc32)C1 ZINC000582383124 1119064559 /nfs/dbraw/zinc/06/45/59/1119064559.db2.gz MHZPQVAWNXHILB-GJYPPUQNSA-N 1 3 286.463 3.945 20 0 CHADHO CC(C)C[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCN(C(C)C)C2)C1 ZINC000300328642 1119273358 /nfs/dbraw/zinc/27/33/58/1119273358.db2.gz PDTVREQOONSWSO-RCCFBDPRSA-N 1 3 280.500 3.911 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)c2ccc(SC)c(F)c2)C1 ZINC000163249229 1119382174 /nfs/dbraw/zinc/38/21/74/1119382174.db2.gz QGJOWYCIVHVYIH-QWHCGFSZSA-N 1 3 296.455 3.540 20 0 CHADHO Cc1ccc([C@H](NCc2ccc(C[NH3+])cc2F)C2CC2)cc1 ZINC000650754766 1119412731 /nfs/dbraw/zinc/41/27/31/1119412731.db2.gz QFHXPTGEQPZLGR-IBGZPJMESA-N 1 3 298.405 3.834 20 0 CHADHO CC[C@H](NCc1ccc(C[NH3+])cc1F)c1cccc(C)c1 ZINC000650756089 1119413483 /nfs/dbraw/zinc/41/34/83/1119413483.db2.gz UJSYDJKNSZXPHE-SFHVURJKSA-N 1 3 286.394 3.834 20 0 CHADHO CCOc1ccc([C@@H](C)NCc2ccccc2C[NH2+]C)cc1 ZINC000650758512 1119416829 /nfs/dbraw/zinc/41/68/29/1119416829.db2.gz QZYUUPXADPMKDG-OAHLLOKOSA-N 1 3 298.430 3.656 20 0 CHADHO CC(C)[C@H](NCc1ccc(C[NH+](C)C)cc1)c1cccnc1 ZINC000091266006 1119554930 /nfs/dbraw/zinc/55/49/30/1119554930.db2.gz SMFGPZFACRGGME-IBGZPJMESA-N 1 3 297.446 3.630 20 0 CHADHO CC(C)[C@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1cccnc1 ZINC000091372556 1119556140 /nfs/dbraw/zinc/55/61/40/1119556140.db2.gz CZRMERLWWYIDPL-KRWDZBQOSA-N 1 3 289.467 3.631 20 0 CHADHO C[C@H](NCCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(F)cn1 ZINC000092739330 1119564976 /nfs/dbraw/zinc/56/49/76/1119564976.db2.gz DNPLEIMHASGEDU-GJZGRUSLSA-N 1 3 293.430 3.526 20 0 CHADHO C[C@H](NCCCC[N@H+]1CCCC[C@@H]1C)c1ccc(F)cn1 ZINC000092739330 1119564978 /nfs/dbraw/zinc/56/49/78/1119564978.db2.gz DNPLEIMHASGEDU-GJZGRUSLSA-N 1 3 293.430 3.526 20 0 CHADHO Cc1cc([C@@H](C)[NH2+]CCCN2CCC(C)CC2)cs1 ZINC000381377099 1119584214 /nfs/dbraw/zinc/58/42/14/1119584214.db2.gz OHWLUMDSIVCSKI-OAHLLOKOSA-N 1 3 280.481 3.829 20 0 CHADHO C[C@H]1CCCC[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000132186422 1119654038 /nfs/dbraw/zinc/65/40/38/1119654038.db2.gz ZILPDEQVNLOXDW-MAUKXSAKSA-N 1 3 278.484 3.952 20 0 CHADHO Cc1ccc([C@@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)C2CC2)cc1 ZINC000295051313 1119846592 /nfs/dbraw/zinc/84/65/92/1119846592.db2.gz PNRDDYGDRYSIMF-XVLXNVKGSA-N 1 3 284.447 3.661 20 0 CHADHO Cc1ccc([C@@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)C2CC2)cc1 ZINC000295051313 1119846595 /nfs/dbraw/zinc/84/65/95/1119846595.db2.gz PNRDDYGDRYSIMF-XVLXNVKGSA-N 1 3 284.447 3.661 20 0 CHADHO CC(C)(C)N1CCC([NH2+]C[C@@H]2CCC[C@@H]2C2CC2)CC1 ZINC000414207157 1119939463 /nfs/dbraw/zinc/93/94/63/1119939463.db2.gz ZENXGGYHNWJDTQ-DOTOQJQBSA-N 1 3 278.484 3.665 20 0 CHADHO Cc1ccc(C)c([C@@H](C)NC[C@H]2CCCC[N@H+](C)C2)c1 ZINC000624119459 1120052322 /nfs/dbraw/zinc/05/23/22/1120052322.db2.gz BMESHBQENRNSDY-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc(C)c([C@@H](C)NC[C@H]2CCCC[N@@H+](C)C2)c1 ZINC000624119459 1120052326 /nfs/dbraw/zinc/05/23/26/1120052326.db2.gz BMESHBQENRNSDY-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc(C)c([C@@H](C)[NH2+]C[C@H]2CCCCN(C)C2)c1 ZINC000624119459 1120052329 /nfs/dbraw/zinc/05/23/29/1120052329.db2.gz BMESHBQENRNSDY-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H](N(C)C)C2)CC(C)(C)C1 ZINC000715539234 1120081675 /nfs/dbraw/zinc/08/16/75/1120081675.db2.gz BTYCYBAYJSYXPJ-LVQVYYBASA-N 1 3 266.473 3.664 20 0 CHADHO CC(C)c1nc(CNC2CCC(C)([NH+](C)C)CC2)cs1 ZINC000715580942 1120136631 /nfs/dbraw/zinc/13/66/31/1120136631.db2.gz OWUOPDPBONXCOA-UHFFFAOYSA-N 1 3 295.496 3.619 20 0 CHADHO C[N@@H+](Cc1ccccc1)CC1CCN(C/C=C/Cl)CC1 ZINC000728688757 1120141159 /nfs/dbraw/zinc/14/11/59/1120141159.db2.gz ULRPQKKJPZQOEK-BJMVGYQFSA-N 1 3 292.854 3.583 20 0 CHADHO C[N@H+](Cc1ccccc1)CC1CCN(C/C=C/Cl)CC1 ZINC000728688757 1120141162 /nfs/dbraw/zinc/14/11/62/1120141162.db2.gz ULRPQKKJPZQOEK-BJMVGYQFSA-N 1 3 292.854 3.583 20 0 CHADHO C[C@H]([NH3+])[C@@H]1CCCN(Cc2ccc(C(C)(C)C)cc2)C1 ZINC000111695820 1120155046 /nfs/dbraw/zinc/15/50/46/1120155046.db2.gz NSHSDCRZGYIKTE-GOEBONIOSA-N 1 3 274.452 3.543 20 0 CHADHO CCCCc1ccc(CN(CCC)C[C@H]2CC[NH2+]C2)s1 ZINC001236833922 1128902199 /nfs/dbraw/zinc/90/21/99/1128902199.db2.gz DIUQUVUKKDRYFP-HNNXBMFYSA-N 1 3 294.508 3.912 20 0 CHADHO CC(C)(C)CCCN1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000499556133 1120321635 /nfs/dbraw/zinc/32/16/35/1120321635.db2.gz YQCJHSPDWMHBBZ-NVXWUHKLSA-N 1 3 278.484 3.761 20 0 CHADHO CC(C)(C)CCCN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000499556133 1120321639 /nfs/dbraw/zinc/32/16/39/1120321639.db2.gz YQCJHSPDWMHBBZ-NVXWUHKLSA-N 1 3 278.484 3.761 20 0 CHADHO CN1CCC[C@@H]2C[N@H+](CC[C@@H]3CCc4ccccc43)CC[C@H]21 ZINC000660009767 1120339273 /nfs/dbraw/zinc/33/92/73/1120339273.db2.gz ACHBPBQAQHRWLQ-NLWGTHIKSA-N 1 3 298.474 3.523 20 0 CHADHO CN1CCC[C@@H]2C[N@@H+](CC[C@@H]3CCc4ccccc43)CC[C@H]21 ZINC000660009767 1120339276 /nfs/dbraw/zinc/33/92/76/1120339276.db2.gz ACHBPBQAQHRWLQ-NLWGTHIKSA-N 1 3 298.474 3.523 20 0 CHADHO CC(C)[C@@H]1C[C@H](N[C@@H](C)C[C@@H](C)[NH3+])c2ccccc21 ZINC000629532220 1128914176 /nfs/dbraw/zinc/91/41/76/1128914176.db2.gz RMNTUERPGLUAFA-OQUILHJVSA-N 1 3 260.425 3.586 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417310962 1120425827 /nfs/dbraw/zinc/42/58/27/1120425827.db2.gz LDGMHMFNHODAGX-XFIYOXNOSA-N 1 3 292.492 3.703 20 0 CHADHO c1cc(C2CC[NH+](CCCN3CCCCC3)CC2)cs1 ZINC000189242783 1120477423 /nfs/dbraw/zinc/47/74/23/1120477423.db2.gz AIEUINUCKCFMHC-UHFFFAOYSA-N 1 3 292.492 3.804 20 0 CHADHO CCc1c2ccccc2oc1[C@@H](C)[NH2+]CCCN(C)C ZINC000019959023 1120499459 /nfs/dbraw/zinc/49/94/59/1120499459.db2.gz DCWHCJKLLSNLSI-CYBMUJFWSA-N 1 3 274.408 3.598 20 0 CHADHO C[C@H]([NH2+]CCCN1CCCC[C@H]1C)c1ccccc1 ZINC000019913011 1120548870 /nfs/dbraw/zinc/54/88/70/1120548870.db2.gz KLWSNYSXZKFAJO-CVEARBPZSA-N 1 3 260.425 3.602 20 0 CHADHO CN(C)[C@H]1CCC[N@H+](CC[C@@H]2CCc3ccccc32)CC1 ZINC000660416644 1120590606 /nfs/dbraw/zinc/59/06/06/1120590606.db2.gz VEYCAQBLNUBJAH-ROUUACIJSA-N 1 3 286.463 3.523 20 0 CHADHO CN(C)[C@H]1CCC[N@@H+](CC[C@@H]2CCc3ccccc32)CC1 ZINC000660416644 1120590608 /nfs/dbraw/zinc/59/06/08/1120590608.db2.gz VEYCAQBLNUBJAH-ROUUACIJSA-N 1 3 286.463 3.523 20 0 CHADHO CCCSC[C@H](C)[NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000893487725 1120795288 /nfs/dbraw/zinc/79/52/88/1120795288.db2.gz LWGZRHBCSWEDQD-JYJNAYRXSA-N 1 3 298.540 3.761 20 0 CHADHO CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663464143 1120981088 /nfs/dbraw/zinc/98/10/88/1120981088.db2.gz COWVDGNIRSDRPD-BBWFWOEESA-N 1 3 278.484 3.523 20 0 CHADHO C(CC1CCCCC1)CN1CCC([NH+]2CCC2)CC1 ZINC001207608882 1121141669 /nfs/dbraw/zinc/14/16/69/1121141669.db2.gz ZUMLQORADGFGNT-UHFFFAOYSA-N 1 3 264.457 3.517 20 0 CHADHO C[C@H](c1ccccc1Cl)N1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000063197606 1121201516 /nfs/dbraw/zinc/20/15/16/1121201516.db2.gz GLJYLCZJPXCCGI-DYVFJYSZSA-N 1 3 292.854 3.865 20 0 CHADHO CCN(CC)CCC[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000124220797 1121288122 /nfs/dbraw/zinc/28/81/22/1121288122.db2.gz UAPBZTYEENGEGX-UHFFFAOYSA-N 1 3 294.405 3.677 20 0 CHADHO CC(C)c1ccc(CCN2CCC[C@H]([NH+](C)C)CC2)cc1 ZINC000432796080 1121359568 /nfs/dbraw/zinc/35/95/68/1121359568.db2.gz FICBMCMFRRDGHR-IBGZPJMESA-N 1 3 288.479 3.769 20 0 CHADHO CC(C)c1ccc(CC[N@@H+]2CCC[C@H](N(C)C)CC2)cc1 ZINC000432796080 1121359578 /nfs/dbraw/zinc/35/95/78/1121359578.db2.gz FICBMCMFRRDGHR-IBGZPJMESA-N 1 3 288.479 3.769 20 0 CHADHO CC(C)c1ccc(CC[N@H+]2CCC[C@H](N(C)C)CC2)cc1 ZINC000432796080 1121359587 /nfs/dbraw/zinc/35/95/87/1121359587.db2.gz FICBMCMFRRDGHR-IBGZPJMESA-N 1 3 288.479 3.769 20 0 CHADHO CC[C@@H]1CCC[C@@H](C[N@@H+]2CCC[C@@H](N(C)C)CC2)C1 ZINC000432801293 1121367102 /nfs/dbraw/zinc/36/71/02/1121367102.db2.gz VIWFSUMFMQAXPT-BRWVUGGUSA-N 1 3 266.473 3.619 20 0 CHADHO CC[C@@H]1CCC[C@@H](C[N@H+]2CCC[C@@H](N(C)C)CC2)C1 ZINC000432801293 1121367111 /nfs/dbraw/zinc/36/71/11/1121367111.db2.gz VIWFSUMFMQAXPT-BRWVUGGUSA-N 1 3 266.473 3.619 20 0 CHADHO C[C@@H](CC[NH+](C)C)N[C@@H]1CCCc2c(Cl)cccc21 ZINC000543599595 1121509092 /nfs/dbraw/zinc/50/90/92/1121509092.db2.gz CFSSWHYVMSPDHN-BLLLJJGKSA-N 1 3 280.843 3.647 20 0 CHADHO C[NH+](C)Cc1ccc(Nc2ccnc(C3CC3)c2)cc1 ZINC001176290497 1121591565 /nfs/dbraw/zinc/59/15/65/1121591565.db2.gz HZBGDUNYCQTLLS-UHFFFAOYSA-N 1 3 267.376 3.764 20 0 CHADHO C[C@@H]1C[C@H](N[C@@H](c2cccc(F)c2)C(C)(C)C)CC[N@@H+]1C ZINC000162180412 1121663356 /nfs/dbraw/zinc/66/33/56/1121663356.db2.gz NSWOXAQLUSOEHQ-XYPHTWIQSA-N 1 3 292.442 3.985 20 0 CHADHO C[C@@H]1C[C@H](N[C@@H](c2cccc(F)c2)C(C)(C)C)CC[N@H+]1C ZINC000162180412 1121663362 /nfs/dbraw/zinc/66/33/62/1121663362.db2.gz NSWOXAQLUSOEHQ-XYPHTWIQSA-N 1 3 292.442 3.985 20 0 CHADHO c1ccc(CN2C[C@@H]3CCC[C@@H]([NH2+]CCC4CC4)[C@H]3C2)cc1 ZINC000512666418 1121673774 /nfs/dbraw/zinc/67/37/74/1121673774.db2.gz KKANHFVWWBYJRN-SLFFLAALSA-N 1 3 298.474 3.677 20 0 CHADHO CC[NH+](CC)CCCN1C[C@H](C)C[C@@H]1c1ccccc1 ZINC000513236994 1121676754 /nfs/dbraw/zinc/67/67/54/1121676754.db2.gz ROWLAOXHDTWBMC-SJLPKXTDSA-N 1 3 274.452 3.801 20 0 CHADHO CCN(CC)CCC[N@@H+]1C[C@H](C)C[C@@H]1c1ccccc1 ZINC000513236994 1121676755 /nfs/dbraw/zinc/67/67/55/1121676755.db2.gz ROWLAOXHDTWBMC-SJLPKXTDSA-N 1 3 274.452 3.801 20 0 CHADHO CCN(CC)CCC[N@H+]1C[C@H](C)C[C@@H]1c1ccccc1 ZINC000513236994 1121676757 /nfs/dbraw/zinc/67/67/57/1121676757.db2.gz ROWLAOXHDTWBMC-SJLPKXTDSA-N 1 3 274.452 3.801 20 0 CHADHO Fc1cc(CN[C@@H]2CCC[N@@H+]3CCCC[C@H]23)ccc1Cl ZINC001179044729 1121841644 /nfs/dbraw/zinc/84/16/44/1121841644.db2.gz OWKXJWNFYQPKMS-HZPDHXFCSA-N 1 3 296.817 3.586 20 0 CHADHO Fc1cc(CN[C@@H]2CCC[N@H+]3CCCC[C@H]23)ccc1Cl ZINC001179044729 1121841659 /nfs/dbraw/zinc/84/16/59/1121841659.db2.gz OWKXJWNFYQPKMS-HZPDHXFCSA-N 1 3 296.817 3.586 20 0 CHADHO CC1(C)CCC[C@@H]([NH2+]C[C@@H]2CCCN(CC3CC3)C2)C1 ZINC001179259526 1121865664 /nfs/dbraw/zinc/86/56/64/1121865664.db2.gz UTKWSZGSUMOJAZ-DLBZAZTESA-N 1 3 278.484 3.667 20 0 CHADHO CC(C)(C)C[NH2+]C1CCN(CC2CCCCC2)CC1 ZINC000731450220 1121868412 /nfs/dbraw/zinc/86/84/12/1121868412.db2.gz QZZXAWDFLKDXTC-UHFFFAOYSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@@H](NCCC1CC[NH2+]CC1)c1c(F)cccc1Cl ZINC000420394791 1122004366 /nfs/dbraw/zinc/00/43/66/1122004366.db2.gz CRZYRVTYRNHCGY-LLVKDONJSA-N 1 3 284.806 3.519 20 0 CHADHO CC[C@@H]1C[C@@]1([NH2+]CC[C@@H]1CCCN1C)c1cccc(C)c1 ZINC000502479157 1122091446 /nfs/dbraw/zinc/09/14/46/1122091446.db2.gz DAPWMWPWFMNSPR-NEWSRXKRSA-N 1 3 286.463 3.694 20 0 CHADHO CN(C)[C@H]1CCC[C@H]([NH2+]Cc2cccc(C3CC3)c2)C1 ZINC000421367264 1122102471 /nfs/dbraw/zinc/10/24/71/1122102471.db2.gz SKUXMCOIZWMLRT-ROUUACIJSA-N 1 3 272.436 3.526 20 0 CHADHO CC(C)CCN1CCC([NH2+]C[C@@H]2C[C@H]2C2CCC2)CC1 ZINC001182507269 1122172291 /nfs/dbraw/zinc/17/22/91/1122172291.db2.gz AJLLUOJTFXDVAQ-WMZOPIPTSA-N 1 3 278.484 3.523 20 0 CHADHO CN(CC(C)(C)C[NH+](C)C)C[C@@]1(C)C[C@@H]1c1ccccc1 ZINC001184196809 1122259386 /nfs/dbraw/zinc/25/93/86/1122259386.db2.gz INNIZTARTQDPDY-IEBWSBKVSA-N 1 3 288.479 3.700 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CC[C@@H](C)[C@H](CN)C1 ZINC001205296217 1122275024 /nfs/dbraw/zinc/27/50/24/1122275024.db2.gz JGMBHJSSQWDJAZ-GVDBMIGSSA-N 1 3 266.473 3.676 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CC[C@@H](C)[C@H](CN)C1 ZINC001205296217 1122275026 /nfs/dbraw/zinc/27/50/26/1122275026.db2.gz JGMBHJSSQWDJAZ-GVDBMIGSSA-N 1 3 266.473 3.676 20 0 CHADHO CCc1oc2ccccc2c1CN1CC[C@]2(CC[N@H+](C)C2)C1 ZINC000430117641 1122407445 /nfs/dbraw/zinc/40/74/45/1122407445.db2.gz ZGZRWDVMAPCJDC-IBGZPJMESA-N 1 3 298.430 3.523 20 0 CHADHO CCc1oc2ccccc2c1CN1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000430117641 1122407447 /nfs/dbraw/zinc/40/74/47/1122407447.db2.gz ZGZRWDVMAPCJDC-IBGZPJMESA-N 1 3 298.430 3.523 20 0 CHADHO C[C@@H]1CCCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167960475 1122517586 /nfs/dbraw/zinc/51/75/86/1122517586.db2.gz ZEZPGRLEPVKOLO-FSUMODHMSA-N 1 3 276.468 3.560 20 0 CHADHO C[C@H]1CCCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167960474 1122517867 /nfs/dbraw/zinc/51/78/67/1122517867.db2.gz ZEZPGRLEPVKOLO-FRKNIRMPSA-N 1 3 276.468 3.560 20 0 CHADHO C(=C\C1CC1)\CN[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716693195 1122636397 /nfs/dbraw/zinc/63/63/97/1122636397.db2.gz OPHFIYMBASPBLC-QWUFYTQJSA-N 1 3 296.458 3.595 20 0 CHADHO C(=C\C1CC1)\CN[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716693195 1122636401 /nfs/dbraw/zinc/63/64/01/1122636401.db2.gz OPHFIYMBASPBLC-QWUFYTQJSA-N 1 3 296.458 3.595 20 0 CHADHO C(=C\C1CC1)\C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000716693195 1122636403 /nfs/dbraw/zinc/63/64/03/1122636403.db2.gz OPHFIYMBASPBLC-QWUFYTQJSA-N 1 3 296.458 3.595 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)c1ccc[nH]1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000775524304 1122639708 /nfs/dbraw/zinc/63/97/08/1122639708.db2.gz FLZRKXRPWHXYKG-RYRKJORJSA-N 1 3 297.446 3.576 20 0 CHADHO Cc1ccc([C@H]([NH2+]C[C@@H](C)CN(C)C)C2CCC2)cc1 ZINC000425940826 1122671859 /nfs/dbraw/zinc/67/18/59/1122671859.db2.gz AWNFZTWCLISYNU-CRAIPNDOSA-N 1 3 274.452 3.624 20 0 CHADHO CCN(CC)CCC[NH2+]C1(Cc2ccccc2)CCCC1 ZINC001193223983 1122682070 /nfs/dbraw/zinc/68/20/70/1122682070.db2.gz FOWCZDXIXKMHCY-UHFFFAOYSA-N 1 3 288.479 3.863 20 0 CHADHO CC1(C)CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C1 ZINC001167973174 1122869333 /nfs/dbraw/zinc/86/93/33/1122869333.db2.gz IJYREQNISKHFQA-MGNMYUMUSA-N 1 3 276.468 3.560 20 0 CHADHO CC1CCN(CC[C@@H]2CCC[N@@H+]2[C@@H]2C=CCCC2)CC1 ZINC001196936127 1122940254 /nfs/dbraw/zinc/94/02/54/1122940254.db2.gz PYTIUGZNYKESQD-MSOLQXFVSA-N 1 3 276.468 3.682 20 0 CHADHO CC1CCN(CC[C@@H]2CCC[N@H+]2[C@@H]2C=CCCC2)CC1 ZINC001196936127 1122940256 /nfs/dbraw/zinc/94/02/56/1122940256.db2.gz PYTIUGZNYKESQD-MSOLQXFVSA-N 1 3 276.468 3.682 20 0 CHADHO CC1CC[NH+](CC[C@@H]2CCCN2[C@@H]2C=CCCC2)CC1 ZINC001196936127 1122940258 /nfs/dbraw/zinc/94/02/58/1122940258.db2.gz PYTIUGZNYKESQD-MSOLQXFVSA-N 1 3 276.468 3.682 20 0 CHADHO CC(C)C[C@H](CN1CC[C@H]2[NH2+]CC[C@H]2C1)c1ccccc1 ZINC000427120193 1122945243 /nfs/dbraw/zinc/94/52/43/1122945243.db2.gz AHMZKWRLXVPXNB-IPMKNSEASA-N 1 3 286.463 3.500 20 0 CHADHO CCC[C@@H](C)CCCN1CCN(c2cc[nH+]cc2)C[C@H]1C ZINC001197931067 1122973875 /nfs/dbraw/zinc/97/38/75/1122973875.db2.gz UXFZCQTVRBSLEJ-IAGOWNOFSA-N 1 3 289.467 3.809 20 0 CHADHO CCC[C@@H](C)CCC[N@@H+]1CCN(c2ccncc2)C[C@H]1C ZINC001197931067 1122973877 /nfs/dbraw/zinc/97/38/77/1122973877.db2.gz UXFZCQTVRBSLEJ-IAGOWNOFSA-N 1 3 289.467 3.809 20 0 CHADHO CCC[C@@H](C)CCC[N@H+]1CCN(c2ccncc2)C[C@H]1C ZINC001197931067 1122973878 /nfs/dbraw/zinc/97/38/78/1122973878.db2.gz UXFZCQTVRBSLEJ-IAGOWNOFSA-N 1 3 289.467 3.809 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1C[NH2+]CCCN1CCC(C)CC1 ZINC001199012819 1123018331 /nfs/dbraw/zinc/01/83/31/1123018331.db2.gz GLZKLCPNQVNDLO-ROUUACIJSA-N 1 3 278.484 3.690 20 0 CHADHO C[C@@H]1[C@@H](C[NH3+])CCCN1Cc1cccc(C(C)(C)C)c1 ZINC001205912779 1123075624 /nfs/dbraw/zinc/07/56/24/1123075624.db2.gz CFTJHIMOPZXRKY-GDBMZVCRSA-N 1 3 274.452 3.543 20 0 CHADHO CN1CCCC[C@@H]1CC[N@H+](C)CCc1ccccc1Cl ZINC000441372174 1123082650 /nfs/dbraw/zinc/08/26/50/1123082650.db2.gz BNRRBIRBZBRMHK-MRXNPFEDSA-N 1 3 294.870 3.689 20 0 CHADHO CN1CCCC[C@@H]1CC[N@@H+](C)CCc1ccccc1Cl ZINC000441372174 1123082656 /nfs/dbraw/zinc/08/26/56/1123082656.db2.gz BNRRBIRBZBRMHK-MRXNPFEDSA-N 1 3 294.870 3.689 20 0 CHADHO C1=CC[C@H](C[N@H+]2CCCC[C@@H]2CCN2CCCC2)CC1 ZINC001201418798 1123097647 /nfs/dbraw/zinc/09/76/47/1123097647.db2.gz SERFPZQKIGPJJT-ZWKOTPCHSA-N 1 3 276.468 3.683 20 0 CHADHO C1=CC[C@H](C[N@@H+]2CCCC[C@@H]2CCN2CCCC2)CC1 ZINC001201418798 1123097650 /nfs/dbraw/zinc/09/76/50/1123097650.db2.gz SERFPZQKIGPJJT-ZWKOTPCHSA-N 1 3 276.468 3.683 20 0 CHADHO C[N@H+](CC(C)(C)C)C1CCN(C2CCCCC2)CC1 ZINC001201446579 1123106623 /nfs/dbraw/zinc/10/66/23/1123106623.db2.gz FWAFSIZOVWOTIF-UHFFFAOYSA-N 1 3 266.473 3.761 20 0 CHADHO C[N@@H+](CC(C)(C)C)C1CCN(C2CCCCC2)CC1 ZINC001201446579 1123106625 /nfs/dbraw/zinc/10/66/25/1123106625.db2.gz FWAFSIZOVWOTIF-UHFFFAOYSA-N 1 3 266.473 3.761 20 0 CHADHO C[C@@H]1CC[N@@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)[C@@H](C)C1 ZINC001167996146 1123116941 /nfs/dbraw/zinc/11/69/41/1123116941.db2.gz XLADJYAQEXSJSH-ULHQQGCDSA-N 1 3 276.468 3.512 20 0 CHADHO C[C@@H]1CC[N@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)[C@@H](C)C1 ZINC001167996146 1123116944 /nfs/dbraw/zinc/11/69/44/1123116944.db2.gz XLADJYAQEXSJSH-ULHQQGCDSA-N 1 3 276.468 3.512 20 0 CHADHO CCCCCN1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001201737578 1123143214 /nfs/dbraw/zinc/14/32/14/1123143214.db2.gz VQEMYFSOEJKNEJ-MOPGFXCFSA-N 1 3 286.463 3.631 20 0 CHADHO CCCCCN1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001201737578 1123143215 /nfs/dbraw/zinc/14/32/15/1123143215.db2.gz VQEMYFSOEJKNEJ-MOPGFXCFSA-N 1 3 286.463 3.631 20 0 CHADHO CN(C)CC1(C[NH2+]C/C=C\c2ccc(F)cc2)CCCC1 ZINC001201929583 1123157618 /nfs/dbraw/zinc/15/76/18/1123157618.db2.gz OIANMZWCINJMDV-WAYWQWQTSA-N 1 3 290.426 3.551 20 0 CHADHO C[C@H]1CC([NH2+]C2(CF)CC2)C[C@H](C)N1Cc1ccccc1 ZINC001168005183 1123196419 /nfs/dbraw/zinc/19/64/19/1123196419.db2.gz HQAYYVVXTGZVBX-GJZGRUSLSA-N 1 3 290.426 3.520 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCc1ccc(-c2cccs2)cc1 ZINC000665237533 1123238673 /nfs/dbraw/zinc/23/86/73/1123238673.db2.gz CUPFHCGOPZJVPC-CHWSQXEVSA-N 1 3 274.433 3.631 20 0 CHADHO Cc1cccc2c1CCC[C@@H]2NC1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000850573658 1123294946 /nfs/dbraw/zinc/29/49/46/1123294946.db2.gz PCGJIGZQNXHYBK-IYHXRUFHSA-N 1 3 284.447 3.587 20 0 CHADHO Cc1cccc2c1CCC[C@@H]2NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000850573658 1123294948 /nfs/dbraw/zinc/29/49/48/1123294948.db2.gz PCGJIGZQNXHYBK-IYHXRUFHSA-N 1 3 284.447 3.587 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NC2CCC3(CC3(F)F)CC2)c2ccccc21 ZINC000665273777 1123303125 /nfs/dbraw/zinc/30/31/25/1123303125.db2.gz DFBNVXOCHYNSHH-XYJYLCNOSA-N 1 3 292.373 3.689 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@@H]1C[C@H](c2ccccc2)C1(C)C ZINC000665282154 1123313297 /nfs/dbraw/zinc/31/32/97/1123313297.db2.gz RWCZYYCABUGOOS-BRWVUGGUSA-N 1 3 274.452 3.532 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@@H]1CC[C@@H](C)c2ccsc21 ZINC000665282500 1123316699 /nfs/dbraw/zinc/31/66/99/1123316699.db2.gz ZGMIYHLZATYXSK-MRVWCRGKSA-N 1 3 266.454 3.650 20 0 CHADHO C[C@H]1CCCCN1CCC[NH2+]C1CCC(C(F)F)CC1 ZINC000442643950 1123331835 /nfs/dbraw/zinc/33/18/35/1123331835.db2.gz GZEKZPBQPOHGNF-NFOMZHRRSA-N 1 3 288.426 3.664 20 0 CHADHO C[C@@H](C[NH2+]C1CCC(C(F)F)CC1)CN1CCCCC1 ZINC000442716689 1123335996 /nfs/dbraw/zinc/33/59/96/1123335996.db2.gz ONSBWRZZHQVFEN-NFOMZHRRSA-N 1 3 288.426 3.522 20 0 CHADHO CC(C)(CN[C@H]1C[C@H]([NH3+])c2ccccc21)CC(F)(F)F ZINC000665301096 1123350452 /nfs/dbraw/zinc/35/04/52/1123350452.db2.gz OCSBKMGFILUBIP-STQMWFEESA-N 1 3 286.341 3.699 20 0 CHADHO CC(C)C[NH2+]CC1CCN(Cc2ccccc2Cl)CC1 ZINC000053660751 1123526257 /nfs/dbraw/zinc/52/62/57/1123526257.db2.gz OKIGFWJMPPNNIL-UHFFFAOYSA-N 1 3 294.870 3.798 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(C)cc2C)C[C@H]1C ZINC000536659892 1123543083 /nfs/dbraw/zinc/54/30/83/1123543083.db2.gz KOQKRIATTJOKBQ-SJLPKXTDSA-N 1 3 274.452 3.608 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2ccc(C)cc2C)C[C@H]1C ZINC000536659892 1123543084 /nfs/dbraw/zinc/54/30/84/1123543084.db2.gz KOQKRIATTJOKBQ-SJLPKXTDSA-N 1 3 274.452 3.608 20 0 CHADHO C[C@@H]1CCC[C@H](CC[N@@H+]2CCC[C@@H](N(C)C)CC2)C1 ZINC000429531811 1123558028 /nfs/dbraw/zinc/55/80/28/1123558028.db2.gz WRDALCDVBXFXBG-BRWVUGGUSA-N 1 3 266.473 3.619 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2CCC[C@H](C(C)C)C2)C1 ZINC000474628596 1123561886 /nfs/dbraw/zinc/56/18/86/1123561886.db2.gz LNTTWJVJZXVJFU-IXDOHACOSA-N 1 3 266.473 3.523 20 0 CHADHO c1ccc([C@H]2CCCN2CCC[NH+]2CCCCC2)cc1 ZINC000193462161 1123575252 /nfs/dbraw/zinc/57/52/52/1123575252.db2.gz CBNXOWWBZVAVMZ-GOSISDBHSA-N 1 3 272.436 3.700 20 0 CHADHO C([NH2+]C1CCN(C2CCCCC2)CC1)[C@H]1CCCCS1 ZINC000544371083 1123622617 /nfs/dbraw/zinc/62/26/17/1123622617.db2.gz LPYLNECPLHZSPA-QGZVFWFLSA-N 1 3 296.524 3.659 20 0 CHADHO C[NH2+]C[C@H]1CCCN(Cc2sc3ccccc3c2C)C1 ZINC001205009249 1123644875 /nfs/dbraw/zinc/64/48/75/1123644875.db2.gz KPHNQLUZCGJMOE-CQSZACIVSA-N 1 3 288.460 3.641 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](CC(C)C)c2cccs2)C1 ZINC000163279572 1129143890 /nfs/dbraw/zinc/14/38/90/1129143890.db2.gz HXWZUZZBHDYOGB-CABCVRRESA-N 1 3 280.481 3.767 20 0 CHADHO Cc1cc(C)c(CN(C)C2CC[NH+](C(C)C)CC2)c(C)c1 ZINC000261382144 1124004051 /nfs/dbraw/zinc/00/40/51/1124004051.db2.gz GDWIJEOAHCBFPP-UHFFFAOYSA-N 1 3 288.479 3.916 20 0 CHADHO C[C@@H]1CCC[C@H]([NH2+]CCCN2C[C@H](C)C[C@H](C)C2)C1 ZINC000525694077 1124457797 /nfs/dbraw/zinc/45/77/97/1124457797.db2.gz LXOKJVAZKYQPBO-NCOADZHNSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)CCC[NH2+]C[C@@H]1CCN(CCc2ccccc2)C1 ZINC000525870243 1124476893 /nfs/dbraw/zinc/47/68/93/1124476893.db2.gz SELUFZBZVXDIEV-IBGZPJMESA-N 1 3 288.479 3.577 20 0 CHADHO CN(C)[C@H]1CCC[C@H]([NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC000526988883 1124538792 /nfs/dbraw/zinc/53/87/92/1124538792.db2.gz QRDMDAYBGLDZHB-GJZGRUSLSA-N 1 3 282.378 3.587 20 0 CHADHO CC(C)CN1CCC([NH2+]Cc2cccc3ccoc32)CC1 ZINC000449069877 1124643907 /nfs/dbraw/zinc/64/39/07/1124643907.db2.gz AJILSARDMLYRHD-UHFFFAOYSA-N 1 3 286.419 3.643 20 0 CHADHO C[C@H](Cc1coc2ccccc12)N[C@@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000449083020 1124646585 /nfs/dbraw/zinc/64/65/85/1124646585.db2.gz RREOHVGDDBOFFD-ZTFGCOKTSA-N 1 3 298.430 3.580 20 0 CHADHO C[C@H](Cc1coc2ccccc12)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000449083020 1124646588 /nfs/dbraw/zinc/64/65/88/1124646588.db2.gz RREOHVGDDBOFFD-ZTFGCOKTSA-N 1 3 298.430 3.580 20 0 CHADHO CCC[C@@H]([NH2+]C[C@H]1CCN(CCC)C1)C1CCCC1 ZINC000449095469 1124650017 /nfs/dbraw/zinc/65/00/17/1124650017.db2.gz YQICEXRMRKSOFY-NVXWUHKLSA-N 1 3 266.473 3.667 20 0 CHADHO CC1([NH2+]C2CCN(C3CCCCC3)CC2)CC(F)(F)C1 ZINC000873197611 1124750544 /nfs/dbraw/zinc/75/05/44/1124750544.db2.gz JTFRGEPRDFUZPA-UHFFFAOYSA-N 1 3 286.410 3.561 20 0 CHADHO CN(CCCCCC[NH3+])Cc1ccc(C(F)(F)F)s1 ZINC000873231802 1124752472 /nfs/dbraw/zinc/75/24/72/1124752472.db2.gz VUYNCPYRTXFCRT-UHFFFAOYSA-N 1 3 294.386 3.718 20 0 CHADHO CC[C@@H](N[C@H](C)c1cccc(C[NH+](C)C)c1)c1ccncc1 ZINC000820811131 1131302024 /nfs/dbraw/zinc/30/20/24/1131302024.db2.gz LHKOVTROXHGGQJ-DNVCBOLYSA-N 1 3 297.446 3.945 20 0 CHADHO C[C@@H](NCc1ccc(F)cc1)c1cccc(C[NH+](C)C)c1 ZINC000820803431 1131302523 /nfs/dbraw/zinc/30/25/23/1131302523.db2.gz VWPDZNITZDNAEN-CQSZACIVSA-N 1 3 286.394 3.738 20 0 CHADHO C[C@H](NCC1=CCCCC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000450728903 1125093836 /nfs/dbraw/zinc/09/38/36/1125093836.db2.gz QKDNWOSFOFTASX-RDJZCZTQSA-N 1 3 276.468 3.729 20 0 CHADHO C[C@H](NCC1=CCCCC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000450728903 1125093844 /nfs/dbraw/zinc/09/38/44/1125093844.db2.gz QKDNWOSFOFTASX-RDJZCZTQSA-N 1 3 276.468 3.729 20 0 CHADHO C[C@H]([NH2+]CC1=CCCCC1)[C@H]1CCCN(C2CCC2)C1 ZINC000450728903 1125093855 /nfs/dbraw/zinc/09/38/55/1125093855.db2.gz QKDNWOSFOFTASX-RDJZCZTQSA-N 1 3 276.468 3.729 20 0 CHADHO CCN1CC[C@H]([N@H+](C)C/C=C/c2ccccc2)C[C@@H]1C ZINC000531381982 1125213797 /nfs/dbraw/zinc/21/37/97/1125213797.db2.gz QVAVCBJWJMQQIU-FRGBQATDSA-N 1 3 272.436 3.504 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)C/C=C/c2ccccc2)C[C@@H]1C ZINC000531381982 1125213801 /nfs/dbraw/zinc/21/38/01/1125213801.db2.gz QVAVCBJWJMQQIU-FRGBQATDSA-N 1 3 272.436 3.504 20 0 CHADHO Cc1c[nH+]ccc1NC[C@@H](c1ccco1)N1CCCCC1 ZINC000191976945 1125330561 /nfs/dbraw/zinc/33/05/61/1125330561.db2.gz ZSBMZSJNAKEXPK-INIZCTEOSA-N 1 3 285.391 3.622 20 0 CHADHO Cc1ccc([C@H](CNc2cc[nH+]cc2C)N2CCCC2)o1 ZINC000192555345 1125334847 /nfs/dbraw/zinc/33/48/47/1125334847.db2.gz YWIYUVQNFAHZCB-INIZCTEOSA-N 1 3 285.391 3.540 20 0 CHADHO CC(C)[C@@H](NC[C@@H]1CCC[NH2+]C1)c1ccc(Cl)cc1 ZINC000132077607 1125414097 /nfs/dbraw/zinc/41/40/97/1125414097.db2.gz SBPONZIDDBFZRP-CZUORRHYSA-N 1 3 280.843 3.626 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)c1ccc(F)cc1 ZINC000125950267 1125452906 /nfs/dbraw/zinc/45/29/06/1125452906.db2.gz UQCPYZUWSBXLLW-MAUKXSAKSA-N 1 3 292.442 3.987 20 0 CHADHO C[C@H](N[C@@H]1CCCC[C@@H]1C[NH3+])c1cc2ccccc2o1 ZINC000089143044 1129217341 /nfs/dbraw/zinc/21/73/41/1129217341.db2.gz JVMHEHHAKIOWMS-NWANDNLSSA-N 1 3 272.392 3.601 20 0 CHADHO CCC[N@H+](CC[C@H]1CCCN1C)Cc1ccc(F)cc1 ZINC000348070248 1129276809 /nfs/dbraw/zinc/27/68/09/1129276809.db2.gz IUQORSYIYMACHS-QGZVFWFLSA-N 1 3 278.415 3.522 20 0 CHADHO CCC[N@@H+](CC[C@H]1CCCN1C)Cc1ccc(F)cc1 ZINC000348070248 1129276811 /nfs/dbraw/zinc/27/68/11/1129276811.db2.gz IUQORSYIYMACHS-QGZVFWFLSA-N 1 3 278.415 3.522 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2c2cccs2)C1 ZINC000639169617 1129288020 /nfs/dbraw/zinc/28/80/20/1129288020.db2.gz HNBAIEGKSPSBSN-LVQVYYBASA-N 1 3 292.492 3.560 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H](C)CSC(C)(C)C)C1 ZINC000247130016 1129355360 /nfs/dbraw/zinc/35/53/60/1129355360.db2.gz VKPFGLUHCRMCTH-CABCVRRESA-N 1 3 286.529 3.617 20 0 CHADHO CCCC[C@H]1C[C@H]([NH2+]C2CCC(CC)CC2)CCN1 ZINC001246169238 1131371319 /nfs/dbraw/zinc/37/13/19/1131371319.db2.gz BTJYNGUIOYQLFC-SJJHQCBESA-N 1 3 266.473 3.856 20 0 CHADHO COc1ccc2cc([C@H](C)N[C@H]3CCC[NH2+]CC3)ccc2c1 ZINC000643521352 1129444077 /nfs/dbraw/zinc/44/40/77/1129444077.db2.gz AKHAMVZCMHAVNO-KSSFIOAISA-N 1 3 298.430 3.641 20 0 CHADHO C[C@@H]([NH2+]C[C@H](C)N)c1ccc(-c2c(F)cccc2F)cc1 ZINC000643527635 1129444569 /nfs/dbraw/zinc/44/45/69/1129444569.db2.gz PWDLDQSWPWKBDT-NWDGAFQWSA-N 1 3 290.357 3.630 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@@H]2N[C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643547953 1129445163 /nfs/dbraw/zinc/44/51/63/1129445163.db2.gz LDGPQVAVFLKKDH-WMZOPIPTSA-N 1 3 298.474 3.945 20 0 CHADHO FC1CCC(C[NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000647252427 1129561534 /nfs/dbraw/zinc/56/15/34/1129561534.db2.gz DKFJTQANBZWXHB-UHFFFAOYSA-N 1 3 296.474 3.901 20 0 CHADHO C[C@@H](c1ccc(C(C)(C)C)cc1)N1CCC(C)([NH3+])CC1 ZINC000647924716 1129588169 /nfs/dbraw/zinc/58/81/69/1129588169.db2.gz FJRMXEZQZXYLHW-AWEZNQCLSA-N 1 3 274.452 3.858 20 0 CHADHO C(C1CCCCC1)N1CCC([NH2+][C@@H]2CC[C@H]2C2CC2)CC1 ZINC000798005397 1129674549 /nfs/dbraw/zinc/67/45/49/1129674549.db2.gz VBFKGAIWVUZJMU-RBUKOAKNSA-N 1 3 290.495 3.809 20 0 CHADHO CCC[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccs1 ZINC001169096073 1129696962 /nfs/dbraw/zinc/69/69/62/1129696962.db2.gz UJPJZIHJCKCRPY-XQLPTFJDSA-N 1 3 278.465 3.804 20 0 CHADHO CCC[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccs1 ZINC001169096073 1129696963 /nfs/dbraw/zinc/69/69/63/1129696963.db2.gz UJPJZIHJCKCRPY-XQLPTFJDSA-N 1 3 278.465 3.804 20 0 CHADHO CC(C)[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001169100727 1129697135 /nfs/dbraw/zinc/69/71/35/1129697135.db2.gz MAMULAUWASPGRH-XMTFNYHQSA-N 1 3 290.426 3.738 20 0 CHADHO CC(C)[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001169100727 1129697137 /nfs/dbraw/zinc/69/71/37/1129697137.db2.gz MAMULAUWASPGRH-XMTFNYHQSA-N 1 3 290.426 3.738 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](N[C@H](c1ccccc1)C(C)(C)C)C2 ZINC001169091436 1129700443 /nfs/dbraw/zinc/70/04/43/1129700443.db2.gz QZRFTRJSEVQFEP-XMTFNYHQSA-N 1 3 286.463 3.989 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](N[C@H](c1ccccc1)C(C)(C)C)C2 ZINC001169091436 1129700445 /nfs/dbraw/zinc/70/04/45/1129700445.db2.gz QZRFTRJSEVQFEP-XMTFNYHQSA-N 1 3 286.463 3.989 20 0 CHADHO CC[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)N2C)c1ccc(F)c(F)c1 ZINC001169119101 1129700816 /nfs/dbraw/zinc/70/08/16/1129700816.db2.gz QMYCEIDMQXWSRU-UMPJEAMMSA-N 1 3 294.389 3.631 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](N1CCC[C@@H]1c1ccc(F)cc1)C2 ZINC001169127003 1129701378 /nfs/dbraw/zinc/70/13/78/1129701378.db2.gz ZHSIOQAQXRBFQM-VSZNYVQBSA-N 1 3 288.410 3.588 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](N1CCC[C@@H]1c1ccc(F)cc1)C2 ZINC001169127003 1129701380 /nfs/dbraw/zinc/70/13/80/1129701380.db2.gz ZHSIOQAQXRBFQM-VSZNYVQBSA-N 1 3 288.410 3.588 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@H](N1CCC[C@H]1c1ccc(F)cc1)C2 ZINC001169127001 1129701471 /nfs/dbraw/zinc/70/14/71/1129701471.db2.gz ZHSIOQAQXRBFQM-MHORFTMASA-N 1 3 288.410 3.588 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](N1CCC[C@H]1c1ccc(F)cc1)C2 ZINC001169127001 1129701473 /nfs/dbraw/zinc/70/14/73/1129701473.db2.gz ZHSIOQAQXRBFQM-MHORFTMASA-N 1 3 288.410 3.588 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](N1CCC(c3cccs3)CC1)C2 ZINC001169139258 1129702669 /nfs/dbraw/zinc/70/26/69/1129702669.db2.gz ACGAGXYNTHHLDP-ZSHCYNCHSA-N 1 3 290.476 3.553 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](N1CCC(c3cccs3)CC1)C2 ZINC001169139258 1129702670 /nfs/dbraw/zinc/70/26/70/1129702670.db2.gz ACGAGXYNTHHLDP-ZSHCYNCHSA-N 1 3 290.476 3.553 20 0 CHADHO CC[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1C ZINC001169107135 1129703714 /nfs/dbraw/zinc/70/37/14/1129703714.db2.gz DVGFSTOZMMQQAH-KYHPRHEASA-N 1 3 272.436 3.661 20 0 CHADHO CC[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1C ZINC001169107135 1129703716 /nfs/dbraw/zinc/70/37/16/1129703716.db2.gz DVGFSTOZMMQQAH-KYHPRHEASA-N 1 3 272.436 3.661 20 0 CHADHO Cc1ccccc1[C@@H]1C[C@H]1[NH2+][C@H]1C[C@H](N)c2ccccc21 ZINC000650741998 1129721245 /nfs/dbraw/zinc/72/12/45/1129721245.db2.gz PGEZUFZDKFPNNH-OKYOBFRVSA-N 1 3 278.399 3.585 20 0 CHADHO C[C@@H]1CCC[C@H](N2CCC([NH2+]C3(C4CCC4)CC3)CC2)C1 ZINC000652272768 1129761643 /nfs/dbraw/zinc/76/16/43/1129761643.db2.gz VYMQBCZPISNQGN-QAPCUYQASA-N 1 3 290.495 3.952 20 0 CHADHO C[C@H]1CCC[C@@H](N2CCC([NH2+]C3(C4CCC4)CC3)CC2)C1 ZINC000652272767 1129761838 /nfs/dbraw/zinc/76/18/38/1129761838.db2.gz VYMQBCZPISNQGN-MAUKXSAKSA-N 1 3 290.495 3.952 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@@H]2CCCC(C)(C)CC2)C1 ZINC000086906402 1129818800 /nfs/dbraw/zinc/81/88/00/1129818800.db2.gz SJCZIOIATQCFKV-JKSUJKDBSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000381983704 1129853942 /nfs/dbraw/zinc/85/39/42/1129853942.db2.gz NNJBOAXRXVCXEJ-NZSAHSFTSA-N 1 3 286.463 3.677 20 0 CHADHO CC[C@H](C)C[NH2+]C1CCN(CC2CCCCC2)CC1 ZINC000771818767 1129990926 /nfs/dbraw/zinc/99/09/26/1129990926.db2.gz LLBVUTCBJYXZPW-HNNXBMFYSA-N 1 3 266.473 3.667 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C1(C2CCCCC2)CC1 ZINC000902516043 1130019097 /nfs/dbraw/zinc/01/90/97/1130019097.db2.gz ABIFNVYXNVBFMF-AWEZNQCLSA-N 1 3 287.451 3.612 20 0 CHADHO CC(C)(C)[NH2+]Cc1ccc(-c2nccc3c2CCN3)cc1 ZINC001240361929 1130277847 /nfs/dbraw/zinc/27/78/47/1130277847.db2.gz QDXOVUKGXQJTSK-UHFFFAOYSA-N 1 3 281.403 3.605 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]C2CCN(C[C@@H]3CC=CCC3)CC2)C1 ZINC001170124233 1130285599 /nfs/dbraw/zinc/28/55/99/1130285599.db2.gz FXFGWVXYBMXEJQ-NUJGCVRESA-N 1 3 276.468 3.585 20 0 CHADHO c1ccc2cc(CCN[C@H]3CC[N@@H+]4CCC[C@@H]4C3)ccc2c1 ZINC000677237658 1130297618 /nfs/dbraw/zinc/29/76/18/1130297618.db2.gz MNCUIKFSQDPNGH-VQTJNVASSA-N 1 3 294.442 3.599 20 0 CHADHO c1ccc2cc(CCN[C@H]3CC[N@H+]4CCC[C@@H]4C3)ccc2c1 ZINC000677237658 1130297624 /nfs/dbraw/zinc/29/76/24/1130297624.db2.gz MNCUIKFSQDPNGH-VQTJNVASSA-N 1 3 294.442 3.599 20 0 CHADHO Cc1ccc2c(c1)CC[C@@H]2NCC(C)(C)C[NH+]1CCCC1 ZINC000790747828 1130328573 /nfs/dbraw/zinc/32/85/73/1130328573.db2.gz GWCQTCJSGCHWNZ-SFHVURJKSA-N 1 3 286.463 3.694 20 0 CHADHO C[C@H]1CC[C@H]([NH+]2CCC3(CN(Cc4ccccc4)C3)CC2)C1 ZINC001170150306 1130357891 /nfs/dbraw/zinc/35/78/91/1130357891.db2.gz NQHGAMZZHVRXAV-HKUYNNGSSA-N 1 3 298.474 3.773 20 0 CHADHO CCC[NH+]1CCC(N[C@H]2c3ccccc3CC[C@H]2C)CC1 ZINC000678774007 1130454224 /nfs/dbraw/zinc/45/42/24/1130454224.db2.gz DBNUTUCQIWFISD-DNVCBOLYSA-N 1 3 286.463 3.774 20 0 CHADHO CC(C)CC[C@@H](C)N1CCC(C)([NH+]2CCCC2)CC1 ZINC001256374146 1130668533 /nfs/dbraw/zinc/66/85/33/1130668533.db2.gz XKHSNWVLQIZILN-MRXNPFEDSA-N 1 3 266.473 3.761 20 0 CHADHO CC(C)=CCCC1=CC[C@H](C[N@@H+]2CCC3(CNC3)C2)CC1 ZINC001235024488 1130702394 /nfs/dbraw/zinc/70/23/94/1130702394.db2.gz MLLDQPGYXSPAQX-SFHVURJKSA-N 1 3 288.479 3.755 20 0 CHADHO CC(C)=CCCC1=CC[C@H](C[N@H+]2CCC3(CNC3)C2)CC1 ZINC001235024488 1130702398 /nfs/dbraw/zinc/70/23/98/1130702398.db2.gz MLLDQPGYXSPAQX-SFHVURJKSA-N 1 3 288.479 3.755 20 0 CHADHO Cc1ccc([C@@H](C)CCN2CCC[C@@]3(CCC[NH2+]3)CC2)o1 ZINC001235041893 1130705363 /nfs/dbraw/zinc/70/53/63/1130705363.db2.gz UPJVQLRBCLVELX-YJBOKZPZSA-N 1 3 290.451 3.690 20 0 CHADHO CC(C)(C)c1cccc(CN2CCCC23CC[NH2+]CC3)c1 ZINC001235145225 1130714981 /nfs/dbraw/zinc/71/49/81/1130714981.db2.gz QXTRQZKHOJJMRX-UHFFFAOYSA-N 1 3 286.463 3.702 20 0 CHADHO CC(C)(C)c1cccc(C[N@@H+]2CCCC23CCNCC3)c1 ZINC001235145225 1130714984 /nfs/dbraw/zinc/71/49/84/1130714984.db2.gz QXTRQZKHOJJMRX-UHFFFAOYSA-N 1 3 286.463 3.702 20 0 CHADHO CC(C)(C)c1cccc(C[N@H+]2CCCC23CCNCC3)c1 ZINC001235145225 1130714987 /nfs/dbraw/zinc/71/49/87/1130714987.db2.gz QXTRQZKHOJJMRX-UHFFFAOYSA-N 1 3 286.463 3.702 20 0 CHADHO CCCC[C@@H](CC)C[N@@H+]1CCCC[C@@]12CCCNC2 ZINC001235176037 1130719154 /nfs/dbraw/zinc/71/91/54/1130719154.db2.gz YXBANSHTHHZJJA-SJORKVTESA-N 1 3 266.473 3.811 20 0 CHADHO CCCC[C@@H](CC)C[N@H+]1CCCC[C@@]12CCCNC2 ZINC001235176037 1130719160 /nfs/dbraw/zinc/71/91/60/1130719160.db2.gz YXBANSHTHHZJJA-SJORKVTESA-N 1 3 266.473 3.811 20 0 CHADHO CCCC[C@@H](CC)CN1CCCC[C@@]12CCC[NH2+]C2 ZINC001235176037 1130719165 /nfs/dbraw/zinc/71/91/65/1130719165.db2.gz YXBANSHTHHZJJA-SJORKVTESA-N 1 3 266.473 3.811 20 0 CHADHO CCCC[C@@H](CC)C[N@@H+]1CCCC[C@]12CCCNC2 ZINC001235176030 1130719574 /nfs/dbraw/zinc/71/95/74/1130719574.db2.gz YXBANSHTHHZJJA-IAGOWNOFSA-N 1 3 266.473 3.811 20 0 CHADHO CCCC[C@@H](CC)C[N@H+]1CCCC[C@]12CCCNC2 ZINC001235176030 1130719579 /nfs/dbraw/zinc/71/95/79/1130719579.db2.gz YXBANSHTHHZJJA-IAGOWNOFSA-N 1 3 266.473 3.811 20 0 CHADHO CCCC[C@@H](CC)CN1CCCC[C@]12CCC[NH2+]C2 ZINC001235176030 1130719582 /nfs/dbraw/zinc/71/95/82/1130719582.db2.gz YXBANSHTHHZJJA-IAGOWNOFSA-N 1 3 266.473 3.811 20 0 CHADHO Cc1c2ccccc2sc1C[N@@H+]1C[C@H]2CCC[C@@]2(N)C1 ZINC001235239281 1130725961 /nfs/dbraw/zinc/72/59/61/1130725961.db2.gz GOZCMSNLIGMPGC-CXAGYDPISA-N 1 3 286.444 3.523 20 0 CHADHO Cc1c2ccccc2sc1C[N@H+]1C[C@H]2CCC[C@@]2(N)C1 ZINC001235239281 1130725967 /nfs/dbraw/zinc/72/59/67/1130725967.db2.gz GOZCMSNLIGMPGC-CXAGYDPISA-N 1 3 286.444 3.523 20 0 CHADHO C[C@H](CN1CC[C@@H]2[NH2+]CC[C@@H]2C1)c1cccc2ccccc21 ZINC001235257009 1130729654 /nfs/dbraw/zinc/72/96/54/1130729654.db2.gz WMYAUSKRLFFIST-MDYRTPRTSA-N 1 3 294.442 3.627 20 0 CHADHO CCCCCCN1CC[C@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001235380954 1130737836 /nfs/dbraw/zinc/73/78/36/1130737836.db2.gz XXSANXIAKTVOAP-MOPGFXCFSA-N 1 3 286.463 3.646 20 0 CHADHO Clc1cc(CN2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)cs1 ZINC001235426751 1130742605 /nfs/dbraw/zinc/74/26/05/1130742605.db2.gz LCYSCFOWQQHUJU-ZIAGYGMSSA-N 1 3 298.883 3.613 20 0 CHADHO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc3c(c2)CNC3)cc1 ZINC001235677280 1130765819 /nfs/dbraw/zinc/76/58/19/1130765819.db2.gz GECGZIBYODBFLU-FQEVSTJZSA-N 1 3 292.426 3.935 20 0 CHADHO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ccc3c(c2)CNC3)cc1 ZINC001235677280 1130765824 /nfs/dbraw/zinc/76/58/24/1130765824.db2.gz GECGZIBYODBFLU-FQEVSTJZSA-N 1 3 292.426 3.935 20 0 CHADHO Cc1ccc([C@H]2CCCN2CC[C@@H]2CCCC[NH2+]2)cc1 ZINC001235679053 1130768347 /nfs/dbraw/zinc/76/83/47/1130768347.db2.gz OFJJMJOVAMCLLW-ZWKOTPCHSA-N 1 3 272.436 3.664 20 0 CHADHO Cc1cc(C)c(Cl)c(CN(C)CCC2CC[NH2+]CC2)c1 ZINC001235717910 1130771265 /nfs/dbraw/zinc/77/12/65/1130771265.db2.gz PGZHKHPTBOTJQZ-UHFFFAOYSA-N 1 3 294.870 3.778 20 0 CHADHO [NH3+]Cc1cccc(CN2CCC[C@@H]2c2ccccc2F)c1 ZINC001235718048 1130771427 /nfs/dbraw/zinc/77/14/27/1130771427.db2.gz BAGVGZJJUQVQQK-GOSISDBHSA-N 1 3 284.378 3.622 20 0 CHADHO [NH3+]C[C@@H]1CCN(Cc2ccc3sc4ccccc4c3c2)C1 ZINC001235751388 1130775881 /nfs/dbraw/zinc/77/58/81/1130775881.db2.gz XRYQGTJITLUEPS-AWEZNQCLSA-N 1 3 296.439 3.835 20 0 CHADHO [NH3+]C1C[C@H]2CC[C@@H](C1)N2Cc1cccc(-c2ccccc2)c1 ZINC001235777618 1130778483 /nfs/dbraw/zinc/77/84/83/1130778483.db2.gz NWNBNDLBSDMXFG-IHWFROFDSA-N 1 3 292.426 3.808 20 0 CHADHO C[C@@H]1CC[C@H](N)C[N@@H+]1Cc1cccc2c3ccccc3oc21 ZINC001235906827 1130802780 /nfs/dbraw/zinc/80/27/80/1130802780.db2.gz OVTLRNBVSYZYEZ-HIFRSBDPSA-N 1 3 294.398 3.898 20 0 CHADHO C[C@@H]1CC[C@H](N)C[N@H+]1Cc1cccc2c3ccccc3oc21 ZINC001235906827 1130802788 /nfs/dbraw/zinc/80/27/88/1130802788.db2.gz OVTLRNBVSYZYEZ-HIFRSBDPSA-N 1 3 294.398 3.898 20 0 CHADHO Clc1ccc([C@H]2CCN(CC[C@@H]3CCCC[NH2+]3)C2)cc1 ZINC001235946723 1130812553 /nfs/dbraw/zinc/81/25/53/1130812553.db2.gz AGFBJVVVIJPTNZ-RDJZCZTQSA-N 1 3 292.854 3.662 20 0 CHADHO C[C@@H](CN(C)C[C@@H]1CCC[NH2+]C1)c1cccc2ccccc21 ZINC001235951999 1130815618 /nfs/dbraw/zinc/81/56/18/1130815618.db2.gz WTCGRUOPISKWTD-DLBZAZTESA-N 1 3 296.458 3.875 20 0 CHADHO C[C@@H](C[N@H+](C)C[C@@H]1CCCNC1)c1cccc2ccccc21 ZINC001235951999 1130815622 /nfs/dbraw/zinc/81/56/22/1130815622.db2.gz WTCGRUOPISKWTD-DLBZAZTESA-N 1 3 296.458 3.875 20 0 CHADHO C[C@@H](C[N@@H+](C)C[C@@H]1CCCNC1)c1cccc2ccccc21 ZINC001235951999 1130815625 /nfs/dbraw/zinc/81/56/25/1130815625.db2.gz WTCGRUOPISKWTD-DLBZAZTESA-N 1 3 296.458 3.875 20 0 CHADHO CSc1ccccc1[C@@H]1CCCN1C[C@H]1CCC[NH2+]C1 ZINC001236109673 1130866524 /nfs/dbraw/zinc/86/65/24/1130866524.db2.gz VNVLVDJVOLGJEG-HOCLYGCPSA-N 1 3 290.476 3.545 20 0 CHADHO c1[nH]c2ccccc2c1[C@@H]1CCCN1CC[C@@H]1CCCC[NH2+]1 ZINC001236191022 1130884037 /nfs/dbraw/zinc/88/40/37/1130884037.db2.gz JBZAAJUQJQQYRF-KXBFYZLASA-N 1 3 297.446 3.837 20 0 CHADHO C[N@H+](Cc1cccc2[nH]cc(Cl)c21)[C@@H]1CCCC[C@H]1N ZINC001236215742 1130889072 /nfs/dbraw/zinc/88/90/72/1130889072.db2.gz XRNVXUSRSKHQMI-UKRRQHHQSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@@H+](Cc1cccc2[nH]cc(Cl)c21)[C@@H]1CCCC[C@H]1N ZINC001236215742 1130889078 /nfs/dbraw/zinc/88/90/78/1130889078.db2.gz XRNVXUSRSKHQMI-UKRRQHHQSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@H+](Cc1cccc2[nH]cc(Cl)c21)[C@H]1CCCC[C@@H]1N ZINC001236215743 1130889405 /nfs/dbraw/zinc/88/94/05/1130889405.db2.gz XRNVXUSRSKHQMI-ZFWWWQNUSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@@H+](Cc1cccc2[nH]cc(Cl)c21)[C@H]1CCCC[C@@H]1N ZINC001236215743 1130889410 /nfs/dbraw/zinc/88/94/10/1130889410.db2.gz XRNVXUSRSKHQMI-ZFWWWQNUSA-N 1 3 291.826 3.523 20 0 CHADHO Cc1c(N)cc[nH+]c1-c1ccc(CN2CCCCC2)c(F)c1 ZINC001236230885 1130898946 /nfs/dbraw/zinc/89/89/46/1130898946.db2.gz FUDGYQJLBNPLIU-UHFFFAOYSA-N 1 3 299.393 3.764 20 0 CHADHO CC(C)CCC[N@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236372643 1130922093 /nfs/dbraw/zinc/92/20/93/1130922093.db2.gz RNVIYIOUDWZUNL-MRXNPFEDSA-N 1 3 266.473 3.667 20 0 CHADHO CC(C)CCC[N@@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236372643 1130922098 /nfs/dbraw/zinc/92/20/98/1130922098.db2.gz RNVIYIOUDWZUNL-MRXNPFEDSA-N 1 3 266.473 3.667 20 0 CHADHO Cc1sccc1CN(C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236376477 1130923737 /nfs/dbraw/zinc/92/37/37/1130923737.db2.gz SMDXKMNKPUIUQC-HNNXBMFYSA-N 1 3 292.492 3.801 20 0 CHADHO CCN(Cc1c(C)c(C)c(C)c(C)c1C)C[C@H]1CC[NH2+]C1 ZINC001236407413 1130931570 /nfs/dbraw/zinc/93/15/70/1130931570.db2.gz FCTKJFPTCVGHPA-SFHVURJKSA-N 1 3 288.479 3.660 20 0 CHADHO CCC(C)(C)c1ccc(CN2CC[C@@](C)(C[NH3+])C2)cc1 ZINC001236603614 1130982472 /nfs/dbraw/zinc/98/24/72/1130982472.db2.gz AZGKFKIIUASKLE-SFHVURJKSA-N 1 3 274.452 3.545 20 0 CHADHO Cc1c(Cl)cccc1CN(C1CCC1)C1CC[NH2+]CC1 ZINC001236638215 1130986926 /nfs/dbraw/zinc/98/69/26/1130986926.db2.gz WQYRSFFMCNHBMR-UHFFFAOYSA-N 1 3 292.854 3.755 20 0 CHADHO Cc1c(Cl)cccc1C[N@H+](C1CCC1)C1CCNCC1 ZINC001236638215 1130986932 /nfs/dbraw/zinc/98/69/32/1130986932.db2.gz WQYRSFFMCNHBMR-UHFFFAOYSA-N 1 3 292.854 3.755 20 0 CHADHO Cc1c(Cl)cccc1C[N@@H+](C1CCC1)C1CCNCC1 ZINC001236638215 1130986935 /nfs/dbraw/zinc/98/69/35/1130986935.db2.gz WQYRSFFMCNHBMR-UHFFFAOYSA-N 1 3 292.854 3.755 20 0 CHADHO Cc1cc(F)ccc1[C@H](C)[NH2+]CCCN1CCCCC1 ZINC000815554464 1130998678 /nfs/dbraw/zinc/99/86/78/1130998678.db2.gz ACIWWIZTWABLOO-HNNXBMFYSA-N 1 3 278.415 3.661 20 0 CHADHO Cc1cc(F)ccc1[C@H](C)[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000815576592 1131000978 /nfs/dbraw/zinc/00/09/78/1131000978.db2.gz UHMCHBRDCLGUTE-JKSUJKDBSA-N 1 3 292.442 3.905 20 0 CHADHO CCCN(Cc1ccc2ccsc2c1)C[C@H]1CC[NH2+]C1 ZINC001236842341 1131022185 /nfs/dbraw/zinc/02/21/85/1131022185.db2.gz FHGFNUCHDNNFPJ-HNNXBMFYSA-N 1 3 288.460 3.723 20 0 CHADHO CC(C)=CCCC1=CC[C@H](CN2C[C@@H]([NH3+])C[C@H]2C)CC1 ZINC001237203386 1131069854 /nfs/dbraw/zinc/06/98/54/1131069854.db2.gz FLYKBZCLOQLOFM-NJAFHUGGSA-N 1 3 276.468 3.881 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+]3CC[C@H](C)C3)cc21 ZINC001237880959 1131147098 /nfs/dbraw/zinc/14/70/98/1131147098.db2.gz LBSSCCIIKSTMCR-AWEZNQCLSA-N 1 3 270.420 3.530 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+]3CC[C@H](C)C3)cc21 ZINC001237880959 1131147099 /nfs/dbraw/zinc/14/70/99/1131147099.db2.gz LBSSCCIIKSTMCR-AWEZNQCLSA-N 1 3 270.420 3.530 20 0 CHADHO CC(C)c1cc(C[N@H+](C)CCCN(C)C)ccc1Cl ZINC001238220526 1131183536 /nfs/dbraw/zinc/18/35/36/1131183536.db2.gz VRBUOPVIRHRJGT-UHFFFAOYSA-N 1 3 282.859 3.847 20 0 CHADHO CC(C)c1cc(C[N@@H+](C)CCCN(C)C)ccc1Cl ZINC001238220526 1131183538 /nfs/dbraw/zinc/18/35/38/1131183538.db2.gz VRBUOPVIRHRJGT-UHFFFAOYSA-N 1 3 282.859 3.847 20 0 CHADHO C[C@@H](NCc1ccc(CC[NH3+])cc1)c1ccc(Cl)s1 ZINC000817946609 1131189447 /nfs/dbraw/zinc/18/94/47/1131189447.db2.gz BBEAOVYXFHEVGS-LLVKDONJSA-N 1 3 294.851 3.754 20 0 CHADHO CCN1CCC[C@@H](C[NH2+][C@H](C)c2nccc3ccccc32)C1 ZINC001117671527 1131191285 /nfs/dbraw/zinc/19/12/85/1131191285.db2.gz KASHBMGUUJBNRT-CVEARBPZSA-N 1 3 297.446 3.617 20 0 CHADHO CC[C@@H](NCC[C@@H](C)[NH2+]C)c1cccc2ccccc21 ZINC001118122012 1131211457 /nfs/dbraw/zinc/21/14/57/1131211457.db2.gz MSIXNNQEYLZDOZ-RDTXWAMCSA-N 1 3 270.420 3.879 20 0 CHADHO CC[C@H]1C[C@@H](N[C@@H](c2ccccc2)C(C)C)CC[NH2+]1 ZINC001246239560 1131425015 /nfs/dbraw/zinc/42/50/15/1131425015.db2.gz OERRDVFUTAKZNF-YESZJQIVSA-N 1 3 260.425 3.504 20 0 CHADHO C[C@H](Cc1ccc(Cl)cc1Cl)[NH2+]C(C)(C)CCN ZINC001246358036 1131487912 /nfs/dbraw/zinc/48/79/12/1131487912.db2.gz CBKGDRHPNHXLBC-SNVBAGLBSA-N 1 3 289.250 3.641 20 0 CHADHO CCCCCC1CCC(NCC[NH2+]C(C)C)CC1 ZINC001246451627 1131503629 /nfs/dbraw/zinc/50/36/29/1131503629.db2.gz HXCUZWBFHFUKHL-UHFFFAOYSA-N 1 3 254.462 3.713 20 0 CHADHO CCCC[C@H](CC(C)C)NC[C@]1(CC)CCC[NH2+]1 ZINC001246455169 1131504613 /nfs/dbraw/zinc/50/46/13/1131504613.db2.gz HIUAGMWKUOZSFB-CVEARBPZSA-N 1 3 254.462 3.713 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+]CCCCC2CCCCC2)C[C@H](C)N1 ZINC001246480981 1131522850 /nfs/dbraw/zinc/52/28/50/1131522850.db2.gz ZWAJCQABJJSEIZ-SCAQPMJSSA-N 1 3 266.473 3.856 20 0 CHADHO CCCCCC1CCC([NH2+][C@@H](CC)C2CNC2)CC1 ZINC001246517922 1131544908 /nfs/dbraw/zinc/54/49/08/1131544908.db2.gz NPIUMYPTTSBYQH-PREGVCBESA-N 1 3 266.473 3.713 20 0 CHADHO C[C@@H]1[C@@H](CN)CCC[N@@H+]1C1CCC2(CCCCC2)CC1 ZINC001246559394 1131621462 /nfs/dbraw/zinc/62/14/62/1131621462.db2.gz AOKDKVYMZOYFOJ-HZPDHXFCSA-N 1 3 278.484 3.939 20 0 CHADHO C[C@@H]1[C@@H](CN)CCC[N@H+]1C1CCC2(CCCCC2)CC1 ZINC001246559394 1131621465 /nfs/dbraw/zinc/62/14/65/1131621465.db2.gz AOKDKVYMZOYFOJ-HZPDHXFCSA-N 1 3 278.484 3.939 20 0 CHADHO C[C@H]1[C@@H](CN)CCC[N@@H+]1C1CCC2(CCCCC2)CC1 ZINC001246559395 1131621491 /nfs/dbraw/zinc/62/14/91/1131621491.db2.gz AOKDKVYMZOYFOJ-JKSUJKDBSA-N 1 3 278.484 3.939 20 0 CHADHO C[C@H]1[C@@H](CN)CCC[N@H+]1C1CCC2(CCCCC2)CC1 ZINC001246559395 1131621494 /nfs/dbraw/zinc/62/14/94/1131621494.db2.gz AOKDKVYMZOYFOJ-JKSUJKDBSA-N 1 3 278.484 3.939 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC[C@]2(C)C[C@@]2(F)Cl)CC1 ZINC000846031390 1131679957 /nfs/dbraw/zinc/67/99/57/1131679957.db2.gz IHESFVRNRRFLJJ-CABCVRRESA-N 1 3 290.854 3.544 20 0 CHADHO CC(C)[N@H+]([C@@H]1CCCC(C)(C)C1)[C@H]1CCCNCC1 ZINC001246589776 1131705037 /nfs/dbraw/zinc/70/50/37/1131705037.db2.gz FTOABALYSLVZJQ-JKSUJKDBSA-N 1 3 266.473 3.808 20 0 CHADHO CC(C)[N@@H+]([C@@H]1CCCC(C)(C)C1)[C@H]1CCCNCC1 ZINC001246589776 1131705041 /nfs/dbraw/zinc/70/50/41/1131705041.db2.gz FTOABALYSLVZJQ-JKSUJKDBSA-N 1 3 266.473 3.808 20 0 CHADHO CCCCC[C@@H](C)[N@H+](C(C)C)[C@H]1CCCNCC1 ZINC001246592719 1131707022 /nfs/dbraw/zinc/70/70/22/1131707022.db2.gz LHNYFHCDSBNLRR-CVEARBPZSA-N 1 3 254.462 3.808 20 0 CHADHO CCCCC[C@@H](C)[N@@H+](C(C)C)[C@H]1CCCNCC1 ZINC001246592719 1131707023 /nfs/dbraw/zinc/70/70/23/1131707023.db2.gz LHNYFHCDSBNLRR-CVEARBPZSA-N 1 3 254.462 3.808 20 0 CHADHO CC(C)CC[C@@H](C)[N@H+](C(C)C)[C@@H]1CCCNCC1 ZINC001246595908 1131710229 /nfs/dbraw/zinc/71/02/29/1131710229.db2.gz UFEHEBORQHGDKW-HZPDHXFCSA-N 1 3 254.462 3.664 20 0 CHADHO CC(C)CC[C@@H](C)[N@@H+](C(C)C)[C@@H]1CCCNCC1 ZINC001246595908 1131710244 /nfs/dbraw/zinc/71/02/44/1131710244.db2.gz UFEHEBORQHGDKW-HZPDHXFCSA-N 1 3 254.462 3.664 20 0 CHADHO CNCC[C@@H](C)[N@H+](C)C1CCC(C(C)(C)C)CC1 ZINC001246852744 1131788561 /nfs/dbraw/zinc/78/85/61/1131788561.db2.gz GBVJUHBTTYIKOY-WLYUNCDWSA-N 1 3 254.462 3.521 20 0 CHADHO CNCC[C@@H](C)[N@@H+](C)C1CCC(C(C)(C)C)CC1 ZINC001246852744 1131788566 /nfs/dbraw/zinc/78/85/66/1131788566.db2.gz GBVJUHBTTYIKOY-WLYUNCDWSA-N 1 3 254.462 3.521 20 0 CHADHO C[N@H+](CC1CCCCC1)[C@@H]1CCN[C@@H](C(C)(C)C)C1 ZINC001246847278 1131789666 /nfs/dbraw/zinc/78/96/66/1131789666.db2.gz RTQHYWRZLVJFLT-HZPDHXFCSA-N 1 3 266.473 3.665 20 0 CHADHO C[N@@H+](CC1CCCCC1)[C@@H]1CCN[C@@H](C(C)(C)C)C1 ZINC001246847278 1131789674 /nfs/dbraw/zinc/78/96/74/1131789674.db2.gz RTQHYWRZLVJFLT-HZPDHXFCSA-N 1 3 266.473 3.665 20 0 CHADHO Cc1nc([C@H](C)NC2CCC(C)([NH+](C)C)CC2)c(C)s1 ZINC000715581401 1131985732 /nfs/dbraw/zinc/98/57/32/1131985732.db2.gz SBDDYCUKGQFGHE-WJFWJRBTSA-N 1 3 295.496 3.673 20 0 CHADHO CC[C@@H]([NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)C1CC1 ZINC000716727474 1132030425 /nfs/dbraw/zinc/03/04/25/1132030425.db2.gz LGTSGQBTJDKTNI-OJAHFUOMSA-N 1 3 298.474 3.818 20 0 CHADHO CC(C)=CCN[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716717197 1132031007 /nfs/dbraw/zinc/03/10/07/1132031007.db2.gz IWANFAWGMGKPRJ-OTWHNJEPSA-N 1 3 284.447 3.595 20 0 CHADHO CC(C)=CCN[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716717197 1132031013 /nfs/dbraw/zinc/03/10/13/1132031013.db2.gz IWANFAWGMGKPRJ-OTWHNJEPSA-N 1 3 284.447 3.595 20 0 CHADHO CC(C)=CC[NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000716717197 1132031020 /nfs/dbraw/zinc/03/10/20/1132031020.db2.gz IWANFAWGMGKPRJ-OTWHNJEPSA-N 1 3 284.447 3.595 20 0 CHADHO CN1C(C)(C)CC([N@@H+]2CCCC[C@](C)(F)C2)CC1(C)C ZINC001171631499 1132060184 /nfs/dbraw/zinc/06/01/84/1132060184.db2.gz JURSCPIIJNQMFB-KRWDZBQOSA-N 1 3 284.463 3.852 20 0 CHADHO CN1C(C)(C)CC([N@H+]2CCCC[C@](C)(F)C2)CC1(C)C ZINC001171631499 1132060190 /nfs/dbraw/zinc/06/01/90/1132060190.db2.gz JURSCPIIJNQMFB-KRWDZBQOSA-N 1 3 284.463 3.852 20 0 CHADHO C[NH+]1C(C)(C)CC(N2CCCC[C@](C)(F)C2)CC1(C)C ZINC001171631499 1132060198 /nfs/dbraw/zinc/06/01/98/1132060198.db2.gz JURSCPIIJNQMFB-KRWDZBQOSA-N 1 3 284.463 3.852 20 0 CHADHO CN1C(C)(C)CC([NH2+]CCC2CCCC2)CC1(C)C ZINC001171619820 1132065636 /nfs/dbraw/zinc/06/56/36/1132065636.db2.gz RKOOEGQGUUPGRX-UHFFFAOYSA-N 1 3 266.473 3.808 20 0 CHADHO CN1C(C)(C)CC([NH2+]CC2(C)CCCC2)CC1(C)C ZINC001171614389 1132065798 /nfs/dbraw/zinc/06/57/98/1132065798.db2.gz YVLVFGGKLHGRFG-UHFFFAOYSA-N 1 3 266.473 3.808 20 0 CHADHO C[C@H]1CCCC[C@H]1[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001171617529 1132065817 /nfs/dbraw/zinc/06/58/17/1132065817.db2.gz MXIHFMCLJKSYAT-DZGCQCFKSA-N 1 3 266.473 3.806 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@H]2CC23CCCCC3)CC1(C)C ZINC001171626298 1132067342 /nfs/dbraw/zinc/06/73/42/1132067342.db2.gz XBDGUVVKCQWBLV-HNNXBMFYSA-N 1 3 278.484 3.950 20 0 CHADHO CCN(CC)CCC[NH2+][C@H](C)CCc1ccc(C)cc1 ZINC001171656105 1132069605 /nfs/dbraw/zinc/06/96/05/1132069605.db2.gz UCVUWLYJFJZSCK-QGZVFWFLSA-N 1 3 276.468 3.638 20 0 CHADHO Cc1ccc(CC[C@H](C)[NH2+][C@H]2CCC[C@@H](N(C)C)C2)cc1 ZINC001171664335 1132072948 /nfs/dbraw/zinc/07/29/48/1132072948.db2.gz XWIQTEFHLUFHLT-YTQUADARSA-N 1 3 288.479 3.779 20 0 CHADHO CN1C(C)(C)CC([N@H+](C)CC(C)(C)C)CC1(C)C ZINC001171637463 1132082642 /nfs/dbraw/zinc/08/26/42/1132082642.db2.gz OKAHFUPDFAMREZ-UHFFFAOYSA-N 1 3 254.462 3.616 20 0 CHADHO CN1C(C)(C)CC([N@@H+](C)CC(C)(C)C)CC1(C)C ZINC001171637463 1132082649 /nfs/dbraw/zinc/08/26/49/1132082649.db2.gz OKAHFUPDFAMREZ-UHFFFAOYSA-N 1 3 254.462 3.616 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cc(F)cc(Cl)c1)C2 ZINC001172098837 1132123354 /nfs/dbraw/zinc/12/33/54/1132123354.db2.gz GTGQJFJCDOONCG-MUJYYYPQSA-N 1 3 296.817 3.584 20 0 CHADHO CN(Cc1ccc(Cl)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172125926 1132126166 /nfs/dbraw/zinc/12/61/66/1132126166.db2.gz RVWUDDLTHQFYPW-BJWYYQGGSA-N 1 3 292.854 3.787 20 0 CHADHO CN(Cc1ccc(Cl)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172125926 1132126167 /nfs/dbraw/zinc/12/61/67/1132126167.db2.gz RVWUDDLTHQFYPW-BJWYYQGGSA-N 1 3 292.854 3.787 20 0 CHADHO CCc1ccc(CN(C)[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172129424 1132128311 /nfs/dbraw/zinc/12/83/11/1132128311.db2.gz ZNMDZPAXNSUBSC-BWTSREIZSA-N 1 3 286.463 3.696 20 0 CHADHO CCc1ccc(CN(C)[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172129424 1132128313 /nfs/dbraw/zinc/12/83/13/1132128313.db2.gz ZNMDZPAXNSUBSC-BWTSREIZSA-N 1 3 286.463 3.696 20 0 CHADHO CCCc1ccc(CN[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172106254 1132129273 /nfs/dbraw/zinc/12/92/73/1132129273.db2.gz OEKRFSXHSTZHPD-REPLKXPHSA-N 1 3 286.463 3.744 20 0 CHADHO CCCc1ccc(CN[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172106254 1132129277 /nfs/dbraw/zinc/12/92/77/1132129277.db2.gz OEKRFSXHSTZHPD-REPLKXPHSA-N 1 3 286.463 3.744 20 0 CHADHO CCC[C@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccncc1 ZINC001172113600 1132133237 /nfs/dbraw/zinc/13/32/37/1132133237.db2.gz DSRNFHWLIDSUEK-FJIDUMEYSA-N 1 3 287.451 3.528 20 0 CHADHO CCC[C@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccncc1 ZINC001172113600 1132133240 /nfs/dbraw/zinc/13/32/40/1132133240.db2.gz DSRNFHWLIDSUEK-FJIDUMEYSA-N 1 3 287.451 3.528 20 0 CHADHO CC[C@@H](C)OCC[C@H](C)[N@H+](CCCN)C1CCCCC1 ZINC001172315214 1132156548 /nfs/dbraw/zinc/15/65/48/1132156548.db2.gz GFSZWDPFJGCECY-JKSUJKDBSA-N 1 3 284.488 3.564 20 0 CHADHO CC[C@@H](C)OCC[C@H](C)[N@@H+](CCCN)C1CCCCC1 ZINC001172315214 1132156551 /nfs/dbraw/zinc/15/65/51/1132156551.db2.gz GFSZWDPFJGCECY-JKSUJKDBSA-N 1 3 284.488 3.564 20 0 CHADHO CC[NH+](CC)C1CCN([C@@H]2CC[C@H](C)[C@@H](C)C2)CC1 ZINC001172374352 1132168132 /nfs/dbraw/zinc/16/81/32/1132168132.db2.gz QATCPFBCUMKHSI-YQQAZPJKSA-N 1 3 266.473 3.617 20 0 CHADHO CCN(CC)C1CC[NH+]([C@@H]2CC[C@H](C)[C@@H](C)C2)CC1 ZINC001172374352 1132168133 /nfs/dbraw/zinc/16/81/33/1132168133.db2.gz QATCPFBCUMKHSI-YQQAZPJKSA-N 1 3 266.473 3.617 20 0 CHADHO CC[C@H](CC(C)C)N1CCC([NH+](CC)CC)CC1 ZINC001172408490 1132198205 /nfs/dbraw/zinc/19/82/05/1132198205.db2.gz VAQRWVGJOQPVOM-OAHLLOKOSA-N 1 3 254.462 3.617 20 0 CHADHO CC[C@H](CC(C)C)[NH+]1CCC(N(CC)CC)CC1 ZINC001172408490 1132198209 /nfs/dbraw/zinc/19/82/09/1132198209.db2.gz VAQRWVGJOQPVOM-OAHLLOKOSA-N 1 3 254.462 3.617 20 0 CHADHO CC[C@@H](CC(C)C)[NH2+]C1CCN(C2CCCC2)CC1 ZINC001172390950 1132215940 /nfs/dbraw/zinc/21/59/40/1132215940.db2.gz BBLMDIHHHBBAJU-HNNXBMFYSA-N 1 3 266.473 3.808 20 0 CHADHO CCCN1C[C@@H]2C[N@H+]([C@H]3CC[C@@H](c4ccccc4)C3)C[C@@H]2C1 ZINC001172570835 1132272160 /nfs/dbraw/zinc/27/21/60/1132272160.db2.gz XTHOEDAACKOKHX-ZRNYENFQSA-N 1 3 298.474 3.596 20 0 CHADHO CCCN1C[C@@H]2C[N@@H+]([C@H]3CC[C@@H](c4ccccc4)C3)C[C@@H]2C1 ZINC001172570835 1132272163 /nfs/dbraw/zinc/27/21/63/1132272163.db2.gz XTHOEDAACKOKHX-ZRNYENFQSA-N 1 3 298.474 3.596 20 0 CHADHO CN1CCC[C@H]1CC[NH2+]C1CCC2(CCCCC2)CC1 ZINC001173116047 1132395285 /nfs/dbraw/zinc/39/52/85/1132395285.db2.gz NRPZGODSKKKTGE-KRWDZBQOSA-N 1 3 278.484 3.953 20 0 CHADHO C[C@@H](CC(c1ccccc1)c1ccccc1)NC1(C[NH3+])CC1 ZINC001173213266 1132416432 /nfs/dbraw/zinc/41/64/32/1132416432.db2.gz DYCWGUVOGMKUAH-INIZCTEOSA-N 1 3 294.442 3.678 20 0 CHADHO [NH3+]C1C[C@H]2CCC[C@@H](C1)N2Cc1ccc2ccccc2c1 ZINC000843054151 1132494570 /nfs/dbraw/zinc/49/45/70/1132494570.db2.gz FTMBIJRJYKWARH-YQQQUEKLSA-N 1 3 280.415 3.684 20 0 CHADHO Cc1cc2cc(NC[C@H]3CCC[NH2+]C[C@H]3C)ccc2cn1 ZINC001162472912 1133081043 /nfs/dbraw/zinc/08/10/43/1133081043.db2.gz ZQCBDYCTAAMBEL-UKRRQHHQSA-N 1 3 283.419 3.591 20 0 CHADHO C[C@H](Cc1ccc(C(C)(C)C)cc1)C[N@@H+]1CCC[C@H](N)C1 ZINC001204877504 1133495341 /nfs/dbraw/zinc/49/53/41/1133495341.db2.gz KYAREGYWBFMHIB-QAPCUYQASA-N 1 3 288.479 3.586 20 0 CHADHO C[C@H](Cc1ccc(C(C)(C)C)cc1)C[N@H+]1CCC[C@H](N)C1 ZINC001204877504 1133495345 /nfs/dbraw/zinc/49/53/45/1133495345.db2.gz KYAREGYWBFMHIB-QAPCUYQASA-N 1 3 288.479 3.586 20 0 CHADHO [NH3+][C@H]1CCCN(Cc2cccc(-c3ccsc3)c2)CC1 ZINC001205110468 1133530708 /nfs/dbraw/zinc/53/07/08/1133530708.db2.gz SUHYMYYOBIDEBF-KRWDZBQOSA-N 1 3 286.444 3.728 20 0 CHADHO Cc1cccc(-c2ccc(CN3CCC[C@@H]([NH3+])CC3)cc2)c1 ZINC001205116574 1133532285 /nfs/dbraw/zinc/53/22/85/1133532285.db2.gz DABXENCTFBAFDF-HXUWFJFHSA-N 1 3 294.442 3.975 20 0 CHADHO C[C@@H]1CN(Cc2cc3c(s2)CC[NH2+]C3)Cc2ccccc21 ZINC001205164437 1133539418 /nfs/dbraw/zinc/53/94/18/1133539418.db2.gz GBOHWPMDKIWUCB-CYBMUJFWSA-N 1 3 298.455 3.513 20 0 CHADHO CN(C)C[C@H]1CC[N@H+](Cc2ccc(C3CC3)c(C3CC3)c2)C1 ZINC001205385787 1133572275 /nfs/dbraw/zinc/57/22/75/1133572275.db2.gz QJJVUZHWRNXPHB-MRXNPFEDSA-N 1 3 298.474 3.825 20 0 CHADHO CN(C)C[C@H]1CC[N@@H+](Cc2ccc(C3CC3)c(C3CC3)c2)C1 ZINC001205385787 1133572279 /nfs/dbraw/zinc/57/22/79/1133572279.db2.gz QJJVUZHWRNXPHB-MRXNPFEDSA-N 1 3 298.474 3.825 20 0 CHADHO Cc1cc(CN2CC[C@@H](C)[C@@H](C[NH3+])CC2)c(F)cc1Cl ZINC001205655153 1133599362 /nfs/dbraw/zinc/59/93/62/1133599362.db2.gz YWUNKUZPALJATG-DGCLKSJQSA-N 1 3 298.833 3.594 20 0 CHADHO CCN(CC)CCC[N@H+](CC)C[C@H](C)C(C)(C)C ZINC001205684550 1133602850 /nfs/dbraw/zinc/60/28/50/1133602850.db2.gz HZXQZMWRPZIOKE-HNNXBMFYSA-N 1 3 256.478 3.722 20 0 CHADHO CCN(CC)CCC[N@@H+](CC)C[C@H](C)C(C)(C)C ZINC001205684550 1133602852 /nfs/dbraw/zinc/60/28/52/1133602852.db2.gz HZXQZMWRPZIOKE-HNNXBMFYSA-N 1 3 256.478 3.722 20 0 CHADHO C[C@@H]1CC[C@H](CN)[N@H+](Cc2cccc3c(F)cccc23)C1 ZINC001205856556 1133623084 /nfs/dbraw/zinc/62/30/84/1133623084.db2.gz WUUWVUPEXPADRT-UKRRQHHQSA-N 1 3 286.394 3.538 20 0 CHADHO C[C@@H]1CC[C@H](CN)[N@@H+](Cc2cccc3c(F)cccc23)C1 ZINC001205856556 1133623086 /nfs/dbraw/zinc/62/30/86/1133623086.db2.gz WUUWVUPEXPADRT-UKRRQHHQSA-N 1 3 286.394 3.538 20 0 CHADHO C[C@@H]1[C@@H](CN)CCC[N@@H+]1CC1(c2ccccc2)CCCC1 ZINC001205901779 1133628875 /nfs/dbraw/zinc/62/88/75/1133628875.db2.gz GFRWADXMHYEEQF-IAGOWNOFSA-N 1 3 286.463 3.558 20 0 CHADHO C[C@@H]1[C@@H](CN)CCC[N@H+]1CC1(c2ccccc2)CCCC1 ZINC001205901779 1133628880 /nfs/dbraw/zinc/62/88/80/1133628880.db2.gz GFRWADXMHYEEQF-IAGOWNOFSA-N 1 3 286.463 3.558 20 0 CHADHO Cc1ccc(Cl)c(CN2CCC[C@H](C[NH3+])[C@H](C)C2)c1F ZINC001205996563 1133638809 /nfs/dbraw/zinc/63/88/09/1133638809.db2.gz XHMVOSPLNGEWBR-CHWSQXEVSA-N 1 3 298.833 3.594 20 0 CHADHO CC(C)N(Cc1ccc(Cl)c(F)c1)[C@H]1CCC[NH2+]CC1 ZINC001206581551 1133721667 /nfs/dbraw/zinc/72/16/67/1133721667.db2.gz KEBJYLAHYVKEFR-AWEZNQCLSA-N 1 3 298.833 3.832 20 0 CHADHO CC(C)(C)c1cccc(CN2CCCC[C@H](C[NH3+])C2)c1 ZINC001206624888 1133729052 /nfs/dbraw/zinc/72/90/52/1133729052.db2.gz ZOFJXWFOSMPSDB-MRXNPFEDSA-N 1 3 274.452 3.545 20 0 CHADHO C[C@H]1CC[C@H](C[NH3+])CN1Cc1ccc(C2CCC2)cc1 ZINC001206811214 1133750903 /nfs/dbraw/zinc/75/09/03/1133750903.db2.gz RUNLZVVCGYYFSE-GOEBONIOSA-N 1 3 272.436 3.513 20 0 CHADHO CN(C1CC1)C1CC[NH+](CCC2CCCCC2)CC1 ZINC001207261038 1133783570 /nfs/dbraw/zinc/78/35/70/1133783570.db2.gz JASJLKGOBDQZFD-UHFFFAOYSA-N 1 3 264.457 3.515 20 0 CHADHO CN(C)CC(C)(C)C[N@@H+]1CCC[C@H]1c1ccccc1F ZINC001207286498 1133788881 /nfs/dbraw/zinc/78/88/81/1133788881.db2.gz VFDZCKGXYAZZKZ-INIZCTEOSA-N 1 3 278.415 3.550 20 0 CHADHO CN(C)CC(C)(C)C[N@H+]1CCC[C@H]1c1ccccc1F ZINC001207286498 1133788886 /nfs/dbraw/zinc/78/88/86/1133788886.db2.gz VFDZCKGXYAZZKZ-INIZCTEOSA-N 1 3 278.415 3.550 20 0 CHADHO CCN(CC)CC[C@H]([NH2+][C@H]1CC[C@H]1C)c1ccccc1 ZINC001207805835 1133849607 /nfs/dbraw/zinc/84/96/07/1133849607.db2.gz KZKUQGIVZBIOQB-NJAFHUGGSA-N 1 3 274.452 3.848 20 0 CHADHO CC1=C[C@@H](C)[C@@H](CN2CCC([NH+]3CCCC3)CC2)CC1 ZINC001208166057 1133892007 /nfs/dbraw/zinc/89/20/07/1133892007.db2.gz VDIJEBPCFJUJKE-IAGOWNOFSA-N 1 3 276.468 3.539 20 0 CHADHO CC1=C[C@@H](C)[C@@H](C[NH+]2CCC(N3CCCC3)CC2)CC1 ZINC001208166057 1133892013 /nfs/dbraw/zinc/89/20/13/1133892013.db2.gz VDIJEBPCFJUJKE-IAGOWNOFSA-N 1 3 276.468 3.539 20 0 CHADHO CC/C=C\CCCCC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C ZINC001208194127 1133904470 /nfs/dbraw/zinc/90/44/70/1133904470.db2.gz KGQRQVFAPNEWOZ-UIZHIOIMSA-N 1 3 264.457 3.682 20 0 CHADHO CC/C=C\CCCCC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C ZINC001208194127 1133904471 /nfs/dbraw/zinc/90/44/71/1133904471.db2.gz KGQRQVFAPNEWOZ-UIZHIOIMSA-N 1 3 264.457 3.682 20 0 CHADHO c1ccc(C[N@H+]2CC[C@H](CN3CC[C@H]4CCC[C@@H]4C3)C2)cc1 ZINC001208943220 1133966194 /nfs/dbraw/zinc/96/61/94/1133966194.db2.gz SAPYMXCAWBJYSB-XUVXKRRUSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(C[N@@H+]2CC[C@H](CN3CC[C@H]4CCC[C@@H]4C3)C2)cc1 ZINC001208943220 1133966198 /nfs/dbraw/zinc/96/61/98/1133966198.db2.gz SAPYMXCAWBJYSB-XUVXKRRUSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(CN2CC[C@H](C[N@@H+]3CC[C@H]4CCC[C@@H]4C3)C2)cc1 ZINC001208943220 1133966200 /nfs/dbraw/zinc/96/62/00/1133966200.db2.gz SAPYMXCAWBJYSB-XUVXKRRUSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(CN2CC[C@H](C[N@H+]3CC[C@H]4CCC[C@@H]4C3)C2)cc1 ZINC001208943220 1133966205 /nfs/dbraw/zinc/96/62/05/1133966205.db2.gz SAPYMXCAWBJYSB-XUVXKRRUSA-N 1 3 298.474 3.631 20 0 CHADHO CCN(Cc1ccccc1)C1CC[NH+](C[C@H]2C[C@H]2C)CC1 ZINC001209420357 1134014684 /nfs/dbraw/zinc/01/46/84/1134014684.db2.gz HZPZAWJPSRFECO-SJLPKXTDSA-N 1 3 286.463 3.629 20 0 CHADHO CCCN(CCC[NH+]1CCCCC1)Cc1ccccc1 ZINC001209449268 1134024853 /nfs/dbraw/zinc/02/48/53/1134024853.db2.gz WFEMDDHCUPSCHZ-UHFFFAOYSA-N 1 3 274.452 3.775 20 0 CHADHO CCCN(CCC[NH+](C)C)Cc1c[nH]c2c1cccc2C ZINC001209495231 1134030217 /nfs/dbraw/zinc/03/02/17/1134030217.db2.gz SHFFODAYZVREPC-UHFFFAOYSA-N 1 3 287.451 3.640 20 0 CHADHO Cc1c(C[N@@H+]2CCN[C@H](C)CC2)cccc1-c1ccccc1 ZINC001210518622 1134238655 /nfs/dbraw/zinc/23/86/55/1134238655.db2.gz GYUDNMHDURBOTG-MRXNPFEDSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1c(C[N@H+]2CCN[C@H](C)CC2)cccc1-c1ccccc1 ZINC001210518622 1134238659 /nfs/dbraw/zinc/23/86/59/1134238659.db2.gz GYUDNMHDURBOTG-MRXNPFEDSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1cc(Nc2ccc(CN3CCCCC3)c(F)c2)cc[nH+]1 ZINC001215709954 1134664677 /nfs/dbraw/zinc/66/46/77/1134664677.db2.gz KNXVZXLNTRBVSU-UHFFFAOYSA-N 1 3 299.393 3.681 20 0 CHADHO Cc1cccc(CN2CCCC[C@@]3(CCCC[NH2+]C3)C2)c1 ZINC001222162079 1135202800 /nfs/dbraw/zinc/20/28/00/1135202800.db2.gz XIFQZCIMMDKWNA-LJQANCHMSA-N 1 3 286.463 3.741 20 0 CHADHO CC/C=C\CCCCC[N@@H+]1CCC[C@]12CCCNC2 ZINC001222232862 1135210812 /nfs/dbraw/zinc/21/08/12/1135210812.db2.gz XSLPCZXHSIHBRH-LIMHQNJXSA-N 1 3 264.457 3.731 20 0 CHADHO CC/C=C\CCCCC[N@H+]1CCC[C@]12CCCNC2 ZINC001222232862 1135210817 /nfs/dbraw/zinc/21/08/17/1135210817.db2.gz XSLPCZXHSIHBRH-LIMHQNJXSA-N 1 3 264.457 3.731 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)[NH2+][C@@H]2CCC[C@@H](N)C2)cc1 ZINC000574290125 335007614 /nfs/dbraw/zinc/00/76/14/335007614.db2.gz HJQPJJBDGGTVHQ-ZTFGCOKTSA-N 1 3 274.452 3.601 20 0 CHADHO C[NH+](C)CC1CCN([C@H]2CCc3ccc(Cl)cc32)CC1 ZINC000574527034 335026993 /nfs/dbraw/zinc/02/69/93/335026993.db2.gz QUCDCHKFFARDED-KRWDZBQOSA-N 1 3 292.854 3.601 20 0 CHADHO CCc1ccc(CNCc2ccc([C@@H](C)[NH3+])cc2)s1 ZINC000574782201 335047284 /nfs/dbraw/zinc/04/72/84/335047284.db2.gz ZTVIQOGKJSEVCR-GFCCVEGCSA-N 1 3 274.433 3.620 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N[C@@H](C)c1csc(C)n1 ZINC000036914510 260050750 /nfs/dbraw/zinc/05/07/50/260050750.db2.gz XEDWABKHQGERJB-STQMWFEESA-N 1 3 283.485 3.613 20 0 CHADHO CSC1(C[NH2+][C@@H](C)c2ccc(C)s2)CCN(C)CC1 ZINC000353632127 533511275 /nfs/dbraw/zinc/51/12/75/533511275.db2.gz RQXYDBRTSCZGAO-ZDUSSCGKSA-N 1 3 298.521 3.535 20 0 CHADHO CC[C@H](NCCC[NH+]1CCCC1)c1ccc(C)cc1 ZINC000021811214 171329301 /nfs/dbraw/zinc/32/93/01/171329301.db2.gz QQBGVHVCWMHHJG-KRWDZBQOSA-N 1 3 260.425 3.522 20 0 CHADHO CC[C@H]([NH2+]CCCN1CCCC1)c1ccc(C)cc1 ZINC000021811214 171329303 /nfs/dbraw/zinc/32/93/03/171329303.db2.gz QQBGVHVCWMHHJG-KRWDZBQOSA-N 1 3 260.425 3.522 20 0 CHADHO C[NH+](C)CCCN[C@@H](CC(C)(C)C)c1ccccc1 ZINC000037213751 173034222 /nfs/dbraw/zinc/03/42/22/173034222.db2.gz UECFRJAQBRGSDV-INIZCTEOSA-N 1 3 262.441 3.705 20 0 CHADHO Cc1cccc(CNC[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000192925988 227387210 /nfs/dbraw/zinc/38/72/10/227387210.db2.gz CKQLKOFXAZLCAE-FQEVSTJZSA-N 1 3 294.442 3.607 20 0 CHADHO Cc1cccc(CNC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000192925988 227387215 /nfs/dbraw/zinc/38/72/15/227387215.db2.gz CKQLKOFXAZLCAE-FQEVSTJZSA-N 1 3 294.442 3.607 20 0 CHADHO c1cc2c(o1)CCC[C@@H]2NCCCCC[NH+]1CCCCC1 ZINC000192860338 227314751 /nfs/dbraw/zinc/31/47/51/227314751.db2.gz PTMSIMVXIUDFKO-KRWDZBQOSA-N 1 3 290.451 3.903 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCCC[C@H]1c1ccccc1)CN(C)C ZINC000394246693 260192798 /nfs/dbraw/zinc/19/27/98/260192798.db2.gz SPAPFVUCEVFOLM-NJAFHUGGSA-N 1 3 274.452 3.500 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)c2cc3ccccc3s2)C1 ZINC000126479903 260353507 /nfs/dbraw/zinc/35/35/07/260353507.db2.gz CMYIBNHVVWYMGC-UONOGXRCSA-N 1 3 288.460 3.894 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H](C)c2cc3ccccc3s2)C1 ZINC000126479903 260353508 /nfs/dbraw/zinc/35/35/08/260353508.db2.gz CMYIBNHVVWYMGC-UONOGXRCSA-N 1 3 288.460 3.894 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H](C)c2cc3ccccc3s2)C1 ZINC000126479903 260353510 /nfs/dbraw/zinc/35/35/10/260353510.db2.gz CMYIBNHVVWYMGC-UONOGXRCSA-N 1 3 288.460 3.894 20 0 CHADHO CCC[C@@H](NCc1cccc(C[NH+](C)C)c1)c1cccnc1 ZINC000184936576 262033910 /nfs/dbraw/zinc/03/39/10/262033910.db2.gz HLKUMZVAWGZXKW-LJQANCHMSA-N 1 3 297.446 3.774 20 0 CHADHO C[C@@H](N[C@@H](C)CCCC[NH3+])c1ccccc1Br ZINC000310500488 262161750 /nfs/dbraw/zinc/16/17/50/262161750.db2.gz HTIZENCTGZIJQR-NWDGAFQWSA-N 1 3 299.256 3.617 20 0 CHADHO CC(C)C[C@H](C)C[NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000499627022 262204423 /nfs/dbraw/zinc/20/44/23/262204423.db2.gz RETPPRISYJQMIG-ULQDDVLXSA-N 1 3 280.500 3.911 20 0 CHADHO CN1CCC[C@@H]1CC[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000502721298 262226268 /nfs/dbraw/zinc/22/62/68/262226268.db2.gz IPDYHIFIXGMJKG-IAGOWNOFSA-N 1 3 292.854 3.961 20 0 CHADHO CN1CCC[C@@H]1CC[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000502721298 262226271 /nfs/dbraw/zinc/22/62/71/262226271.db2.gz IPDYHIFIXGMJKG-IAGOWNOFSA-N 1 3 292.854 3.961 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H](Cc2ccccc2)C(C)C)C1 ZINC000187048749 262377404 /nfs/dbraw/zinc/37/74/04/262377404.db2.gz BZEVSBDEVZHCQV-OALUTQOASA-N 1 3 288.479 3.575 20 0 CHADHO Cc1cc(C)c(CNCc2ccc([C@@H](C)[NH3+])cc2)cc1C ZINC000414809265 263052875 /nfs/dbraw/zinc/05/28/75/263052875.db2.gz LVFSNNRAOQWACT-MRXNPFEDSA-N 1 3 282.431 3.921 20 0 CHADHO Clc1ccccc1[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCCNC1 ZINC000414829316 263056159 /nfs/dbraw/zinc/05/61/59/263056159.db2.gz NRBWMFXQTIEMDM-KMFMINBZSA-N 1 3 292.854 3.565 20 0 CHADHO [NH3+]C1(CN[C@H]2CCC[C@H]2c2ccc(F)cc2)CCCCC1 ZINC000414836748 263057127 /nfs/dbraw/zinc/05/71/27/263057127.db2.gz GGJDIHPUYGGBSG-IRXDYDNUSA-N 1 3 290.426 3.713 20 0 CHADHO C[C@@H](NCC1([NH3+])CCCCCC1)[C@@H](C)c1ccccc1 ZINC000414858050 263074161 /nfs/dbraw/zinc/07/41/61/263074161.db2.gz HPAPQDQYTJOVNY-HZPDHXFCSA-N 1 3 274.452 3.820 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@@H]2[NH2+]C[C@]2(C)CCCNC2)cc1 ZINC000414903624 263111369 /nfs/dbraw/zinc/11/13/69/263111369.db2.gz ISBSVDNDTUICAS-GBESFXJTSA-N 1 3 286.463 3.610 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H](c3ccccc3)C[C@H](C)C2)CCN1 ZINC000414927868 263133393 /nfs/dbraw/zinc/13/33/93/263133393.db2.gz AGZBNKSNSDKNFP-KFXXHRTLSA-N 1 3 286.463 3.689 20 0 CHADHO CC1([NH2+]Cc2ccc(-c3ccccc3)s2)CCNCC1 ZINC000414932718 263138084 /nfs/dbraw/zinc/13/80/84/263138084.db2.gz DFCOITXITNNLOB-UHFFFAOYSA-N 1 3 286.444 3.647 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@H]1C[C@@H](C)C[C@H](c2ccccc2)C1 ZINC000414944940 263154131 /nfs/dbraw/zinc/15/41/31/263154131.db2.gz QSUIPHKOPPICPC-HAYURNKSSA-N 1 3 286.463 3.546 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H]1CCC[C@H]1c1ccccc1Cl ZINC000414948125 263155815 /nfs/dbraw/zinc/15/58/15/263155815.db2.gz XQXOOYUTORPPCO-NQZOLGFYSA-N 1 3 292.854 3.564 20 0 CHADHO Cc1ccccc1-c1cccc(C[NH2+][C@@H]2CCN[C@H](C)C2)c1 ZINC000414952900 263158216 /nfs/dbraw/zinc/15/82/16/263158216.db2.gz REHCRGSQSPKAQC-VQIMIIECSA-N 1 3 294.442 3.892 20 0 CHADHO Clc1oc2ccccc2c1CNCCC[C@H]1CCC[NH2+]1 ZINC000414960047 263165353 /nfs/dbraw/zinc/16/53/53/263165353.db2.gz AADYDHUGZOZURR-LBPRGKRZSA-N 1 3 292.810 3.708 20 0 CHADHO CCc1cccc(Cl)c1CNCCC[C@H]1CCC[NH2+]1 ZINC000414971635 263173117 /nfs/dbraw/zinc/17/31/17/263173117.db2.gz WSUBBCUACSOKCQ-AWEZNQCLSA-N 1 3 280.843 3.524 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](CNCc2csc(Cl)c2Cl)C1 ZINC000415002924 263204346 /nfs/dbraw/zinc/20/43/46/263204346.db2.gz MQWJCZWDXGRKHI-PSASIEDQSA-N 1 3 293.263 3.662 20 0 CHADHO COc1ccc(C)cc1CN[C@@H](CCC[NH3+])c1ccccc1 ZINC000415049571 263255684 /nfs/dbraw/zinc/25/56/84/263255684.db2.gz HVHDUNIEQRLOJD-SFHVURJKSA-N 1 3 298.430 3.573 20 0 CHADHO C[C@@H](CC[NH2+][C@@H]1CNC[C@H]1c1ccccc1)c1ccccc1 ZINC000415036144 263257190 /nfs/dbraw/zinc/25/71/90/263257190.db2.gz FJMSTJKPGKBVJY-FFZOFVMBSA-N 1 3 294.442 3.525 20 0 CHADHO Clc1ccccc1[C@@H]1CCC[C@@H]1[NH2+]CCCNC1CC1 ZINC000415065976 263259814 /nfs/dbraw/zinc/25/98/14/263259814.db2.gz IFDIBLDBPXDDLG-RDJZCZTQSA-N 1 3 292.854 3.708 20 0 CHADHO C[C@H](NC1CCC(C[NH3+])CC1)c1nc(C(C)(C)C)cs1 ZINC000415073402 263262149 /nfs/dbraw/zinc/26/21/49/263262149.db2.gz BEVNGJIUIJEESQ-HIFPTAJRSA-N 1 3 295.496 3.609 20 0 CHADHO Cc1ccccc1C1(CN[C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)CC1 ZINC000415098975 263273031 /nfs/dbraw/zinc/27/30/31/263273031.db2.gz GHEUQXRWFDXJHW-NZSAHSFTSA-N 1 3 298.474 3.537 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)[C@@H]1C[C@H]1c1cccs1)CN1CCCC1 ZINC000417309408 263794953 /nfs/dbraw/zinc/79/49/53/263794953.db2.gz GGOINQBWZWNPAX-YHUYYLMFSA-N 1 3 292.492 3.562 20 0 CHADHO CC(C)C(C)(C)C[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000188709674 264242971 /nfs/dbraw/zinc/24/29/71/264242971.db2.gz WDWKIGSMYDRDLO-UHFFFAOYSA-N 1 3 254.462 3.521 20 0 CHADHO CC[C@H](N[C@H]1CCC[NH2+]CC1)c1ccc(Cl)cc1 ZINC000129001032 264312899 /nfs/dbraw/zinc/31/28/99/264312899.db2.gz UCXQZXFJWXRXSA-GJZGRUSLSA-N 1 3 266.816 3.523 20 0 CHADHO Cc1oc2ccccc2c1C[N@H+]1CCC[C@@H]2CN(C)CC[C@H]21 ZINC000519033707 265300170 /nfs/dbraw/zinc/30/01/70/265300170.db2.gz ZRQLAKIURNVAEH-CRAIPNDOSA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1C[N@@H+]1CCC[C@@H]2CN(C)CC[C@H]21 ZINC000519033707 265300171 /nfs/dbraw/zinc/30/01/71/265300171.db2.gz ZRQLAKIURNVAEH-CRAIPNDOSA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1CN1CCC[C@@H]2C[N@H+](C)CC[C@H]21 ZINC000519033707 265300175 /nfs/dbraw/zinc/30/01/75/265300175.db2.gz ZRQLAKIURNVAEH-CRAIPNDOSA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1CN1CCC[C@@H]2C[N@@H+](C)CC[C@H]21 ZINC000519033707 265300177 /nfs/dbraw/zinc/30/01/77/265300177.db2.gz ZRQLAKIURNVAEH-CRAIPNDOSA-N 1 3 298.430 3.657 20 0 CHADHO C[N@@H+]1CCCC[C@@H]1CCN1CCC[C@H]1c1cccs1 ZINC000356853072 266191246 /nfs/dbraw/zinc/19/12/46/266191246.db2.gz NSTPVJFXHFBDBV-CABCVRRESA-N 1 3 278.465 3.759 20 0 CHADHO C[N@H+]1CCCC[C@@H]1CCN1CCC[C@H]1c1cccs1 ZINC000356853072 266191248 /nfs/dbraw/zinc/19/12/48/266191248.db2.gz NSTPVJFXHFBDBV-CABCVRRESA-N 1 3 278.465 3.759 20 0 CHADHO C[C@@H](CC[NH2+]C1CCC2(CC2)CC1)N1CCCCC1 ZINC000362914424 267060505 /nfs/dbraw/zinc/06/05/05/267060505.db2.gz UAGHBLNIOITQQW-HNNXBMFYSA-N 1 3 264.457 3.563 20 0 CHADHO CCC[C@H](CN[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000368401747 267170463 /nfs/dbraw/zinc/17/04/63/267170463.db2.gz GCSYTGGPFPHRNV-QRVBRYPASA-N 1 3 286.463 3.787 20 0 CHADHO CCC[C@H](CN[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000368401747 267170466 /nfs/dbraw/zinc/17/04/66/267170466.db2.gz GCSYTGGPFPHRNV-QRVBRYPASA-N 1 3 286.463 3.787 20 0 CHADHO [NH3+][C@H]1CCC[C@@H](NC2(c3ccc(Cl)cc3)CCC2)C1 ZINC000580095174 327698349 /nfs/dbraw/zinc/69/83/49/327698349.db2.gz KIFMCNMVSCFTJH-LSDHHAIUSA-N 1 3 278.827 3.579 20 0 CHADHO Cc1ccc2nccc(NC3CC[NH+](CC4CC4)CC3)c2c1 ZINC000185519496 327840284 /nfs/dbraw/zinc/84/02/84/327840284.db2.gz FFDIKJMOBDWFHL-UHFFFAOYSA-N 1 3 295.430 3.830 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+][C@@H](c1ccccc1)C(C)(C)C ZINC000534019435 328033170 /nfs/dbraw/zinc/03/31/70/328033170.db2.gz LHIMOLRRRIFXSE-SJORKVTESA-N 1 3 274.452 3.848 20 0 CHADHO C[N@@H+]1CCC[C@@H]1CCN[C@@H](c1ccccc1)C(C)(C)C ZINC000534019435 328033172 /nfs/dbraw/zinc/03/31/72/328033172.db2.gz LHIMOLRRRIFXSE-SJORKVTESA-N 1 3 274.452 3.848 20 0 CHADHO C[N@H+]1CCC[C@@H]1CCN[C@@H](c1ccccc1)C(C)(C)C ZINC000534019435 328033174 /nfs/dbraw/zinc/03/31/74/328033174.db2.gz LHIMOLRRRIFXSE-SJORKVTESA-N 1 3 274.452 3.848 20 0 CHADHO CCc1ccc(CN2CCC(C[NH+](CC)CC)CC2)s1 ZINC000534332151 328046757 /nfs/dbraw/zinc/04/67/57/328046757.db2.gz LUBRHJNYQOZZJD-UHFFFAOYSA-N 1 3 294.508 3.864 20 0 CHADHO Cc1cc(C[N@H+]2CC[C@@H](C3CCN(C)CC3)C2)c(C)s1 ZINC000563481157 328069503 /nfs/dbraw/zinc/06/95/03/328069503.db2.gz AKUDROQAHWIJFU-MRXNPFEDSA-N 1 3 292.492 3.529 20 0 CHADHO Cc1cc(C[N@@H+]2CC[C@@H](C3CCN(C)CC3)C2)c(C)s1 ZINC000563481157 328069505 /nfs/dbraw/zinc/06/95/05/328069505.db2.gz AKUDROQAHWIJFU-MRXNPFEDSA-N 1 3 292.492 3.529 20 0 CHADHO CC[N@@H+]1CC[C@@H](NCc2cc3ccccc3s2)[C@@H](C)C1 ZINC000571304577 328101215 /nfs/dbraw/zinc/10/12/15/328101215.db2.gz SMMXWYZKPIEGMN-XJKSGUPXSA-N 1 3 288.460 3.721 20 0 CHADHO CC[N@H+]1CC[C@@H](NCc2cc3ccccc3s2)[C@@H](C)C1 ZINC000571304577 328101216 /nfs/dbraw/zinc/10/12/16/328101216.db2.gz SMMXWYZKPIEGMN-XJKSGUPXSA-N 1 3 288.460 3.721 20 0 CHADHO C[C@H]1C[N@H+](CC2CCC(c3ccccc3)CC2)CC[C@H]1N ZINC000414652042 328208264 /nfs/dbraw/zinc/20/82/64/328208264.db2.gz CYLLPXKSRWQUTH-NHFHULPWSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@H]1C[N@@H+](CC2CCC(c3ccccc3)CC2)CC[C@H]1N ZINC000414652042 328208266 /nfs/dbraw/zinc/20/82/66/328208266.db2.gz CYLLPXKSRWQUTH-NHFHULPWSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@H]1CN(CC2CCC(c3ccccc3)CC2)CC[C@H]1[NH3+] ZINC000414652042 328208268 /nfs/dbraw/zinc/20/82/68/328208268.db2.gz CYLLPXKSRWQUTH-NHFHULPWSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@H](N)[C@@H]1CC[N@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC000414655073 328208828 /nfs/dbraw/zinc/20/88/28/328208828.db2.gz CTHCBFGCRYDQSE-NHFHULPWSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@H](N)[C@@H]1CC[N@@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC000414655073 328208829 /nfs/dbraw/zinc/20/88/29/328208829.db2.gz CTHCBFGCRYDQSE-NHFHULPWSA-N 1 3 286.463 3.630 20 0 CHADHO Cc1ccc(-c2ccc(C[NH2+]C[C@@H](N)C3CC3)s2)cc1 ZINC000414892972 328252149 /nfs/dbraw/zinc/25/21/49/328252149.db2.gz JXDXLUCVGFWKEU-MRXNPFEDSA-N 1 3 286.444 3.550 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](CNCc2c(Cl)oc3ccccc32)C1 ZINC000414995359 328290659 /nfs/dbraw/zinc/29/06/59/328290659.db2.gz FLKAVNQHRMWJEU-VXGBXAGGSA-N 1 3 292.810 3.693 20 0 CHADHO c1ccc([C@H](CC2CC2)NC[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000531937762 328319738 /nfs/dbraw/zinc/31/97/38/328319738.db2.gz UDHUOACEFPSEIX-LPHOPBHVSA-N 1 3 284.447 3.602 20 0 CHADHO c1ccc([C@H](CC2CC2)NC[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000531937762 328319739 /nfs/dbraw/zinc/31/97/39/328319739.db2.gz UDHUOACEFPSEIX-LPHOPBHVSA-N 1 3 284.447 3.602 20 0 CHADHO C[C@H]1Cc2ccccc2[C@H]1NCc1ccc(C[NH+](C)C)cc1 ZINC000111410931 328354615 /nfs/dbraw/zinc/35/46/15/328354615.db2.gz CWRVUUXHIQGKMF-YWZLYKJASA-N 1 3 294.442 3.771 20 0 CHADHO C[C@H]1Cc2ccccc2[C@H]1[NH2+]Cc1ccc(CN(C)C)cc1 ZINC000111410931 328354617 /nfs/dbraw/zinc/35/46/17/328354617.db2.gz CWRVUUXHIQGKMF-YWZLYKJASA-N 1 3 294.442 3.771 20 0 CHADHO C[C@H](c1cccc(Cl)c1)[N@H+](C)CC[C@@H]1CCCN1C ZINC000534757886 328360329 /nfs/dbraw/zinc/36/03/29/328360329.db2.gz DQUHVGOGBBLCPR-CJNGLKHVSA-N 1 3 280.843 3.817 20 0 CHADHO C[C@H](c1cccc(Cl)c1)[N@@H+](C)CC[C@@H]1CCCN1C ZINC000534757886 328360330 /nfs/dbraw/zinc/36/03/30/328360330.db2.gz DQUHVGOGBBLCPR-CJNGLKHVSA-N 1 3 280.843 3.817 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@H](C)CC[NH+](C)C)cc1 ZINC000049553482 328371575 /nfs/dbraw/zinc/37/15/75/328371575.db2.gz NWPKQORRRYSYKB-CABCVRRESA-N 1 3 262.441 3.801 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H](C)c1c(C)cccc1C ZINC000558723170 327117282 /nfs/dbraw/zinc/11/72/82/327117282.db2.gz JZSVLSJSCBDSCT-INIZCTEOSA-N 1 3 262.441 3.686 20 0 CHADHO CC[NH+](CC)C[C@@H]1CCN([C@@H]2C=CCCCCC2)C1 ZINC000559105652 327141404 /nfs/dbraw/zinc/14/14/04/327141404.db2.gz GGYKWJKXNQANIX-DLBZAZTESA-N 1 3 264.457 3.539 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+]([C@@H]2C=CCCCCC2)C1 ZINC000559105652 327141405 /nfs/dbraw/zinc/14/14/05/327141405.db2.gz GGYKWJKXNQANIX-DLBZAZTESA-N 1 3 264.457 3.539 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+]([C@@H]2C=CCCCCC2)C1 ZINC000559105652 327141407 /nfs/dbraw/zinc/14/14/07/327141407.db2.gz GGYKWJKXNQANIX-DLBZAZTESA-N 1 3 264.457 3.539 20 0 CHADHO NC[C@@H]1C[N@H+](CCCC2CCCC2)C[C@H]1c1ccccc1 ZINC000410082028 327178261 /nfs/dbraw/zinc/17/82/61/327178261.db2.gz KSOOHTHXBKDLLA-MOPGFXCFSA-N 1 3 286.463 3.631 20 0 CHADHO NC[C@@H]1C[N@@H+](CCCC2CCCC2)C[C@H]1c1ccccc1 ZINC000410082028 327178262 /nfs/dbraw/zinc/17/82/62/327178262.db2.gz KSOOHTHXBKDLLA-MOPGFXCFSA-N 1 3 286.463 3.631 20 0 CHADHO [NH3+]C[C@@H]1CN(CCCC2CCCC2)C[C@H]1c1ccccc1 ZINC000410082028 327178263 /nfs/dbraw/zinc/17/82/63/327178263.db2.gz KSOOHTHXBKDLLA-MOPGFXCFSA-N 1 3 286.463 3.631 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCc1ccc(-c2ccccc2F)s1 ZINC000566230231 327248477 /nfs/dbraw/zinc/24/84/77/327248477.db2.gz SPIVUZSZQJMXHP-VXGBXAGGSA-N 1 3 292.423 3.770 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN([C@@H]2C=CCCCCC2)C1 ZINC000559796363 327261907 /nfs/dbraw/zinc/26/19/07/327261907.db2.gz SGAFGVHDJFABLI-IAGOWNOFSA-N 1 3 264.457 3.539 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN([C@@H]2C=CCCCCC2)C1 ZINC000559796363 327261910 /nfs/dbraw/zinc/26/19/10/327261910.db2.gz SGAFGVHDJFABLI-IAGOWNOFSA-N 1 3 264.457 3.539 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+]([C@@H]2C=CCCCCC2)C1 ZINC000559796363 327261911 /nfs/dbraw/zinc/26/19/11/327261911.db2.gz SGAFGVHDJFABLI-IAGOWNOFSA-N 1 3 264.457 3.539 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+]([C@@H]2C=CCCCCC2)C1 ZINC000559796363 327261912 /nfs/dbraw/zinc/26/19/12/327261912.db2.gz SGAFGVHDJFABLI-IAGOWNOFSA-N 1 3 264.457 3.539 20 0 CHADHO C[C@H](C[NH2+][C@H](C)c1ccc(F)c2ccccc21)CN(C)C ZINC000559860000 327265600 /nfs/dbraw/zinc/26/56/00/327265600.db2.gz VYBNDWCJZDMRLR-ZIAGYGMSSA-N 1 3 288.410 3.827 20 0 CHADHO C[C@H](CN[C@H](C)c1ccc(F)c2ccccc21)C[NH+](C)C ZINC000559860000 327265601 /nfs/dbraw/zinc/26/56/01/327265601.db2.gz VYBNDWCJZDMRLR-ZIAGYGMSSA-N 1 3 288.410 3.827 20 0 CHADHO C[NH+](C)CCCN[C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000561138638 327369033 /nfs/dbraw/zinc/36/90/33/327369033.db2.gz SPMKXGISPGMEPI-MRXNPFEDSA-N 1 3 280.843 3.723 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCCC[C@@H]2c2ccccc2)C1 ZINC000566482089 327392844 /nfs/dbraw/zinc/39/28/44/327392844.db2.gz MMDGCUFEHJFTMF-AKHDSKFASA-N 1 3 286.463 3.820 20 0 CHADHO CCSCCC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000360024596 329070051 /nfs/dbraw/zinc/07/00/51/329070051.db2.gz WAJSTNDGNKOUPF-UHFFFAOYSA-N 1 3 284.513 3.516 20 0 CHADHO CCSCCCNC1CC[NH+](C2CCCCC2)CC1 ZINC000360024596 329070052 /nfs/dbraw/zinc/07/00/52/329070052.db2.gz WAJSTNDGNKOUPF-UHFFFAOYSA-N 1 3 284.513 3.516 20 0 CHADHO CC1=C[C@H](C)C[C@H](C[N@@H+]2CC[C@@H](CN(C)CC3CC3)C2)C1 ZINC000582479473 329095296 /nfs/dbraw/zinc/09/52/96/329095296.db2.gz YNXGVPZIWSMLKQ-SNRMKQJTSA-N 1 3 290.495 3.643 20 0 CHADHO CC1=C[C@H](C)C[C@H](C[N@H+]2CC[C@@H](CN(C)CC3CC3)C2)C1 ZINC000582479473 329095297 /nfs/dbraw/zinc/09/52/97/329095297.db2.gz YNXGVPZIWSMLKQ-SNRMKQJTSA-N 1 3 290.495 3.643 20 0 CHADHO Cc1cc(F)c(CNC2CCC([NH+](C)C)CC2)c(Cl)c1 ZINC000421377372 329817131 /nfs/dbraw/zinc/81/71/31/329817131.db2.gz RJWLPTNQRJYCAA-UHFFFAOYSA-N 1 3 298.833 3.750 20 0 CHADHO C[C@@H](CCCC[NH3+])N[C@@H](CC(F)(F)F)c1ccccc1 ZINC000422707284 330151145 /nfs/dbraw/zinc/15/11/45/330151145.db2.gz HEQWJMQJMSABBO-JSGCOSHPSA-N 1 3 288.357 3.787 20 0 CHADHO Cc1ccc(CCN[C@H]2C[C@H]([NH3+])c3ccccc32)c(C)c1 ZINC000422707618 330151498 /nfs/dbraw/zinc/15/14/98/330151498.db2.gz WSNYVOYWKGJWRI-OALUTQOASA-N 1 3 280.415 3.580 20 0 CHADHO CC(C)Oc1ccc(CC[C@H](C)[NH2+][C@H](C)C[C@H](C)N)cc1 ZINC000422717278 330151825 /nfs/dbraw/zinc/15/18/25/330151825.db2.gz KMHBIGMXIGVRST-HRCADAONSA-N 1 3 292.467 3.510 20 0 CHADHO CC(C)Oc1ccc(CC[C@H](C)[NH2+][C@@H](C)C[C@H](C)N)cc1 ZINC000422717279 330151845 /nfs/dbraw/zinc/15/18/45/330151845.db2.gz KMHBIGMXIGVRST-JYJNAYRXSA-N 1 3 292.467 3.510 20 0 CHADHO CC[C@H](Cc1ccccc1)[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000422717958 330152056 /nfs/dbraw/zinc/15/20/56/330152056.db2.gz WGBZGMZKWQLLKI-RHSMWYFYSA-N 1 3 297.446 3.521 20 0 CHADHO CCSc1ccc([C@H](C)N[C@@H](C)C[C@H](C)[NH3+])cc1 ZINC000422720888 330152158 /nfs/dbraw/zinc/15/21/58/330152158.db2.gz UBYQFERLZWCMGG-AVGNSLFASA-N 1 3 266.454 3.575 20 0 CHADHO C[C@H](CN[C@H]1C[C@@H]([NH3+])c2ccccc21)c1ccc(F)cc1 ZINC000422739821 330152772 /nfs/dbraw/zinc/15/27/72/330152772.db2.gz LXMGZKJQMNSKOO-PJSAGSTRSA-N 1 3 284.378 3.664 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@H]2CC[NH2+]CC[C@@H]2C)c1C ZINC000422735180 330152844 /nfs/dbraw/zinc/15/28/44/330152844.db2.gz DLYJUUXYDBBREF-UGSOOPFHSA-N 1 3 299.462 3.571 20 0 CHADHO Cc1ccc([C@H](C)C[NH2+][C@H](C)c2ccc(CN)nc2C)cc1 ZINC000422760667 330154089 /nfs/dbraw/zinc/15/40/89/330154089.db2.gz LCDDUKBESJDTNY-HUUCEWRRSA-N 1 3 297.446 3.611 20 0 CHADHO C[C@@H](N)C[C@@H](C)[NH2+]CC1(c2cccs2)CCCCC1 ZINC000422772739 330154321 /nfs/dbraw/zinc/15/43/21/330154321.db2.gz XQMYOTZBQDCIBB-ZIAGYGMSSA-N 1 3 280.481 3.665 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCC1(c2cccs2)CCCCC1 ZINC000422772739 330154323 /nfs/dbraw/zinc/15/43/23/330154323.db2.gz XQMYOTZBQDCIBB-ZIAGYGMSSA-N 1 3 280.481 3.665 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+][C@@H](C)C[C@@H](C)N ZINC000422776238 330154440 /nfs/dbraw/zinc/15/44/40/330154440.db2.gz CJABMMVFURGADC-HLLBOEOZSA-N 1 3 262.441 3.503 20 0 CHADHO C[C@H](C[NH2+][C@@H]1C[C@H](N)c2ccccc21)Sc1ccccc1 ZINC000422778973 330155023 /nfs/dbraw/zinc/15/50/23/330155023.db2.gz BIKOBDMTFRAMTN-JEBQAFNWSA-N 1 3 298.455 3.902 20 0 CHADHO [NH3+][C@@H]1C[C@H](N[C@@H]2CC[C@H]3CCC[C@@H]3C2)c2ccccc21 ZINC000422795441 330155531 /nfs/dbraw/zinc/15/55/31/330155531.db2.gz VOOJUKYMQNXDAZ-NBZYUPRNSA-N 1 3 270.420 3.690 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CCCCC1CCCC1 ZINC000422798736 330155665 /nfs/dbraw/zinc/15/56/65/330155665.db2.gz SPOHOZUFXLZJBN-CQSZACIVSA-N 1 3 289.467 3.860 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000422808802 330155901 /nfs/dbraw/zinc/15/59/01/330155901.db2.gz QWPWPGQXBUWEIG-KUHUBIRLSA-N 1 3 295.430 3.651 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H](C)[C@H](C)c1ccccc1 ZINC000422817712 330156305 /nfs/dbraw/zinc/15/63/05/330156305.db2.gz DUTJQQCPEDKKSW-ZNMIVQPWSA-N 1 3 297.446 3.692 20 0 CHADHO CC[C@H](N[C@@H](C)[C@@H]1CCC[NH2+]C1)c1cccc(Cl)c1 ZINC000422853421 330157416 /nfs/dbraw/zinc/15/74/16/330157416.db2.gz BTFJHYHHDXLTES-BJJXKVORSA-N 1 3 280.843 3.769 20 0 CHADHO C[C@@H](N)C[C@H](C)[NH2+]CC1CCC(c2ccccc2)CC1 ZINC000422892385 330159232 /nfs/dbraw/zinc/15/92/32/330159232.db2.gz YEVXLSWZVGJTAS-MHAAMQRSSA-N 1 3 274.452 3.676 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCCc1cccc(-c2ccccc2)c1 ZINC000422883658 330159148 /nfs/dbraw/zinc/15/91/48/330159148.db2.gz CPYIZQBCEBCGQF-CVEARBPZSA-N 1 3 282.431 3.612 20 0 CHADHO C[C@@H](N)C[C@H](C)[NH2+]CCc1cccc(-c2ccccc2)c1 ZINC000422883658 330159150 /nfs/dbraw/zinc/15/91/50/330159150.db2.gz CPYIZQBCEBCGQF-CVEARBPZSA-N 1 3 282.431 3.612 20 0 CHADHO c1ccc([C@H]2CCCC[C@H]2NC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000422896059 330159600 /nfs/dbraw/zinc/15/96/00/330159600.db2.gz HFBYXJKYXFULJN-YZYRWKSTSA-N 1 3 284.447 3.585 20 0 CHADHO Cc1cccc(C2(C[NH2+][C@@H](C)C[C@@H](C)N)CCCC2)c1 ZINC000422909418 330159860 /nfs/dbraw/zinc/15/98/60/330159860.db2.gz NZPBCNOQEDKEHO-CVEARBPZSA-N 1 3 274.452 3.522 20 0 CHADHO Cc1cccc(C2(CN[C@@H](C)C[C@@H](C)[NH3+])CCCC2)c1 ZINC000422909418 330159862 /nfs/dbraw/zinc/15/98/62/330159862.db2.gz NZPBCNOQEDKEHO-CVEARBPZSA-N 1 3 274.452 3.522 20 0 CHADHO C[C@@H](N[C@@H](C)CCCC[NH3+])c1c(F)cccc1Cl ZINC000422923475 330160538 /nfs/dbraw/zinc/16/05/38/330160538.db2.gz WHJRBZGVQDIKSX-WDEREUQCSA-N 1 3 272.795 3.647 20 0 CHADHO Cc1cccc(C)c1CCN[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422925222 330160762 /nfs/dbraw/zinc/16/07/62/330160762.db2.gz AQJXEMMSGRONTQ-RTBURBONSA-N 1 3 280.415 3.580 20 0 CHADHO NC[C@@H]1CCCC[C@H]1[NH2+]CCc1csc2ccccc12 ZINC000422935915 330161437 /nfs/dbraw/zinc/16/14/37/330161437.db2.gz LGXQIEKHSCMHGS-XJKSGUPXSA-N 1 3 288.460 3.551 20 0 CHADHO CCCc1ccc([C@H](N[C@@H](C)C2C[NH2+]C2)C(C)C)cc1 ZINC000422937202 330161531 /nfs/dbraw/zinc/16/15/31/330161531.db2.gz NZBPYUDPMWPWPM-KBXCAEBGSA-N 1 3 274.452 3.534 20 0 CHADHO CCCc1ccc([C@H]([NH2+][C@@H](C)C2CNC2)C(C)C)cc1 ZINC000422937202 330161533 /nfs/dbraw/zinc/16/15/33/330161533.db2.gz NZBPYUDPMWPWPM-KBXCAEBGSA-N 1 3 274.452 3.534 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H]1CCC(C)(C)c2ccccc21 ZINC000422939491 330161719 /nfs/dbraw/zinc/16/17/19/330161719.db2.gz FWMYLJKFOFZAFB-HEHGZKQESA-N 1 3 260.425 3.515 20 0 CHADHO c1ccc(C2CC(N[C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)C2)cc1 ZINC000422968667 330164451 /nfs/dbraw/zinc/16/44/51/330164451.db2.gz RTRBKUSCIKASKP-RNUBBMKBSA-N 1 3 298.474 3.833 20 0 CHADHO C[C@@H]1CC[C@H](N[C@H]2CC[NH2+]CC[C@H]2C)c2ccccc21 ZINC000423004506 330164846 /nfs/dbraw/zinc/16/48/46/330164846.db2.gz PGXHPVSSODKTCW-KNCCTNLNSA-N 1 3 272.436 3.603 20 0 CHADHO C[C@H](N[C@H]1CC[C@@H](C)c2ccccc21)[C@@H]1CCC[NH2+]C1 ZINC000423005411 330164921 /nfs/dbraw/zinc/16/49/21/330164921.db2.gz RZTCMMGZRKFMHP-FSZRXZPDSA-N 1 3 272.436 3.603 20 0 CHADHO C[C@H]([NH2+][C@H]1CC[C@@H](C)c2ccccc21)[C@@H]1CCCNC1 ZINC000423005411 330164923 /nfs/dbraw/zinc/16/49/23/330164923.db2.gz RZTCMMGZRKFMHP-FSZRXZPDSA-N 1 3 272.436 3.603 20 0 CHADHO CC1(C)CC[C@H](CNC2C[C@H]3CC[C@@H](C2)[NH2+]3)c2ccccc21 ZINC000423018264 330165445 /nfs/dbraw/zinc/16/54/45/330165445.db2.gz QNUGJOPXZHJZHC-VPSFDDGASA-N 1 3 298.474 3.714 20 0 CHADHO Cc1cccc([C@H](N[C@H](C)CCCC[NH3+])c2ccccn2)c1 ZINC000423030777 330166215 /nfs/dbraw/zinc/16/62/15/330166215.db2.gz WHJKOLLKKVDUDX-APWZRJJASA-N 1 3 297.446 3.587 20 0 CHADHO CS[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCCN1)C(C)(C)C ZINC000423036774 330166529 /nfs/dbraw/zinc/16/65/29/330166529.db2.gz UTEQPIYJNOWZDF-KLHDSHLOSA-N 1 3 298.540 3.665 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+][C@H](C)C1(c2ccccc2)CCCC1 ZINC000423048112 330167178 /nfs/dbraw/zinc/16/71/78/330167178.db2.gz HRGKZECHMVUPEQ-ARFHVFGLSA-N 1 3 274.452 3.602 20 0 CHADHO CC(C)[C@@H]1CCc2ccccc2[C@@H]1NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423052517 330167523 /nfs/dbraw/zinc/16/75/23/330167523.db2.gz QOJALBLJLBRPEC-LJDZDVQXSA-N 1 3 298.474 3.819 20 0 CHADHO CC(C)[C@H](CC(F)(F)F)N[C@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000423059127 330167661 /nfs/dbraw/zinc/16/76/61/330167661.db2.gz LESWOBBJRLEBGB-RDBSUJKOSA-N 1 3 294.405 3.864 20 0 CHADHO C[C@H](CCCC(F)(F)F)N[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423078781 330168591 /nfs/dbraw/zinc/16/85/91/330168591.db2.gz WTHHACLOXOAUAF-DDTOSNHZSA-N 1 3 286.341 3.842 20 0 CHADHO c1ccc([C@@H]2CCC[C@H](NC3C[C@H]4CC[C@@H](C3)[NH2+]4)C2)cc1 ZINC000423078099 330168635 /nfs/dbraw/zinc/16/86/35/330168635.db2.gz NTRVGNUXINWLHM-AQVVAKNZSA-N 1 3 284.447 3.585 20 0 CHADHO C[C@H](CCCC(F)(F)F)N[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423078783 330168651 /nfs/dbraw/zinc/16/86/51/330168651.db2.gz WTHHACLOXOAUAF-HONMWMINSA-N 1 3 286.341 3.842 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@@H](C)CC1CCCCC1 ZINC000423087646 330169148 /nfs/dbraw/zinc/16/91/48/330169148.db2.gz ONSWYZSJDDFNPO-UONOGXRCSA-N 1 3 289.467 3.858 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[C@@H](c2cccc(F)c2)C1 ZINC000423092883 330169474 /nfs/dbraw/zinc/16/94/74/330169474.db2.gz DTQOHWNRDXBDIJ-FZCLSBEQSA-N 1 3 290.426 3.569 20 0 CHADHO CC(C)[C@H](C[NH2+][C@H](C)C[C@H](C)N)c1ccc(Cl)cc1 ZINC000423099076 330170288 /nfs/dbraw/zinc/17/02/88/330170288.db2.gz AGAJPGMJBCBPHB-ZENOOKHLSA-N 1 3 282.859 3.795 20 0 CHADHO N[C@@H]1CCCCC[C@H]1[NH2+]Cc1ccc2sccc2c1 ZINC000423130036 330171520 /nfs/dbraw/zinc/17/15/20/330171520.db2.gz XXFQIHHLNRMFKF-HUUCEWRRSA-N 1 3 274.433 3.651 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@@H]1NCCc1cc2ccccc2s1 ZINC000423132574 330171844 /nfs/dbraw/zinc/17/18/44/330171844.db2.gz JIMJTNXGPIGGIF-CVEARBPZSA-N 1 3 288.460 3.693 20 0 CHADHO C[C@@H](N[C@H]1CCC[NH2+]CC1)c1ccc(F)c2ccccc21 ZINC000423137150 330172404 /nfs/dbraw/zinc/17/24/04/330172404.db2.gz ZSVIVMCWPBQUGB-KGLIPLIRSA-N 1 3 286.394 3.772 20 0 CHADHO C=Cc1ccc(CCN[C@@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000423141626 330172541 /nfs/dbraw/zinc/17/25/41/330172541.db2.gz QYDOMHBVJDFSLG-RTBURBONSA-N 1 3 278.399 3.607 20 0 CHADHO [NH3+][C@H]1C[C@@H](NCC2(C3CCC3)CCC2)c2ccccc21 ZINC000423162348 330173634 /nfs/dbraw/zinc/17/36/34/330173634.db2.gz KQWVDMLCBVYMQU-DLBZAZTESA-N 1 3 270.420 3.691 20 0 CHADHO Clc1cccc([C@H]2CCC[C@@H]([NH2+]C3CCNCC3)C2)c1 ZINC000423171158 330174571 /nfs/dbraw/zinc/17/45/71/330174571.db2.gz ZNNQMAWIYKTMJY-WMLDXEAASA-N 1 3 292.854 3.708 20 0 CHADHO NC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000423177302 330175219 /nfs/dbraw/zinc/17/52/19/330175219.db2.gz HBSVXEHRKXKYCJ-DIECFANBSA-N 1 3 292.854 3.693 20 0 CHADHO Cc1ccccc1[C@H]([NH2+]C1CCNCC1)C1CCCC1 ZINC000423180737 330175329 /nfs/dbraw/zinc/17/53/29/330175329.db2.gz IUNNXHXZRYRICA-GOSISDBHSA-N 1 3 272.436 3.568 20 0 CHADHO Cc1ccccc1[C@H](NC1CC[NH2+]CC1)C1CCCC1 ZINC000423180737 330175330 /nfs/dbraw/zinc/17/53/30/330175330.db2.gz IUNNXHXZRYRICA-GOSISDBHSA-N 1 3 272.436 3.568 20 0 CHADHO Cc1ccsc1[C@@H](C)[NH2+]CC1(N)CCCCCC1 ZINC000423198824 330176508 /nfs/dbraw/zinc/17/65/08/330176508.db2.gz ICUPBZUQVGUGDE-CYBMUJFWSA-N 1 3 266.454 3.759 20 0 CHADHO Clc1cccc([C@@H]2CC[C@H]([NH2+]C[C@@H]3CCCNC3)C2)c1 ZINC000423208251 330177251 /nfs/dbraw/zinc/17/72/51/330177251.db2.gz HOXMLRJQOBRBHF-UNEWFSDZSA-N 1 3 292.854 3.565 20 0 CHADHO C[C@@H](N[C@@H](C)c1cc2c(s1)CCCC2)[C@@H]1CCC[NH2+]C1 ZINC000423212632 330177963 /nfs/dbraw/zinc/17/79/63/330177963.db2.gz ISTMZNPDKRJUAD-VNHYZAJKSA-N 1 3 292.492 3.666 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)c1cc2c(s1)CCCC2)[C@@H]1CCCNC1 ZINC000423212632 330177964 /nfs/dbraw/zinc/17/79/64/330177964.db2.gz ISTMZNPDKRJUAD-VNHYZAJKSA-N 1 3 292.492 3.666 20 0 CHADHO Fc1ccc([C@H](NC[C@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC000423212723 330178364 /nfs/dbraw/zinc/17/83/64/330178364.db2.gz MEPRFVCUHALLFP-KBXCAEBGSA-N 1 3 290.426 3.646 20 0 CHADHO Fc1ccc([C@H]([NH2+]C[C@H]2CCCNC2)C2CCCC2)cc1 ZINC000423212723 330178365 /nfs/dbraw/zinc/17/83/65/330178365.db2.gz MEPRFVCUHALLFP-KBXCAEBGSA-N 1 3 290.426 3.646 20 0 CHADHO CCCc1ccc([C@H](C)N[C@H](C)[C@H]2CCC[NH2+]C2)cc1 ZINC000423217825 330179066 /nfs/dbraw/zinc/17/90/66/330179066.db2.gz QOLZODTYEFCQNU-DAYGRLMNSA-N 1 3 274.452 3.678 20 0 CHADHO CC(C)Sc1ccc([C@H](C)[NH2+]C[C@H](N)C(C)C)cc1 ZINC000423264510 330184098 /nfs/dbraw/zinc/18/40/98/330184098.db2.gz CCUYOZMTEWARBQ-BBRMVZONSA-N 1 3 280.481 3.821 20 0 CHADHO CC[C@H](N[C@H](C[NH3+])C1CCCCC1)c1cccs1 ZINC000423267854 330184402 /nfs/dbraw/zinc/18/44/02/330184402.db2.gz UBXHKLQQBWASQG-UONOGXRCSA-N 1 3 266.454 3.696 20 0 CHADHO [NH3+]C[C@H](N[C@@H]1CCCc2c3ccccc3sc21)C1CC1 ZINC000423276186 330185104 /nfs/dbraw/zinc/18/51/04/330185104.db2.gz MPJOECTZEPLEFE-CABCVRRESA-N 1 3 286.444 3.606 20 0 CHADHO CNC[C@@H](C)C[NH2+][C@@H](C)C(c1ccccc1)c1ccccc1 ZINC000423284019 330185725 /nfs/dbraw/zinc/18/57/25/330185725.db2.gz XXWPQZAFUDZCGM-SJORKVTESA-N 1 3 296.458 3.652 20 0 CHADHO C[NH2+]C[C@@H](C)CN[C@@H](C)C(c1ccccc1)c1ccccc1 ZINC000423284019 330185726 /nfs/dbraw/zinc/18/57/26/330185726.db2.gz XXWPQZAFUDZCGM-SJORKVTESA-N 1 3 296.458 3.652 20 0 CHADHO CC[C@H](NCc1ccc([C@H](C)[NH3+])cc1)c1cccc(OC)c1 ZINC000423288974 330186405 /nfs/dbraw/zinc/18/64/05/330186405.db2.gz AEVQWHOZBHXDKT-LIRRHRJNSA-N 1 3 298.430 3.956 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2CCCc3sccc32)cc1 ZINC000423290259 330186734 /nfs/dbraw/zinc/18/67/34/330186734.db2.gz CODVEGOKIYATDP-BLLLJJGKSA-N 1 3 286.444 3.935 20 0 CHADHO Cc1ccsc1[C@@H](C)NCc1ccc([C@H](C)[NH3+])cc1 ZINC000423290562 330186773 /nfs/dbraw/zinc/18/67/73/330186773.db2.gz DNOUNEJKAJTHIC-QWHCGFSZSA-N 1 3 274.433 3.927 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2CCc3cc(F)ccc32)cc1 ZINC000423291840 330187364 /nfs/dbraw/zinc/18/73/64/330187364.db2.gz KBEUHXZISQGVCM-KPZWWZAWSA-N 1 3 284.378 3.623 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@H]2CCCNc3ccccc32)cc1 ZINC000423292675 330187731 /nfs/dbraw/zinc/18/77/31/330187731.db2.gz NVLXWGZRNQEWDO-LIRRHRJNSA-N 1 3 295.430 3.743 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc(F)c(F)c2)cc1 ZINC000423293180 330187781 /nfs/dbraw/zinc/18/77/81/330187781.db2.gz QCSWTPQKMULJDQ-RYUDHWBXSA-N 1 3 290.357 3.835 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H]2CCCOc3ccccc32)cc1 ZINC000423295180 330188354 /nfs/dbraw/zinc/18/83/54/330188354.db2.gz WINKCJLCAQSGFI-RDTXWAMCSA-N 1 3 296.414 3.710 20 0 CHADHO CC(C)[C@@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1cccnc1 ZINC000423296259 330188372 /nfs/dbraw/zinc/18/83/72/330188372.db2.gz YTDGLBTVTTVSPU-RDTXWAMCSA-N 1 3 283.419 3.588 20 0 CHADHO COc1ccc([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000423296254 330188392 /nfs/dbraw/zinc/18/83/92/330188392.db2.gz YSQRWCRMEZAHCX-UONOGXRCSA-N 1 3 284.403 3.566 20 0 CHADHO CC(C)[C@H](NC[C@H](C)C[NH3+])c1cccc(C(F)(F)F)c1 ZINC000423300911 330189019 /nfs/dbraw/zinc/18/90/19/330189019.db2.gz SMOGTBUACZRWJJ-RISCZKNCSA-N 1 3 288.357 3.587 20 0 CHADHO C[C@@H](NC[C@]1(C)CCC[NH2+]C1)c1cccc2ccccc21 ZINC000423318678 330190114 /nfs/dbraw/zinc/19/01/14/330190114.db2.gz CWGRBCUSDWIZDM-DNVCBOLYSA-N 1 3 282.431 3.880 20 0 CHADHO C[C@@H]([NH2+]C[C@]1(C)CCCNC1)c1cccc2ccccc21 ZINC000423318678 330190116 /nfs/dbraw/zinc/19/01/16/330190116.db2.gz CWGRBCUSDWIZDM-DNVCBOLYSA-N 1 3 282.431 3.880 20 0 CHADHO C[C@@H](NCC1(C)CC[NH2+]CC1)c1ccc(F)cc1Cl ZINC000423317461 330190127 /nfs/dbraw/zinc/19/01/27/330190127.db2.gz BMHYRACWSWFUGV-LLVKDONJSA-N 1 3 284.806 3.519 20 0 CHADHO CCc1c2cc(C)ccc2oc1[C@H](C)NCC1=CC[NH2+]CC1 ZINC000423331781 330191087 /nfs/dbraw/zinc/19/10/87/330191087.db2.gz CXWYTZKWTLENCG-AWEZNQCLSA-N 1 3 298.430 3.874 20 0 CHADHO Cc1cc2cc([C@H](C)NCC3=CC[NH2+]CC3)oc2cc1C ZINC000423345376 330192243 /nfs/dbraw/zinc/19/22/43/330192243.db2.gz NVGHPRZIVJETNS-AWEZNQCLSA-N 1 3 284.403 3.620 20 0 CHADHO CC[C@@H](NCC1=CC[NH2+]CC1)c1ccc(Cl)cc1Cl ZINC000423347574 330192544 /nfs/dbraw/zinc/19/25/44/330192544.db2.gz QQFBDNHQOYDUHJ-OAHLLOKOSA-N 1 3 299.245 3.954 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000423361353 330193655 /nfs/dbraw/zinc/19/36/55/330193655.db2.gz AFHDZWLJJITMOE-WNOSKKOXSA-N 1 3 292.854 3.564 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@H](c3ccc(Cl)cc3)C2)C1 ZINC000423364897 330194292 /nfs/dbraw/zinc/19/42/92/330194292.db2.gz KBXDTZXRZKRABX-ORQFMDKSSA-N 1 3 292.854 3.836 20 0 CHADHO CC(C)C[C@H]([NH2+][C@H]1CCN[C@@H](C)C1)c1cccs1 ZINC000423371011 330194846 /nfs/dbraw/zinc/19/48/46/330194846.db2.gz HGISZUGBOJJGJS-IHRRRGAJSA-N 1 3 266.454 3.565 20 0 CHADHO C[C@H](CCCC(F)(F)F)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423370198 330194985 /nfs/dbraw/zinc/19/49/85/330194985.db2.gz FHZGJNGTMLIGLW-LLVKDONJSA-N 1 3 286.341 3.501 20 0 CHADHO C[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)c1cc(Cl)cc(Cl)c1 ZINC000423371513 330195398 /nfs/dbraw/zinc/19/53/98/330195398.db2.gz GJQGXTKTTTWXCI-FZZIBODNSA-N 1 3 287.234 3.914 20 0 CHADHO C[C@H]([NH2+]Cc1ccc2c(c1)CNC2)[C@@H]1C[C@H]1c1ccccc1 ZINC000423396814 330195602 /nfs/dbraw/zinc/19/56/02/330195602.db2.gz SRHNWFGDTDYHSG-GKCIPKSASA-N 1 3 292.426 3.572 20 0 CHADHO C[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccc2c(c1)CCC2 ZINC000423400438 330195829 /nfs/dbraw/zinc/19/58/29/330195829.db2.gz VITKVNSTKCHFDA-AWEZNQCLSA-N 1 3 292.426 3.629 20 0 CHADHO C[C@@H]1C[C@H](N[C@H](CC(C)(C)C)c2ccccc2)CC[NH2+]1 ZINC000423400782 330195844 /nfs/dbraw/zinc/19/58/44/330195844.db2.gz WVSVKVKJBIXZKM-DJIMGWMZSA-N 1 3 274.452 3.894 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H](CC(C)(C)C)c2ccccc2)CCN1 ZINC000423400782 330195846 /nfs/dbraw/zinc/19/58/46/330195846.db2.gz WVSVKVKJBIXZKM-DJIMGWMZSA-N 1 3 274.452 3.894 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@@H]1N[C@@H](CC1CCC1)c1ccccc1 ZINC000423397928 330195995 /nfs/dbraw/zinc/19/59/95/330195995.db2.gz OOWXPBDBHJYIEM-JLSDUUJJSA-N 1 3 272.436 3.506 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H](CC1CCC1)c1ccccc1 ZINC000423397928 330195997 /nfs/dbraw/zinc/19/59/97/330195997.db2.gz OOWXPBDBHJYIEM-JLSDUUJJSA-N 1 3 272.436 3.506 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1ccc(F)c2ccccc21 ZINC000423374739 330198614 /nfs/dbraw/zinc/19/86/14/330198614.db2.gz IHLSJPWDBMJSIQ-HZSPNIEDSA-N 1 3 286.394 3.770 20 0 CHADHO C[C@@H]1[C@H]([NH2+]Cc2ccc3c(c2)CNC3)C[C@H]1c1ccccc1 ZINC000423382164 330199202 /nfs/dbraw/zinc/19/92/02/330199202.db2.gz JXNPWMIKWKENFT-VHKYSDTDSA-N 1 3 292.426 3.572 20 0 CHADHO CC(C)[C@H](CSc1ccccc1)[NH2+][C@@H]1CCN[C@H](C)C1 ZINC000423384684 330199540 /nfs/dbraw/zinc/19/95/40/330199540.db2.gz QGSJHDWNUBFZAA-INMHGKMJSA-N 1 3 292.492 3.533 20 0 CHADHO CC(C)[C@H](CSc1ccccc1)N[C@@H]1CC[NH2+][C@H](C)C1 ZINC000423384684 330199542 /nfs/dbraw/zinc/19/95/42/330199542.db2.gz QGSJHDWNUBFZAA-INMHGKMJSA-N 1 3 292.492 3.533 20 0 CHADHO CC(C)CC[C@H]([NH2+]Cc1ccc2c(c1)CNC2)C1CC1 ZINC000423384306 330199649 /nfs/dbraw/zinc/19/96/49/330199649.db2.gz KTRCAJAVHQMOBY-SFHVURJKSA-N 1 3 272.436 3.594 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H](c3ccc(Cl)cc3)C2)CCN1 ZINC000423387602 330199978 /nfs/dbraw/zinc/19/99/78/330199978.db2.gz SOJLORXZLHIULR-ODVANORSSA-N 1 3 292.854 3.706 20 0 CHADHO CCSc1ccc([C@H](C)N[C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000423390662 330200298 /nfs/dbraw/zinc/20/02/98/330200298.db2.gz PBTIARHAXSVSEG-CFVMTHIKSA-N 1 3 278.465 3.719 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@H]1N[C@H](c1ccc(F)cc1)C1CCCC1 ZINC000423391291 330200386 /nfs/dbraw/zinc/20/03/86/330200386.db2.gz KSBOUJTXOGFOBD-XWIAVFTESA-N 1 3 290.426 3.645 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@H](c1ccc(F)cc1)C1CCCC1 ZINC000423391291 330200388 /nfs/dbraw/zinc/20/03/88/330200388.db2.gz KSBOUJTXOGFOBD-XWIAVFTESA-N 1 3 290.426 3.645 20 0 CHADHO CC[C@@H](N)C[NH2+][C@H](C)c1ccc(-c2ccccc2OC)cc1 ZINC000423459459 330203901 /nfs/dbraw/zinc/20/39/01/330203901.db2.gz IBQWXGYXYAUTQG-RHSMWYFYSA-N 1 3 298.430 3.750 20 0 CHADHO CC[C@H]([NH2+]C[C@@H]1CNCC[C@@H]1c1ccc(F)cc1)C(C)C ZINC000423472784 330205266 /nfs/dbraw/zinc/20/52/66/330205266.db2.gz NFWZUNPXTYQVJL-JQHSSLGASA-N 1 3 292.442 3.543 20 0 CHADHO CC[C@H](N)C[NH2+][C@@H](C)c1ccc(-c2cccs2)cc1 ZINC000423484759 330206602 /nfs/dbraw/zinc/20/66/02/330206602.db2.gz YWVLGMQJCRQDQS-WFASDCNBSA-N 1 3 274.433 3.803 20 0 CHADHO CC[C@H](N)C[NH2+][C@H](c1cccc(C(F)(F)F)c1)C(C)C ZINC000423486661 330206763 /nfs/dbraw/zinc/20/67/63/330206763.db2.gz ZYDHIOQQRJMEHY-KBPBESRZSA-N 1 3 288.357 3.729 20 0 CHADHO CCc1ccc([C@@H](C)N[C@@H](CCC[NH3+])c2ccccc2)o1 ZINC000423506717 330208815 /nfs/dbraw/zinc/20/88/15/330208815.db2.gz PGCVVRHZHXNYOK-PBHICJAKSA-N 1 3 286.419 3.973 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]CCCNC1CC1 ZINC000423554171 330211849 /nfs/dbraw/zinc/21/18/49/330211849.db2.gz LFZHMHHQBGGEKW-GOSISDBHSA-N 1 3 297.446 3.585 20 0 CHADHO CCC[C@H](C)[C@@H](CC)[NH2+]CCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000536859120 330252574 /nfs/dbraw/zinc/25/25/74/330252574.db2.gz UTUZSIUAURSIAI-WNRNVDISSA-N 1 3 298.515 3.680 20 0 CHADHO FC1(CNCc2ccc(C[NH+]3CCCCCC3)cc2)CC1 ZINC000527519427 330256292 /nfs/dbraw/zinc/25/62/92/330256292.db2.gz HCXHEVPAXHZTNW-UHFFFAOYSA-N 1 3 290.426 3.654 20 0 CHADHO Cc1cccc([C@H](N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)C(C)C)c1 ZINC000527810206 330284702 /nfs/dbraw/zinc/28/47/02/330284702.db2.gz OVVYPMPEYRFMJV-CEXWTWQISA-N 1 3 286.463 3.909 20 0 CHADHO Cc1cccc([C@H](N[C@@H]2CC[N@H+]3CCC[C@H]3C2)C(C)C)c1 ZINC000527810206 330284703 /nfs/dbraw/zinc/28/47/03/330284703.db2.gz OVVYPMPEYRFMJV-CEXWTWQISA-N 1 3 286.463 3.909 20 0 CHADHO CC[NH+](CC)CCCNC1CC(c2ccc(C)cc2)C1 ZINC000036842388 330292478 /nfs/dbraw/zinc/29/24/78/330292478.db2.gz HXPZPRBEIIDMBS-UHFFFAOYSA-N 1 3 274.452 3.563 20 0 CHADHO CCN(CC)CCC[NH2+]C1CC(c2ccc(C)cc2)C1 ZINC000036842388 330292479 /nfs/dbraw/zinc/29/24/79/330292479.db2.gz HXPZPRBEIIDMBS-UHFFFAOYSA-N 1 3 274.452 3.563 20 0 CHADHO C[C@@H]1CCC[C@H](N2CCC([NH2+]CC3CC=CC3)CC2)C1 ZINC000527943376 330294074 /nfs/dbraw/zinc/29/40/74/330294074.db2.gz KCBIMJGDEKXJRE-QAPCUYQASA-N 1 3 276.468 3.585 20 0 CHADHO CC(C)Cc1ccc([C@H](C)NC[C@H]2CCC[N@H+](C)C2)cc1 ZINC000044534596 330330074 /nfs/dbraw/zinc/33/00/74/330330074.db2.gz FHZWOOBSUGIPED-FUHWJXTLSA-N 1 3 288.479 3.878 20 0 CHADHO CC(C)Cc1ccc([C@H](C)NC[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000044534596 330330075 /nfs/dbraw/zinc/33/00/75/330330075.db2.gz FHZWOOBSUGIPED-FUHWJXTLSA-N 1 3 288.479 3.878 20 0 CHADHO CCCC1CCC([NH2+][C@@H]2CCN3CCC[C@@H]3C2)CC1 ZINC000106868920 330341458 /nfs/dbraw/zinc/34/14/58/330341458.db2.gz WPAMHESSDJMMPT-BHUNQDJPSA-N 1 3 264.457 3.562 20 0 CHADHO C[C@@H](NCCCC[NH+](C)C)c1ccc(Cl)cc1Cl ZINC000045663472 330347560 /nfs/dbraw/zinc/34/75/60/330347560.db2.gz IUUZYUONHVEODC-LLVKDONJSA-N 1 3 289.250 3.986 20 0 CHADHO C1CC1[C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@H]2[C@H]2CCCCN2)C1 ZINC000424370042 330348344 /nfs/dbraw/zinc/34/83/44/330348344.db2.gz DFRRQRIMFJSBGM-SPOLIRPYSA-N 1 3 290.495 3.856 20 0 CHADHO C[C@@H]([NH2+]CC(C)(C)CN(C)C)c1ccc(Cl)c(F)c1 ZINC000212813412 330367006 /nfs/dbraw/zinc/36/70/06/330367006.db2.gz LWBFEDJUPWCAMU-LLVKDONJSA-N 1 3 286.822 3.718 20 0 CHADHO CC[C@H](N[C@@H]1CCC[C@@H]1C[NH3+])c1cccc(Cl)c1 ZINC000089148254 330380974 /nfs/dbraw/zinc/38/09/74/330380974.db2.gz TWKYFGAVNGAJMQ-VHDGCEQUSA-N 1 3 266.816 3.508 20 0 CHADHO CC1(C)CC[C@H]([NH2+]C2CCN(CC3CCCC3)CC2)C1 ZINC000514756938 330464138 /nfs/dbraw/zinc/46/41/38/330464138.db2.gz WUDAGSDCVXAOMK-KRWDZBQOSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]Cc1ccc(CN(C)C)cc1 ZINC000434766927 330644637 /nfs/dbraw/zinc/64/46/37/330644637.db2.gz VAAGNJDUGSQPDQ-PBHICJAKSA-N 1 3 274.452 3.663 20 0 CHADHO C[C@@H](NCc1ccc(C[NH3+])cc1)c1ccc(Cl)s1 ZINC000572483722 330669132 /nfs/dbraw/zinc/66/91/32/330669132.db2.gz OQQFNKMQCJPIRK-SNVBAGLBSA-N 1 3 280.824 3.711 20 0 CHADHO CCC[NH+]1CCC(CNCc2ccc(Cl)cc2F)CC1 ZINC000438219350 330720042 /nfs/dbraw/zinc/72/00/42/330720042.db2.gz LSINPGNWJWHNEG-UHFFFAOYSA-N 1 3 298.833 3.691 20 0 CHADHO C[C@H](C[NH2+]CC(C)(C)CN1CCCC1)c1ccccc1 ZINC000446787953 330854228 /nfs/dbraw/zinc/85/42/28/330854228.db2.gz ZRRBUMPKSRDXKI-MRXNPFEDSA-N 1 3 274.452 3.502 20 0 CHADHO CSCC1CCC([NH2+]CC[C@H](C)N2CCCCC2)CC1 ZINC000449240830 330908895 /nfs/dbraw/zinc/90/88/95/330908895.db2.gz PCNXHKOTTFRPNG-GTPINHCMSA-N 1 3 298.540 3.762 20 0 CHADHO C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)N1CC[C@H]1CCC[N@@H+]1C ZINC000451146912 331017486 /nfs/dbraw/zinc/01/74/86/331017486.db2.gz NJGWJOHXQILRAM-RFQIPJPRSA-N 1 3 292.389 3.522 20 0 CHADHO C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)N1CC[C@H]1CCC[N@H+]1C ZINC000451146912 331017487 /nfs/dbraw/zinc/01/74/87/331017487.db2.gz NJGWJOHXQILRAM-RFQIPJPRSA-N 1 3 292.389 3.522 20 0 CHADHO C[C@H](C[NH2+][C@H](C)CCCC(F)(F)F)CN1CCCCC1 ZINC000163376845 331029430 /nfs/dbraw/zinc/02/94/30/331029430.db2.gz ZQPYSYNTEXVQHB-ZIAGYGMSSA-N 1 3 294.405 3.819 20 0 CHADHO C(C1CCCC1)N1CCC([NH2+]C2CC3(CCC3)C2)CC1 ZINC000459384547 331279442 /nfs/dbraw/zinc/27/94/42/331279442.db2.gz DHZNNAGPRHCGNA-UHFFFAOYSA-N 1 3 276.468 3.563 20 0 CHADHO CC[C@H](NCC[C@@H]1CCC[N@H+](C)C1)c1ccccc1F ZINC000459724244 331295808 /nfs/dbraw/zinc/29/58/08/331295808.db2.gz AKIMHFIXFLXIJE-YOEHRIQHSA-N 1 3 278.415 3.598 20 0 CHADHO CC[C@H](NCC[C@@H]1CCC[N@@H+](C)C1)c1ccccc1F ZINC000459724244 331295809 /nfs/dbraw/zinc/29/58/09/331295809.db2.gz AKIMHFIXFLXIJE-YOEHRIQHSA-N 1 3 278.415 3.598 20 0 CHADHO CC(C)[C@@H](CN[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000166088260 331306591 /nfs/dbraw/zinc/30/65/91/331306591.db2.gz GYWXZQZCHBRBHL-GUDVDZBRSA-N 1 3 286.463 3.643 20 0 CHADHO CC(C)[C@@H](CN[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000166088260 331306592 /nfs/dbraw/zinc/30/65/92/331306592.db2.gz GYWXZQZCHBRBHL-GUDVDZBRSA-N 1 3 286.463 3.643 20 0 CHADHO CC[C@H]([NH2+]C[C@H](C)CN1CCCC1)c1cccc(F)c1 ZINC000166580340 331307375 /nfs/dbraw/zinc/30/73/75/331307375.db2.gz JHGABKQPPOHUNQ-YOEHRIQHSA-N 1 3 278.415 3.598 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H](C)CN1CCCC1)c1cccc(F)c1 ZINC000166580231 331307406 /nfs/dbraw/zinc/30/74/06/331307406.db2.gz JHGABKQPPOHUNQ-RHSMWYFYSA-N 1 3 278.415 3.598 20 0 CHADHO CC[C@@H]([NH2+]C[C@H](C)CN1CCCC1)c1cccc(F)c1 ZINC000166580453 331307454 /nfs/dbraw/zinc/30/74/54/331307454.db2.gz JHGABKQPPOHUNQ-WMLDXEAASA-N 1 3 278.415 3.598 20 0 CHADHO C[C@@H](CCc1ccsc1)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000462799991 331329648 /nfs/dbraw/zinc/32/96/48/331329648.db2.gz AJGXPIATBBNSJG-ZDUSSCGKSA-N 1 3 294.508 3.968 20 0 CHADHO C[C@@H](CCc1ccsc1)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000462799991 331329649 /nfs/dbraw/zinc/32/96/49/331329649.db2.gz AJGXPIATBBNSJG-ZDUSSCGKSA-N 1 3 294.508 3.968 20 0 CHADHO CCc1cccc(Cl)c1CNCC1(C)CC[NH+](C)CC1 ZINC000473997696 331562269 /nfs/dbraw/zinc/56/22/69/331562269.db2.gz AFQSUYRSABZOLF-UHFFFAOYSA-N 1 3 294.870 3.724 20 0 CHADHO C[C@H](c1ccccc1Cl)N1CCC(C[NH+](C)C)CC1 ZINC000480997676 331794206 /nfs/dbraw/zinc/79/42/06/331794206.db2.gz JKCIVYICUXLZNM-CYBMUJFWSA-N 1 3 280.843 3.675 20 0 CHADHO C[C@H](C[NH2+][C@H]1CS[C@@H](C(C)(C)C)C1)CN1CCCCC1 ZINC000488413777 332005568 /nfs/dbraw/zinc/00/55/68/332005568.db2.gz ZVVYUAJUTLXOQR-BZUAXINKSA-N 1 3 298.540 3.618 20 0 CHADHO C[C@H](CN[C@H]1CS[C@@H](C(C)(C)C)C1)C[NH+]1CCCCC1 ZINC000488413777 332005570 /nfs/dbraw/zinc/00/55/70/332005570.db2.gz ZVVYUAJUTLXOQR-BZUAXINKSA-N 1 3 298.540 3.618 20 0 CHADHO CC(C)C1CC([NH2+][C@H](C)[C@@H]2CCCN(C3CCC3)C2)C1 ZINC000488509293 332014893 /nfs/dbraw/zinc/01/48/93/332014893.db2.gz VNICXEPIQCPGOD-NUWOQIAWSA-N 1 3 278.484 3.664 20 0 CHADHO CC(C)[C@@H]1CCCN1CCC[N@@H+]1CCC[C@H]1C(C)C ZINC000488722396 332022692 /nfs/dbraw/zinc/02/26/92/332022692.db2.gz GSJNYQBQBQQZBG-IRXDYDNUSA-N 1 3 266.473 3.617 20 0 CHADHO CC(C)[C@@H]1CCCN1CCC[N@H+]1CCC[C@H]1C(C)C ZINC000488722396 332022693 /nfs/dbraw/zinc/02/26/93/332022693.db2.gz GSJNYQBQBQQZBG-IRXDYDNUSA-N 1 3 266.473 3.617 20 0 CHADHO C[C@H]1CN(CCC[N@@H+]2C[C@@H](C)CC2(C)C)C(C)(C)C1 ZINC000489356502 332048445 /nfs/dbraw/zinc/04/84/45/332048445.db2.gz FQMDQIMUXBEEPO-GASCZTMLSA-N 1 3 266.473 3.617 20 0 CHADHO C[C@H]1CN(CCC[N@H+]2C[C@@H](C)CC2(C)C)C(C)(C)C1 ZINC000489356502 332048446 /nfs/dbraw/zinc/04/84/46/332048446.db2.gz FQMDQIMUXBEEPO-GASCZTMLSA-N 1 3 266.473 3.617 20 0 CHADHO C[C@H]1C[N@@H+](CCCN2C[C@@H](C)CC2(C)C)C(C)(C)C1 ZINC000489356502 332048448 /nfs/dbraw/zinc/04/84/48/332048448.db2.gz FQMDQIMUXBEEPO-GASCZTMLSA-N 1 3 266.473 3.617 20 0 CHADHO C[C@H]1C[N@H+](CCCN2C[C@@H](C)CC2(C)C)C(C)(C)C1 ZINC000489356502 332048449 /nfs/dbraw/zinc/04/84/49/332048449.db2.gz FQMDQIMUXBEEPO-GASCZTMLSA-N 1 3 266.473 3.617 20 0 CHADHO c1cc2c(cc1C[NH2+]C1CCN(CC3CC3)CC1)CCCC2 ZINC000490596961 332094302 /nfs/dbraw/zinc/09/43/02/332094302.db2.gz YIUJQBAIRKFKSB-UHFFFAOYSA-N 1 3 298.474 3.529 20 0 CHADHO C(C1CCCC1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000491060588 332143811 /nfs/dbraw/zinc/14/38/11/332143811.db2.gz LFDCSIOAVXUCRS-SFHVURJKSA-N 1 3 278.484 3.765 20 0 CHADHO C(C1CCCC1)[N@H+]1CCC[C@@H](CN2CCCCCC2)C1 ZINC000491060588 332143812 /nfs/dbraw/zinc/14/38/12/332143812.db2.gz LFDCSIOAVXUCRS-SFHVURJKSA-N 1 3 278.484 3.765 20 0 CHADHO C(C1CCCC1)[N@@H+]1CCC[C@@H](CN2CCCCCC2)C1 ZINC000491060588 332143813 /nfs/dbraw/zinc/14/38/13/332143813.db2.gz LFDCSIOAVXUCRS-SFHVURJKSA-N 1 3 278.484 3.765 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)CCC(C)(C)C)CN1CCCC1 ZINC000310892980 333062409 /nfs/dbraw/zinc/06/24/09/333062409.db2.gz YVDQPWCDNQXAPC-GJZGRUSLSA-N 1 3 254.462 3.523 20 0 CHADHO CC[NH+](CC)CCCN1CC[C@H](c2ccccc2)[C@@H]1C ZINC000514077358 333065101 /nfs/dbraw/zinc/06/51/01/333065101.db2.gz PSZOSIALXXLHOR-WMZOPIPTSA-N 1 3 274.452 3.596 20 0 CHADHO CCN(CC)CCC[N@@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC000514077358 333065102 /nfs/dbraw/zinc/06/51/02/333065102.db2.gz PSZOSIALXXLHOR-WMZOPIPTSA-N 1 3 274.452 3.596 20 0 CHADHO CCN(CC)CCC[N@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC000514077358 333065103 /nfs/dbraw/zinc/06/51/03/333065103.db2.gz PSZOSIALXXLHOR-WMZOPIPTSA-N 1 3 274.452 3.596 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@@H]2NC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000186104815 333155121 /nfs/dbraw/zinc/15/51/21/333155121.db2.gz XWMDNTQVDOHRPN-APWZRJJASA-N 1 3 298.474 3.755 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@@H]2NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000186104815 333155123 /nfs/dbraw/zinc/15/51/23/333155123.db2.gz XWMDNTQVDOHRPN-APWZRJJASA-N 1 3 298.474 3.755 20 0 CHADHO C/C(=C/c1ccccc1)C[NH2+]Cc1ccc(CN(C)C)cc1 ZINC000521821023 333190346 /nfs/dbraw/zinc/19/03/46/333190346.db2.gz TYSDQMGLVUPUIB-LGMDPLHJSA-N 1 3 294.442 3.941 20 0 CHADHO C[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)c1cccc(C(F)(F)F)c1 ZINC000222947969 333202864 /nfs/dbraw/zinc/20/28/64/333202864.db2.gz MKFOVKFKLLIALN-GDLCADMTSA-N 1 3 286.341 3.626 20 0 CHADHO C[C@H](CCc1ccccc1)N[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227535437 333285246 /nfs/dbraw/zinc/28/52/46/333285246.db2.gz WURXXCRRAWZQEW-NIKGAXFTSA-N 1 3 280.415 3.742 20 0 CHADHO C[C@H](CN[C@@H]1C[C@@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000227535416 333285296 /nfs/dbraw/zinc/28/52/96/333285296.db2.gz QWNBHUWNJIZEIK-FSPWUOQZSA-N 1 3 266.388 3.525 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CC[C@@H]([C@H](C)[NH3+])C2)cc1 ZINC000228150296 333295646 /nfs/dbraw/zinc/29/56/46/333295646.db2.gz WOYVXELLERAPPO-GRDNDAEWSA-N 1 3 260.425 3.540 20 0 CHADHO c1cc2c(s1)CCC[C@@H]2N[C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000250172410 333303130 /nfs/dbraw/zinc/30/31/30/333303130.db2.gz MJXZEOSNXMFYOX-XZDPQHSOSA-N 1 3 290.476 3.636 20 0 CHADHO CC1(C[NH2+]C2CCN(c3ccncc3)CC2)CCCCC1 ZINC000232874053 333344659 /nfs/dbraw/zinc/34/46/59/333344659.db2.gz PVJYWVLTSGPASL-UHFFFAOYSA-N 1 3 287.451 3.610 20 0 CHADHO C[C@H]1CC(C)(C)C[C@@H]1[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000235586193 333370908 /nfs/dbraw/zinc/37/09/08/333370908.db2.gz IAFRWLKTRUUBAS-JSGCOSHPSA-N 1 3 266.473 3.710 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC[C@H]1CCCC1(C)C ZINC000530210031 333528089 /nfs/dbraw/zinc/52/80/89/333528089.db2.gz KIQYKIGUNISUKF-DZGCQCFKSA-N 1 3 289.467 3.716 20 0 CHADHO C1=CC[C@H](CC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCCN2)CC1 ZINC000530217473 333528594 /nfs/dbraw/zinc/52/85/94/333528594.db2.gz HAFYDKBGUFCUQC-BSDSXHPESA-N 1 3 276.468 3.633 20 0 CHADHO C[C@H]([NH2+]CC1CCN(C)CC1)c1cc2c(s1)CCCC2 ZINC000126260547 333595606 /nfs/dbraw/zinc/59/56/06/333595606.db2.gz BCULKTCNSMFFMQ-ZDUSSCGKSA-N 1 3 292.492 3.619 20 0 CHADHO C[C@@H](N[C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000546166154 334017774 /nfs/dbraw/zinc/01/77/74/334017774.db2.gz HMAVMKMHARSIKG-CLCXKQKWSA-N 1 3 286.463 3.699 20 0 CHADHO C[C@@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc2c(c1)CCCC2 ZINC000546166154 334017776 /nfs/dbraw/zinc/01/77/76/334017776.db2.gz HMAVMKMHARSIKG-CLCXKQKWSA-N 1 3 286.463 3.699 20 0 CHADHO CC1=CCC[C@@H](C)[C@H]1C[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000134014711 334077300 /nfs/dbraw/zinc/07/73/00/334077300.db2.gz JXCXAJMUPYGMHK-WBVHZDCISA-N 1 3 278.484 3.831 20 0 CHADHO C[C@H](Cc1ccccc1F)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000134111252 334080582 /nfs/dbraw/zinc/08/05/82/334080582.db2.gz WYAQHKXYSNOXGA-CYBMUJFWSA-N 1 3 292.442 3.656 20 0 CHADHO C[C@H](Cc1ccccc1F)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000134111252 334080584 /nfs/dbraw/zinc/08/05/84/334080584.db2.gz WYAQHKXYSNOXGA-CYBMUJFWSA-N 1 3 292.442 3.656 20 0 CHADHO CC[C@H](C[NH2+]CCCN(CC)CC)c1ccccc1 ZINC000135610044 334134506 /nfs/dbraw/zinc/13/45/06/334134506.db2.gz FMDCFARBOALJGW-MRXNPFEDSA-N 1 3 262.441 3.502 20 0 CHADHO CC1(C)CCC([NH2+]C2CC(C)(C)NC(C)(C)C2)CC1 ZINC000079620504 334158294 /nfs/dbraw/zinc/15/82/94/334158294.db2.gz SIFYFKZPBSQSQA-UHFFFAOYSA-N 1 3 266.473 3.854 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN([C@H]2CCCc3ccccc32)C1 ZINC000245427146 334192011 /nfs/dbraw/zinc/19/20/11/334192011.db2.gz LVRADUGFSNRJIX-APWZRJJASA-N 1 3 286.463 3.728 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN([C@H]2CCCc3ccccc32)C1 ZINC000245427146 334192012 /nfs/dbraw/zinc/19/20/12/334192012.db2.gz LVRADUGFSNRJIX-APWZRJJASA-N 1 3 286.463 3.728 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+]([C@H]2CCCc3ccccc32)C1 ZINC000245427146 334192013 /nfs/dbraw/zinc/19/20/13/334192013.db2.gz LVRADUGFSNRJIX-APWZRJJASA-N 1 3 286.463 3.728 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+]([C@H]2CCCc3ccccc32)C1 ZINC000245427146 334192014 /nfs/dbraw/zinc/19/20/14/334192014.db2.gz LVRADUGFSNRJIX-APWZRJJASA-N 1 3 286.463 3.728 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2[N@@H+]1CC[C@@H](CN2CCCCC2)C1 ZINC000245433129 334192734 /nfs/dbraw/zinc/19/27/34/334192734.db2.gz BSBSADLMZWLCMY-PXNSSMCTSA-N 1 3 298.474 3.872 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2[N@H+]1CC[C@@H](CN2CCCCC2)C1 ZINC000245433129 334192735 /nfs/dbraw/zinc/19/27/35/334192735.db2.gz BSBSADLMZWLCMY-PXNSSMCTSA-N 1 3 298.474 3.872 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2N1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000245433129 334192736 /nfs/dbraw/zinc/19/27/36/334192736.db2.gz BSBSADLMZWLCMY-PXNSSMCTSA-N 1 3 298.474 3.872 20 0 CHADHO C[N@H+](CC1CC1)C[C@H]1CCN([C@@H]2C=CCCCCC2)C1 ZINC000549464463 334194591 /nfs/dbraw/zinc/19/45/91/334194591.db2.gz CNLFKFZFGUWNIU-QZTJIDSGSA-N 1 3 276.468 3.539 20 0 CHADHO C[N@@H+](CC1CC1)C[C@H]1CCN([C@@H]2C=CCCCCC2)C1 ZINC000549464463 334194593 /nfs/dbraw/zinc/19/45/93/334194593.db2.gz CNLFKFZFGUWNIU-QZTJIDSGSA-N 1 3 276.468 3.539 20 0 CHADHO CN(CC1CC1)C[C@H]1CC[N@@H+]([C@@H]2C=CCCCCC2)C1 ZINC000549464463 334194594 /nfs/dbraw/zinc/19/45/94/334194594.db2.gz CNLFKFZFGUWNIU-QZTJIDSGSA-N 1 3 276.468 3.539 20 0 CHADHO CN(CC1CC1)C[C@H]1CC[N@H+]([C@@H]2C=CCCCCC2)C1 ZINC000549464463 334194595 /nfs/dbraw/zinc/19/45/95/334194595.db2.gz CNLFKFZFGUWNIU-QZTJIDSGSA-N 1 3 276.468 3.539 20 0 CHADHO C[C@@H](NCCC[NH+](C)C)c1ccc(F)c2ccccc21 ZINC000550994919 334235771 /nfs/dbraw/zinc/23/57/71/334235771.db2.gz WHHRZRQMEBMFCA-CYBMUJFWSA-N 1 3 274.383 3.581 20 0 CHADHO CC(C)C1([NH2+]C2CCN([C@@H]3CCC[C@@H](C)C3)CC2)CC1 ZINC000551263337 334243323 /nfs/dbraw/zinc/24/33/23/334243323.db2.gz PWPVXRDJNVZETL-NVXWUHKLSA-N 1 3 278.484 3.808 20 0 CHADHO CCc1ccc([C@@H](C)NCCCCC[NH+]2CCCC2)o1 ZINC000551263494 334243609 /nfs/dbraw/zinc/24/36/09/334243609.db2.gz ROUQALNAUGKHGB-OAHLLOKOSA-N 1 3 278.440 3.759 20 0 CHADHO CC(C)[C@@H]1CC[C@H]1NCCC[NH+](C(C)C)C(C)C ZINC000552046540 334281142 /nfs/dbraw/zinc/28/11/42/334281142.db2.gz KEWFJFUNLRRMNY-JKSUJKDBSA-N 1 3 254.462 3.520 20 0 CHADHO CC(C)[C@@H]1CC[C@H]1[NH2+]CCCN(C(C)C)C(C)C ZINC000552046540 334281143 /nfs/dbraw/zinc/28/11/43/334281143.db2.gz KEWFJFUNLRRMNY-JKSUJKDBSA-N 1 3 254.462 3.520 20 0 CHADHO C[C@H](CC[N@@H+]1CC[C@H]2[C@H](CCCN2C)C1)c1ccccc1 ZINC000248744295 334315694 /nfs/dbraw/zinc/31/56/94/334315694.db2.gz AQUZMLVODMBMNT-QRQLOZEOSA-N 1 3 286.463 3.596 20 0 CHADHO C[C@H](CC[N@H+]1CC[C@H]2[C@H](CCCN2C)C1)c1ccccc1 ZINC000248744295 334315695 /nfs/dbraw/zinc/31/56/95/334315695.db2.gz AQUZMLVODMBMNT-QRQLOZEOSA-N 1 3 286.463 3.596 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)N1CCC[C@@H]([C@H](C)[NH3+])C1 ZINC000251529307 334363467 /nfs/dbraw/zinc/36/34/67/334363467.db2.gz MLSPGLUPEYHFHD-QMTMVMCOSA-N 1 3 282.431 3.960 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](C)c2ccc(C(C)(C)C)cc2)C1 ZINC000252439656 334380061 /nfs/dbraw/zinc/38/00/61/334380061.db2.gz RENKKHDIGMNJHX-CVEARBPZSA-N 1 3 288.479 3.977 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](C)c2ccc(C(C)(C)C)cc2)C1 ZINC000252439656 334380064 /nfs/dbraw/zinc/38/00/64/334380064.db2.gz RENKKHDIGMNJHX-CVEARBPZSA-N 1 3 288.479 3.977 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](C)c2ccc(C(C)(C)C)cc2)C1 ZINC000252439656 334380065 /nfs/dbraw/zinc/38/00/65/334380065.db2.gz RENKKHDIGMNJHX-CVEARBPZSA-N 1 3 288.479 3.977 20 0 CHADHO CCCC1CCC([NH2+][C@H]2CCN3CCC[C@H]3C2)CC1 ZINC000252675000 334385187 /nfs/dbraw/zinc/38/51/87/334385187.db2.gz WPAMHESSDJMMPT-GQGLESIBSA-N 1 3 264.457 3.562 20 0 CHADHO C[C@@H](CC1CC1)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000164277007 334879457 /nfs/dbraw/zinc/87/94/57/334879457.db2.gz NYVNZFZMBJYFPB-AWEZNQCLSA-N 1 3 264.457 3.562 20 0 CHADHO CC(C)[C@@H]1CC[C@@H]1[NH2+]C1CCN(CC2CCCC2)CC1 ZINC000572906779 334890104 /nfs/dbraw/zinc/89/01/04/334890104.db2.gz IYZYRGDGCWOPPJ-ROUUACIJSA-N 1 3 278.484 3.665 20 0 CHADHO CCC[C@H](Cc1ccccc1)[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000576692830 335235333 /nfs/dbraw/zinc/23/53/33/335235333.db2.gz LEINXIPPGXMXGV-RTBURBONSA-N 1 3 288.479 3.718 20 0 CHADHO C[C@H](N[C@@H]1CCCC[C@@H]1C[NH3+])c1ccc(Cl)c(F)c1 ZINC000577481856 335357104 /nfs/dbraw/zinc/35/71/04/335357104.db2.gz HMXYCRQJFSRBRK-JVLSTEMRSA-N 1 3 284.806 3.647 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]CC1(c2ccccc2)CCCCC1 ZINC000577499442 335359894 /nfs/dbraw/zinc/35/98/94/335359894.db2.gz JSNZGHXRYNNNGR-JKSUJKDBSA-N 1 3 274.452 3.604 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCC1(c2ccccc2)CCCCC1 ZINC000577499442 335359895 /nfs/dbraw/zinc/35/98/95/335359895.db2.gz JSNZGHXRYNNNGR-JKSUJKDBSA-N 1 3 274.452 3.604 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CCC2=CCCCC2)CC1 ZINC000178027739 335408732 /nfs/dbraw/zinc/40/87/32/335408732.db2.gz CTDGTACMYYRLKG-UHFFFAOYSA-N 1 3 264.457 3.729 20 0 CHADHO CCC[NH+]1CCC(CN[C@H](C)c2cccc(F)c2F)CC1 ZINC000183257756 335883402 /nfs/dbraw/zinc/88/34/02/335883402.db2.gz MOAFFFSEXMEFTB-CYBMUJFWSA-N 1 3 296.405 3.737 20 0 CHADHO CC[C@H]([NH2+]CCCN1CCC(C)CC1)c1ccsc1 ZINC000382102554 336081742 /nfs/dbraw/zinc/08/17/42/336081742.db2.gz JJJHONDXKMCKPZ-INIZCTEOSA-N 1 3 280.481 3.911 20 0 CHADHO CSCC1CCC(N[C@@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC000385349142 336144729 /nfs/dbraw/zinc/14/47/29/336144729.db2.gz ZYXHZAQVXMZDOF-DNDXXGFKSA-N 1 3 290.476 3.643 20 0 CHADHO CC(C)[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC000036967531 519798774 /nfs/dbraw/zinc/79/87/74/519798774.db2.gz JUKGSLQGCCQLDH-HQSKLWIPSA-N 1 3 272.436 3.599 20 0 CHADHO CC(C)[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC000036967531 519798775 /nfs/dbraw/zinc/79/87/75/519798775.db2.gz JUKGSLQGCCQLDH-HQSKLWIPSA-N 1 3 272.436 3.599 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H](CC)c2ccc(F)cc2)C1 ZINC000151132670 519863913 /nfs/dbraw/zinc/86/39/13/519863913.db2.gz GWGZSWRBERPTLQ-PBHICJAKSA-N 1 3 278.415 3.598 20 0 CHADHO CN(C)Cc1ccc(C[NH2+][C@H]2CCC[C@@H]2CCCF)cc1 ZINC000337988937 521906673 /nfs/dbraw/zinc/90/66/73/521906673.db2.gz YNNIRXYPGWWIKG-MSOLQXFVSA-N 1 3 292.442 3.756 20 0 CHADHO CC[C@H](NCC1CC[NH+](C2CC2)CC1)c1ccccc1F ZINC000278449593 522578033 /nfs/dbraw/zinc/57/80/33/522578033.db2.gz LIOYNVHXQGSEDM-SFHVURJKSA-N 1 3 290.426 3.741 20 0 CHADHO CC[C@@H](NCC[C@@H]1CCCC[N@@H+]1C)c1ccccc1 ZINC000052206357 522840366 /nfs/dbraw/zinc/84/03/66/522840366.db2.gz SAKWQDYGKWTFJR-DLBZAZTESA-N 1 3 260.425 3.602 20 0 CHADHO CC[C@@H](NCC[C@@H]1CCCC[N@H+]1C)c1ccccc1 ZINC000052206357 522840373 /nfs/dbraw/zinc/84/03/73/522840373.db2.gz SAKWQDYGKWTFJR-DLBZAZTESA-N 1 3 260.425 3.602 20 0 CHADHO CC[C@H](c1ccccc1)[N@@H+]1CCC[C@@H](N(C)C)CC1 ZINC000277099010 522943934 /nfs/dbraw/zinc/94/39/34/522943934.db2.gz GIZWALAZHMFSLN-IAGOWNOFSA-N 1 3 260.425 3.554 20 0 CHADHO CC[C@H](c1ccccc1)[N@H+]1CCC[C@@H](N(C)C)CC1 ZINC000277099010 522943951 /nfs/dbraw/zinc/94/39/51/522943951.db2.gz GIZWALAZHMFSLN-IAGOWNOFSA-N 1 3 260.425 3.554 20 0 CHADHO CC[C@H](c1ccccc1)N1CCC[C@@H]([NH+](C)C)CC1 ZINC000277099010 522943955 /nfs/dbraw/zinc/94/39/55/522943955.db2.gz GIZWALAZHMFSLN-IAGOWNOFSA-N 1 3 260.425 3.554 20 0 CHADHO CC[C@@H]1CCC[C@H]([NH2+]C2CCN(c3ccncc3)CC2)C1 ZINC000068591785 523305309 /nfs/dbraw/zinc/30/53/09/523305309.db2.gz KUQATEJTLOYYMF-WBVHZDCISA-N 1 3 287.451 3.609 20 0 CHADHO Cc1cc(C)cc(C[NH2+]C2CCN(C(C)(C)C)CC2)c1 ZINC000043393673 524383363 /nfs/dbraw/zinc/38/33/63/524383363.db2.gz VADHZPFLQIFLOW-UHFFFAOYSA-N 1 3 274.452 3.656 20 0 CHADHO Cc1cccc(C[NH2+]C2CCN(C(C)(C)C)CC2)c1C ZINC000042243911 524430423 /nfs/dbraw/zinc/43/04/23/524430423.db2.gz SXSAAILFCFGCRS-UHFFFAOYSA-N 1 3 274.452 3.656 20 0 CHADHO C[C@H](NCC1CC[NH+](C2CC2)CC1)c1csc(Cl)c1 ZINC000278557240 525324393 /nfs/dbraw/zinc/32/43/93/525324393.db2.gz WINVPWDIKBZZNR-NSHDSACASA-N 1 3 298.883 3.927 20 0 CHADHO C[C@@H](NC1CC[NH+](C2CC2)CC1)c1cccc(Cl)c1 ZINC000037140883 525401568 /nfs/dbraw/zinc/40/15/68/525401568.db2.gz YVKAAXWNHBRWHO-GFCCVEGCSA-N 1 3 278.827 3.617 20 0 CHADHO C[C@H](N[C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc2ccccc2c1 ZINC000093978078 525616678 /nfs/dbraw/zinc/61/66/78/525616678.db2.gz ZCEYHYFIYXPBTR-VCBZYWHSSA-N 1 3 282.431 3.973 20 0 CHADHO C[C@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc2ccccc2c1 ZINC000093978078 525616687 /nfs/dbraw/zinc/61/66/87/525616687.db2.gz ZCEYHYFIYXPBTR-VCBZYWHSSA-N 1 3 282.431 3.973 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]C2CCN(c3ccncc3)CC2)cc1 ZINC000298444641 525722011 /nfs/dbraw/zinc/72/20/11/525722011.db2.gz NSASRSLDSGIZDF-MRXNPFEDSA-N 1 3 295.430 3.710 20 0 CHADHO Cc1ccc([C@H](NC[C@H]2CC[N@@H+](C3CC3)C2)C2CC2)cc1 ZINC000037648849 525970669 /nfs/dbraw/zinc/97/06/69/525970669.db2.gz UODNGVXQSFUFQB-BEFAXECRSA-N 1 3 284.447 3.520 20 0 CHADHO Cc1ccc([C@H](NC[C@H]2CC[N@H+](C3CC3)C2)C2CC2)cc1 ZINC000037648849 525970680 /nfs/dbraw/zinc/97/06/80/525970680.db2.gz UODNGVXQSFUFQB-BEFAXECRSA-N 1 3 284.447 3.520 20 0 CHADHO Clc1ccc(C[NH2+]C[C@@H]2CCN(C3CC3)C2)cc1Cl ZINC000037408190 526948963 /nfs/dbraw/zinc/94/89/63/526948963.db2.gz ZDNIGEUVBALAAV-LBPRGKRZSA-N 1 3 299.245 3.567 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](CCC(C)C)c2ccoc2)C1 ZINC000353437153 527745065 /nfs/dbraw/zinc/74/50/65/527745065.db2.gz DGNSHRISKWBOKU-RDJZCZTQSA-N 1 3 278.440 3.688 20 0 CHADHO CC[N@@H+]1CC[C@H](N[C@@H]2CCCc3ccc(C)cc32)[C@@H](C)C1 ZINC000352611845 527885748 /nfs/dbraw/zinc/88/57/48/527885748.db2.gz KNWOXNDLGGOMIV-ZYSHUDEJSA-N 1 3 286.463 3.692 20 0 CHADHO CC[N@H+]1CC[C@H](N[C@@H]2CCCc3ccc(C)cc32)[C@@H](C)C1 ZINC000352611845 527885750 /nfs/dbraw/zinc/88/57/50/527885750.db2.gz KNWOXNDLGGOMIV-ZYSHUDEJSA-N 1 3 286.463 3.692 20 0 CHADHO CC[N@@H+]1CC[C@H](N[C@@H]2CCCc3ccc(C)cc32)[C@H](C)C1 ZINC000352611842 527886816 /nfs/dbraw/zinc/88/68/16/527886816.db2.gz KNWOXNDLGGOMIV-AYOQOUSVSA-N 1 3 286.463 3.692 20 0 CHADHO CC[N@H+]1CC[C@H](N[C@@H]2CCCc3ccc(C)cc32)[C@H](C)C1 ZINC000352611842 527886821 /nfs/dbraw/zinc/88/68/21/527886821.db2.gz KNWOXNDLGGOMIV-AYOQOUSVSA-N 1 3 286.463 3.692 20 0 CHADHO CCC[N@H+](Cc1cc(C)c2ncccc2c1)C1CCNCC1 ZINC000347055893 528129963 /nfs/dbraw/zinc/12/99/63/528129963.db2.gz UTKJUFZVPBXUKE-UHFFFAOYSA-N 1 3 297.446 3.507 20 0 CHADHO CCC[N@@H+](Cc1cc(C)c2ncccc2c1)C1CCNCC1 ZINC000347055893 528129970 /nfs/dbraw/zinc/12/99/70/528129970.db2.gz UTKJUFZVPBXUKE-UHFFFAOYSA-N 1 3 297.446 3.507 20 0 CHADHO CCCN(Cc1cc(C)c2ncccc2c1)C1CC[NH2+]CC1 ZINC000347055893 528129975 /nfs/dbraw/zinc/12/99/75/528129975.db2.gz UTKJUFZVPBXUKE-UHFFFAOYSA-N 1 3 297.446 3.507 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H]2CC(C)(C)C[C@H]2C)C1 ZINC000193130940 529015445 /nfs/dbraw/zinc/01/54/45/529015445.db2.gz LSBLBWSLDWCSGE-OWCLPIDISA-N 1 3 266.473 3.521 20 0 CHADHO CC(C)(C)[C@@H](N[C@H]1CCC[NH2+]CC1)c1ccc(F)cc1 ZINC000133708382 1125485331 /nfs/dbraw/zinc/48/53/31/1125485331.db2.gz WLLMIFQYWJMMSC-HOTGVXAUSA-N 1 3 278.415 3.645 20 0 CHADHO CC[C@@H]([NH2+]C1CCN(CC(C)C)CC1)c1ccc(F)cc1 ZINC000131223492 1125491475 /nfs/dbraw/zinc/49/14/75/1125491475.db2.gz WJEHVPHHDSVXKJ-GOSISDBHSA-N 1 3 292.442 3.987 20 0 CHADHO CC(C)CC(CC(C)C)[NH2+][C@H]1CCC[C@H](N(C)C)C1 ZINC000715543405 1120110755 /nfs/dbraw/zinc/11/07/55/1120110755.db2.gz NEQLVWYUUWIMBT-RDJZCZTQSA-N 1 3 268.489 3.910 20 0 CHADHO C[C@H](CC[NH2+][C@@H](C)c1cccs1)N1CCCCC1 ZINC000184501334 1120357206 /nfs/dbraw/zinc/35/72/06/1120357206.db2.gz GDCNQMSIZUSDBP-KGLIPLIRSA-N 1 3 266.454 3.663 20 0 CHADHO Cc1cc2c(cc1C)[C@H](NCCC(C)(C)[NH3+])CCS2 ZINC000925737367 1120849284 /nfs/dbraw/zinc/84/92/84/1120849284.db2.gz HQTYNGVYAHLWKE-CQSZACIVSA-N 1 3 278.465 3.557 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)C[C@@H]2CCCCC2(F)F)C[C@@H]1C ZINC000450471563 1125038804 /nfs/dbraw/zinc/03/88/04/1125038804.db2.gz WFYGGSOBCWDXMJ-KKUMJFAQSA-N 1 3 288.426 3.617 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN(CCC2=CCCCC2)C1 ZINC000450464174 1125036212 /nfs/dbraw/zinc/03/62/12/1125036212.db2.gz WNEDQDLTTKYXKC-KRWDZBQOSA-N 1 3 264.457 3.541 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN(CCC2=CCCCC2)C1 ZINC000450464174 1125036219 /nfs/dbraw/zinc/03/62/19/1125036219.db2.gz WNEDQDLTTKYXKC-KRWDZBQOSA-N 1 3 264.457 3.541 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+](CCC2=CCCCC2)C1 ZINC000450464174 1125036229 /nfs/dbraw/zinc/03/62/29/1125036229.db2.gz WNEDQDLTTKYXKC-KRWDZBQOSA-N 1 3 264.457 3.541 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+](CCC2=CCCCC2)C1 ZINC000450464174 1125036234 /nfs/dbraw/zinc/03/62/34/1125036234.db2.gz WNEDQDLTTKYXKC-KRWDZBQOSA-N 1 3 264.457 3.541 20 0 CHADHO CCCC[C@H]1C[C@H]([NH+]2CCC(C(C)C)CC2)CCN1 ZINC001246843479 1131788654 /nfs/dbraw/zinc/78/86/54/1131788654.db2.gz CSMFLXZXOGCQNT-DLBZAZTESA-N 1 3 266.473 3.665 20 0 CHADHO CCC(CC)C[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001171614380 1132064802 /nfs/dbraw/zinc/06/48/02/1132064802.db2.gz YPCBTKNWUZYOSE-UHFFFAOYSA-N 1 3 254.462 3.664 20 0 CHADHO CCCC[C@H](CC(C)C)[NH+]1C[C@@H]2CN(CCC)C[C@H]2C1 ZINC001173259088 1132427720 /nfs/dbraw/zinc/42/77/20/1132427720.db2.gz FMQYMULNCJAZFP-OKZBNKHCSA-N 1 3 280.500 3.865 20 0 CHADHO C[C@H]([NH2+]CC[C@@H]1C[C@H]1C1CC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000886127958 1125654200 /nfs/dbraw/zinc/65/42/00/1125654200.db2.gz YOFYJRLVWKIOFF-WFEDQXDTSA-N 1 3 290.495 3.665 20 0 CHADHO CC[N@H+](CC[C@@H]1CCCN1C)Cc1ccc(Cl)cc1 ZINC000348041583 1129276349 /nfs/dbraw/zinc/27/63/49/1129276349.db2.gz HVUZBLDYKZSTOW-INIZCTEOSA-N 1 3 280.843 3.646 20 0 CHADHO CC[N@@H+](CC[C@@H]1CCCN1C)Cc1ccc(Cl)cc1 ZINC000348041583 1129276352 /nfs/dbraw/zinc/27/63/52/1129276352.db2.gz HVUZBLDYKZSTOW-INIZCTEOSA-N 1 3 280.843 3.646 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](NCc2cc(-c3ccccc3)cs2)C1 ZINC000414933421 1129206106 /nfs/dbraw/zinc/20/61/06/1129206106.db2.gz WWNRUBAJVLJXEM-CVEARBPZSA-N 1 3 286.444 3.775 20 0 CHADHO C[NH+](C)Cc1ccc(CN[C@H]2CCc3c2cccc3F)cc1 ZINC000338238820 1126726426 /nfs/dbraw/zinc/72/64/26/1126726426.db2.gz ONBKZMMQZUCVBT-IBGZPJMESA-N 1 3 298.405 3.664 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@@H]2CC[N@@H+](C)C[C@@H]2C)c1C ZINC000482330897 1126751204 /nfs/dbraw/zinc/75/12/04/1126751204.db2.gz JCTTXEGTVKHEGL-SCLBCKFNSA-N 1 3 299.462 3.523 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@@H]2CC[N@H+](C)C[C@@H]2C)c1C ZINC000482330897 1126751209 /nfs/dbraw/zinc/75/12/09/1126751209.db2.gz JCTTXEGTVKHEGL-SCLBCKFNSA-N 1 3 299.462 3.523 20 0 CHADHO CC(C)[C@@H]1C[C@H](N[C@@H](C)C[C@H](C)[NH3+])c2ccccc21 ZINC000629532221 1126756549 /nfs/dbraw/zinc/75/65/49/1126756549.db2.gz RMNTUERPGLUAFA-PYTWLRIVSA-N 1 3 260.425 3.586 20 0 CHADHO CCc1ccc([C@@H](C)[NH2+][C@@H](CCN(C)C)C(C)(C)C)o1 ZINC000483158466 1126770480 /nfs/dbraw/zinc/77/04/80/1126770480.db2.gz UQGDJDWUOSDTHO-CJNGLKHVSA-N 1 3 280.456 3.859 20 0 CHADHO COc1ccc([C@H](C)N[C@H](CC[NH+](C)C)C(C)(C)C)cc1 ZINC000483200955 1126772367 /nfs/dbraw/zinc/77/23/67/1126772367.db2.gz OBUSFUKKKBVYDA-WMLDXEAASA-N 1 3 292.467 3.712 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1cccc(Cl)c1 ZINC000484500317 1126821833 /nfs/dbraw/zinc/82/18/33/1126821833.db2.gz KOSGRLNHCKKOOT-VBNZEHGJSA-N 1 3 280.843 3.863 20 0 CHADHO [NH3+][C@H]1C[C@@H](CN(Cc2ccccc2)Cc2ccccc2F)C1 ZINC000904309480 1126844317 /nfs/dbraw/zinc/84/43/17/1126844317.db2.gz LVGRFHJVORESLY-MAEOIBBWSA-N 1 3 298.405 3.565 20 0 CHADHO CC[C@H](NC[C@@H]1CCC[N@H+](CC)C1)c1cccs1 ZINC001319754028 1126984271 /nfs/dbraw/zinc/98/42/71/1126984271.db2.gz IXLLSTPDILHRDS-KBPBESRZSA-N 1 3 266.454 3.521 20 0 CHADHO CC[C@H](NC[C@@H]1CCC[N@@H+](CC)C1)c1cccs1 ZINC001319754028 1126984274 /nfs/dbraw/zinc/98/42/74/1126984274.db2.gz IXLLSTPDILHRDS-KBPBESRZSA-N 1 3 266.454 3.521 20 0 CHADHO C[C@@H]([NH2+]C1CCN(CC2CC2)CC1)c1ccc(Cl)cc1 ZINC000268734995 1127021962 /nfs/dbraw/zinc/02/19/62/1127021962.db2.gz VMPSEMPRVUDKBW-CYBMUJFWSA-N 1 3 292.854 3.865 20 0 CHADHO CC[C@@H](NC1CC[NH+](C2CCC2)CC1)c1ccccc1 ZINC000268997241 1127031571 /nfs/dbraw/zinc/03/15/71/1127031571.db2.gz KXJOWLXXOYTDGL-GOSISDBHSA-N 1 3 272.436 3.744 20 0 CHADHO Fc1ccc(C[NH2+]C2CCN(C3CCC3)CC2)cc1Cl ZINC000270274948 1127052848 /nfs/dbraw/zinc/05/28/48/1127052848.db2.gz WYNCYVQAMCQBNB-UHFFFAOYSA-N 1 3 296.817 3.586 20 0 CHADHO CCCN(CCC[NH+](C)C)Cc1cc(C)c2ncccc2c1 ZINC000349404123 1127150347 /nfs/dbraw/zinc/15/03/47/1127150347.db2.gz FBQLAMVVTMKTAX-UHFFFAOYSA-N 1 3 299.462 3.707 20 0 CHADHO CN1CCCC[C@H]1CC[NH+]1CCC2(CCCC2)CC1 ZINC000351403198 1127188971 /nfs/dbraw/zinc/18/89/71/1127188971.db2.gz BVRRJKQPXJOEFM-INIZCTEOSA-N 1 3 264.457 3.517 20 0 CHADHO CCN(CC)CCC[N@@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000351490636 1127190019 /nfs/dbraw/zinc/19/00/19/1127190019.db2.gz GLDHBZSUCAPTOX-KRWDZBQOSA-N 1 3 264.457 3.541 20 0 CHADHO CCN(CC)CCC[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000351490636 1127190022 /nfs/dbraw/zinc/19/00/22/1127190022.db2.gz GLDHBZSUCAPTOX-KRWDZBQOSA-N 1 3 264.457 3.541 20 0 CHADHO CC[NH+](CC)CCCN1CCC[C@@]2(CC=CCC2)C1 ZINC000351490636 1127190023 /nfs/dbraw/zinc/19/00/23/1127190023.db2.gz GLDHBZSUCAPTOX-KRWDZBQOSA-N 1 3 264.457 3.541 20 0 CHADHO Cc1ccnc([C@@H](C)NCCCC[NH+]2CCC(C)CC2)c1 ZINC000285633446 1127240001 /nfs/dbraw/zinc/24/00/01/1127240001.db2.gz LLZPKCKYGADCCV-QGZVFWFLSA-N 1 3 289.467 3.553 20 0 CHADHO CSCc1ccc(C[NH2+]C2CCN(C(C)C)CC2)cc1 ZINC000285693725 1127240618 /nfs/dbraw/zinc/24/06/18/1127240618.db2.gz OHKHLPFNUQFZLR-UHFFFAOYSA-N 1 3 292.492 3.512 20 0 CHADHO Cc1ccc(C2=CC[N@H+](CC[C@@H]3CCCCN3C)CC2)cc1 ZINC000760804926 1127283091 /nfs/dbraw/zinc/28/30/91/1127283091.db2.gz GTDSPGAVZAQQJP-FQEVSTJZSA-N 1 3 298.474 3.959 20 0 CHADHO Cc1ccc(C2=CC[N@@H+](CC[C@@H]3CCCCN3C)CC2)cc1 ZINC000760804926 1127283093 /nfs/dbraw/zinc/28/30/93/1127283093.db2.gz GTDSPGAVZAQQJP-FQEVSTJZSA-N 1 3 298.474 3.959 20 0 CHADHO C[C@H]1C[C@@H](NC2CC[NH+](C3CCC3)CC2)c2ccccc21 ZINC000289221465 1127377665 /nfs/dbraw/zinc/37/76/65/1127377665.db2.gz LHGKUXFFZPJLRO-IFXJQAMLSA-N 1 3 284.447 3.841 20 0 CHADHO C[C@@H]1CCC[C@H]([NH+]2CCC(N[C@H]3CCCSC3)CC2)C1 ZINC000358780893 1127434157 /nfs/dbraw/zinc/43/41/57/1127434157.db2.gz YDBDJXCLSSDJEZ-PVAVHDDUSA-N 1 3 296.524 3.515 20 0 CHADHO C[C@@H]1CCC[C@H](N2CCC([NH2+][C@H]3CCCSC3)CC2)C1 ZINC000358780893 1127434158 /nfs/dbraw/zinc/43/41/58/1127434158.db2.gz YDBDJXCLSSDJEZ-PVAVHDDUSA-N 1 3 296.524 3.515 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1N[C@H]1CCCc2ccc(F)cc21 ZINC000359031667 1127445583 /nfs/dbraw/zinc/44/55/83/1127445583.db2.gz QCJRJQAEKILSNT-OSLDLMBLSA-N 1 3 290.426 3.521 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1N[C@H]1CCCc2ccc(F)cc21 ZINC000359031667 1127445584 /nfs/dbraw/zinc/44/55/84/1127445584.db2.gz QCJRJQAEKILSNT-OSLDLMBLSA-N 1 3 290.426 3.521 20 0 CHADHO CC(C)N1CCC([NH2+]Cc2ccc(C(C)(F)F)cc2)CC1 ZINC000293766630 1127518755 /nfs/dbraw/zinc/51/87/55/1127518755.db2.gz RSTBIQIKTQLPKA-UHFFFAOYSA-N 1 3 296.405 3.761 20 0 CHADHO c1cc(C2CCC2)ccc1CNC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000294117967 1127549933 /nfs/dbraw/zinc/54/99/33/1127549933.db2.gz NFHOSZIJRQNOIU-MRXNPFEDSA-N 1 3 284.447 3.528 20 0 CHADHO c1cc(C2CCC2)ccc1CNC[C@H]1CC[N@H+](C2CC2)C1 ZINC000294117967 1127549934 /nfs/dbraw/zinc/54/99/34/1127549934.db2.gz NFHOSZIJRQNOIU-MRXNPFEDSA-N 1 3 284.447 3.528 20 0 CHADHO c1cc(C2CCC2)ccc1C[NH2+]C[C@H]1CCN(C2CC2)C1 ZINC000294117967 1127549936 /nfs/dbraw/zinc/54/99/36/1127549936.db2.gz NFHOSZIJRQNOIU-MRXNPFEDSA-N 1 3 284.447 3.528 20 0 CHADHO c1cc(C2CCC2)ccc1CNC1CC[NH+](C2CC2)CC1 ZINC000294171603 1127554656 /nfs/dbraw/zinc/55/46/56/1127554656.db2.gz PWBYCCZIUJGHLC-UHFFFAOYSA-N 1 3 284.447 3.671 20 0 CHADHO CCC[C@H](N[C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccccc1 ZINC000361966639 1127603107 /nfs/dbraw/zinc/60/31/07/1127603107.db2.gz NPZOGVTYJZEGJH-KURKYZTESA-N 1 3 274.452 3.990 20 0 CHADHO CCC[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1ccccc1 ZINC000361966639 1127603109 /nfs/dbraw/zinc/60/31/09/1127603109.db2.gz NPZOGVTYJZEGJH-KURKYZTESA-N 1 3 274.452 3.990 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)c1ccc(F)cc1 ZINC000361967804 1127603139 /nfs/dbraw/zinc/60/31/39/1127603139.db2.gz MQSPIDFUJBYNIJ-IKGGRYGDSA-N 1 3 278.415 3.739 20 0 CHADHO C[C@@H]([NH2+]CCC(C)(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000295584952 1127647011 /nfs/dbraw/zinc/64/70/11/1127647011.db2.gz BQONSQKKPWLTJH-ZBFHGGJFSA-N 1 3 296.405 3.532 20 0 CHADHO Cc1cc([C@@H](C)[NH2+]C2CCN(CC3CC3)CC2)cs1 ZINC000295996511 1127659708 /nfs/dbraw/zinc/65/97/08/1127659708.db2.gz NZRLQCSHDADQJN-CYBMUJFWSA-N 1 3 278.465 3.582 20 0 CHADHO C[C@H](N[C@@H](CC[NH+](C)C)C(C)(C)C)c1ccc(F)cc1 ZINC000604773716 1127715386 /nfs/dbraw/zinc/71/53/86/1127715386.db2.gz ZXWNNJHXHQEWCV-BBRMVZONSA-N 1 3 280.431 3.843 20 0 CHADHO CC[C@@H](c1ccc(F)cc1F)N1CCC(C[NH+](C)C)CC1 ZINC000606432845 1127761820 /nfs/dbraw/zinc/76/18/20/1127761820.db2.gz FNZSAXXIQNZHOT-KRWDZBQOSA-N 1 3 296.405 3.690 20 0 CHADHO FC(F)(F)CCC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000372781304 1127812272 /nfs/dbraw/zinc/81/22/72/1127812272.db2.gz MZMZJKSCOJPASG-UHFFFAOYSA-N 1 3 292.389 3.716 20 0 CHADHO CN1CCC[C@H]1CC[N@H+](C)CCc1cccc2ccccc21 ZINC000535472851 1127916749 /nfs/dbraw/zinc/91/67/49/1127916749.db2.gz UUGVKRMLISZRQT-IBGZPJMESA-N 1 3 296.458 3.798 20 0 CHADHO CN1CCC[C@H]1CC[N@@H+](C)CCc1cccc2ccccc21 ZINC000535472851 1127916753 /nfs/dbraw/zinc/91/67/53/1127916753.db2.gz UUGVKRMLISZRQT-IBGZPJMESA-N 1 3 296.458 3.798 20 0 CHADHO Cc1ccc(F)c(CN2CCC(CCC[NH+](C)C)CC2)c1 ZINC000539852219 1127949081 /nfs/dbraw/zinc/94/90/81/1127949081.db2.gz HVABJFOQDDRRIU-UHFFFAOYSA-N 1 3 292.442 3.688 20 0 CHADHO CCc1ccc([C@@H]([NH2+]C[C@H]2CCN(CC)C2)C(C)C)cc1 ZINC000540259195 1127971786 /nfs/dbraw/zinc/97/17/86/1127971786.db2.gz ONPUGBHIWUKNPA-MJGOQNOKSA-N 1 3 288.479 3.878 20 0 CHADHO CC(C)[C@H](NCCC[NH+](C)C)c1ccc(Cl)cc1 ZINC000540262227 1127972026 /nfs/dbraw/zinc/97/20/26/1127972026.db2.gz HTWPELYPVSEKJD-HNNXBMFYSA-N 1 3 268.832 3.578 20 0 CHADHO CC[C@@H]([NH2+]CC[C@@H]1CCCN1C)C(C)(C)c1ccccc1 ZINC000540526866 1127982421 /nfs/dbraw/zinc/98/24/21/1127982421.db2.gz YIASJNMVJGIUJH-ZWKOTPCHSA-N 1 3 288.479 3.817 20 0 CHADHO CC[N@H+](C)C[C@H]1CCN(CCCc2ccc(Cl)cc2)C1 ZINC000173898200 1128094270 /nfs/dbraw/zinc/09/42/70/1128094270.db2.gz RCJNGBGFLYLJKW-MRXNPFEDSA-N 1 3 294.870 3.546 20 0 CHADHO CC[N@@H+](C)C[C@H]1CCN(CCCc2ccc(Cl)cc2)C1 ZINC000173898200 1128094273 /nfs/dbraw/zinc/09/42/73/1128094273.db2.gz RCJNGBGFLYLJKW-MRXNPFEDSA-N 1 3 294.870 3.546 20 0 CHADHO CCN(C)C[C@H]1CC[N@H+](CCCc2ccc(Cl)cc2)C1 ZINC000173898200 1128094276 /nfs/dbraw/zinc/09/42/76/1128094276.db2.gz RCJNGBGFLYLJKW-MRXNPFEDSA-N 1 3 294.870 3.546 20 0 CHADHO CCN(C)C[C@H]1CC[N@@H+](CCCc2ccc(Cl)cc2)C1 ZINC000173898200 1128094278 /nfs/dbraw/zinc/09/42/78/1128094278.db2.gz RCJNGBGFLYLJKW-MRXNPFEDSA-N 1 3 294.870 3.546 20 0 CHADHO CC[NH+](CC)C[C@H]1CCN([C@@H]2CCCc3ccccc32)C1 ZINC000174211659 1128098118 /nfs/dbraw/zinc/09/81/18/1128098118.db2.gz NMNAUPQUMMLZGH-VQIMIIECSA-N 1 3 286.463 3.728 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)c1cc2ccccc2[nH]1 ZINC000925217452 1128125718 /nfs/dbraw/zinc/12/57/18/1128125718.db2.gz PCNWRVAHGADYDW-BPUTZDHNSA-N 1 3 285.435 3.691 20 0 CHADHO [NH3+]CCC[C@H](N[C@@H]1CCOc2ccccc21)c1ccccc1 ZINC000925510187 1128130424 /nfs/dbraw/zinc/13/04/24/1128130424.db2.gz UDDZTVAXESSBMF-ZWKOTPCHSA-N 1 3 296.414 3.580 20 0 CHADHO CCOc1ccccc1CN[C@@H](CCC[NH3+])c1ccccc1 ZINC000925493335 1128130747 /nfs/dbraw/zinc/13/07/47/1128130747.db2.gz KHMPNHVXQLBASQ-SFHVURJKSA-N 1 3 298.430 3.655 20 0 CHADHO C[C@@H](NCCC(C)(C)[NH3+])c1ccc(-c2ccncc2)cc1 ZINC000925742648 1128140353 /nfs/dbraw/zinc/14/03/53/1128140353.db2.gz WFFHYEYIJGYGOV-CQSZACIVSA-N 1 3 283.419 3.527 20 0 CHADHO CSC1CCC(CN[C@@H](c2ccccc2)[C@H](C)[NH3+])CC1 ZINC000925802288 1128142517 /nfs/dbraw/zinc/14/25/17/1128142517.db2.gz KYKJLPHWOKLZGS-VFNXUKNFSA-N 1 3 292.492 3.586 20 0 CHADHO CCCCCC[C@H](C)N1CCN(c2cc[nH+]cc2)CC1 ZINC001257363385 1128275402 /nfs/dbraw/zinc/27/54/02/1128275402.db2.gz NGHIMSBYANSIDP-INIZCTEOSA-N 1 3 275.440 3.563 20 0 CHADHO CCCCCC[C@H](C)[NH+]1CCN(c2ccncc2)CC1 ZINC001257363385 1128275406 /nfs/dbraw/zinc/27/54/06/1128275406.db2.gz NGHIMSBYANSIDP-INIZCTEOSA-N 1 3 275.440 3.563 20 0 CHADHO CC/C=C\CCCCC[N@@H+]1CCCC12CCNCC2 ZINC001235139894 1128304887 /nfs/dbraw/zinc/30/48/87/1128304887.db2.gz FDFXRWCYKCRDLF-ARJAWSKDSA-N 1 3 264.457 3.731 20 0 CHADHO CC/C=C\CCCCC[N@H+]1CCCC12CCNCC2 ZINC001235139894 1128304889 /nfs/dbraw/zinc/30/48/89/1128304889.db2.gz FDFXRWCYKCRDLF-ARJAWSKDSA-N 1 3 264.457 3.731 20 0 CHADHO C[C@@H]1C[C@@H](N[C@@H]2CCCc3c4ccccc4[nH]c32)CC[N@@H+]1C ZINC000316741945 1128335564 /nfs/dbraw/zinc/33/55/64/1128335564.db2.gz IARUVLWFJKZXKS-QWQRMKEZSA-N 1 3 297.446 3.618 20 0 CHADHO C[C@@H]1C[C@@H](N[C@@H]2CCCc3c4ccccc4[nH]c32)CC[N@H+]1C ZINC000316741945 1128335566 /nfs/dbraw/zinc/33/55/66/1128335566.db2.gz IARUVLWFJKZXKS-QWQRMKEZSA-N 1 3 297.446 3.618 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1)C(C)(C)C ZINC000670268946 1128380273 /nfs/dbraw/zinc/38/02/73/1128380273.db2.gz UKUGTSWUCKNPKG-HRCADAONSA-N 1 3 280.500 3.911 20 0 CHADHO CCC(C)(C)[C@H](C)[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000562778812 1128419882 /nfs/dbraw/zinc/41/98/82/1128419882.db2.gz JZABQJAHJFGSEO-LSDHHAIUSA-N 1 3 254.462 3.521 20 0 CHADHO CCC(C)(C)[C@H](C)[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000562778810 1128419925 /nfs/dbraw/zinc/41/99/25/1128419925.db2.gz JZABQJAHJFGSEO-GJZGRUSLSA-N 1 3 254.462 3.521 20 0 CHADHO Cc1cccc(CC[C@H](C)[NH2+]C[C@@H](C)CN2CCCC2)c1 ZINC000062079228 1128437372 /nfs/dbraw/zinc/43/73/72/1128437372.db2.gz RPRQWPCJSFATSY-MSOLQXFVSA-N 1 3 288.479 3.638 20 0 CHADHO CN(C)C1CC[NH+](C2c3ccccc3-c3ccccc32)CC1 ZINC000127887735 1128483881 /nfs/dbraw/zinc/48/38/81/1128483881.db2.gz TUDSTLXEVFQBFO-UHFFFAOYSA-N 1 3 292.426 3.782 20 0 CHADHO CC(C)Cc1cccc([C@@H](C)NC[C@H]2CCC[N@H+](C)C2)c1 ZINC000563904461 1128484137 /nfs/dbraw/zinc/48/41/37/1128484137.db2.gz YYZPUCULLKLRSZ-SJLPKXTDSA-N 1 3 288.479 3.878 20 0 CHADHO CC(C)Cc1cccc([C@@H](C)NC[C@H]2CCC[N@@H+](C)C2)c1 ZINC000563904461 1128484141 /nfs/dbraw/zinc/48/41/41/1128484141.db2.gz YYZPUCULLKLRSZ-SJLPKXTDSA-N 1 3 288.479 3.878 20 0 CHADHO CCCCCC[C@@H](C)[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000040622457 1128525447 /nfs/dbraw/zinc/52/54/47/1128525447.db2.gz MOVFOPUFFDOOGI-CVEARBPZSA-N 1 3 254.462 3.665 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCCC23CCCC3)C1 ZINC000556104426 1128545899 /nfs/dbraw/zinc/54/58/99/1128545899.db2.gz WIKLUMJBJSWMEM-OAGGEKHMSA-N 1 3 264.457 3.562 20 0 CHADHO C[C@@H](NCCCCC[NH+]1CCCC1)c1cc(F)ccc1F ZINC000556231981 1128567367 /nfs/dbraw/zinc/56/73/67/1128567367.db2.gz GWSICDNEWBPRSH-CQSZACIVSA-N 1 3 296.405 3.882 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC(C)(C)C1)[C@@H]1CCCN(C2CCC2)C1 ZINC000568137405 1128578799 /nfs/dbraw/zinc/57/87/99/1128578799.db2.gz AXTWFTLUTGVJQA-ARFHVFGLSA-N 1 3 278.484 3.808 20 0 CHADHO CCC[N@H+](Cc1ccc(Cl)c(C)c1C)C1CCNCC1 ZINC001236185126 1128600508 /nfs/dbraw/zinc/60/05/08/1128600508.db2.gz WVZDENOBYRGFPH-UHFFFAOYSA-N 1 3 294.870 3.921 20 0 CHADHO CCC[N@@H+](Cc1ccc(Cl)c(C)c1C)C1CCNCC1 ZINC001236185126 1128600511 /nfs/dbraw/zinc/60/05/11/1128600511.db2.gz WVZDENOBYRGFPH-UHFFFAOYSA-N 1 3 294.870 3.921 20 0 CHADHO CCCN(Cc1ccc(Cl)c(C)c1C)C1CC[NH2+]CC1 ZINC001236185126 1128600513 /nfs/dbraw/zinc/60/05/13/1128600513.db2.gz WVZDENOBYRGFPH-UHFFFAOYSA-N 1 3 294.870 3.921 20 0 CHADHO Cc1ccc2c(c1)[C@H](NC1CC[NH+](CC3CC3)CC1)CCC2 ZINC000572095063 1128642029 /nfs/dbraw/zinc/64/20/29/1128642029.db2.gz PSQVPQDWHDPOCC-HXUWFJFHSA-N 1 3 298.474 3.836 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](C[C@H]2CC(C)=C[C@@H](C)C2)C1 ZINC000577945711 1128700681 /nfs/dbraw/zinc/70/06/81/1128700681.db2.gz VIUOUIDQQSPSOW-BPQIPLTHSA-N 1 3 278.484 3.643 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](C[C@H]2CC(C)=C[C@@H](C)C2)C1 ZINC000577945711 1128700683 /nfs/dbraw/zinc/70/06/83/1128700683.db2.gz VIUOUIDQQSPSOW-BPQIPLTHSA-N 1 3 278.484 3.643 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CCC1=CCCCCC1 ZINC000578005096 1128702918 /nfs/dbraw/zinc/70/29/18/1128702918.db2.gz BZVXZKQLGXMBKC-CQSZACIVSA-N 1 3 287.451 3.780 20 0 CHADHO CCCN1CCC([NH2+]Cc2ccc3sccc3c2)CC1 ZINC000578582756 1128722826 /nfs/dbraw/zinc/72/28/26/1128722826.db2.gz YUJLVAUGKKXWAD-UHFFFAOYSA-N 1 3 288.460 3.865 20 0 CHADHO CC[NH+]1CCC(N[C@@H](C)c2ccc(C(C)C)cc2)CC1 ZINC000034996119 1117789848 /nfs/dbraw/zinc/78/98/48/1117789848.db2.gz FXEUJFWGLXYICM-HNNXBMFYSA-N 1 3 274.452 3.945 20 0 CHADHO CC1(C)[C@H]([NH2+][C@H]2CCNC3(CCC3)C2)C[C@H]1c1ccccc1 ZINC000643547212 1117797175 /nfs/dbraw/zinc/79/71/75/1117797175.db2.gz BIBLCJNFWUCJID-OKZBNKHCSA-N 1 3 298.474 3.833 20 0 CHADHO CC[C@H](N[C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(C)cc1 ZINC000623337926 1117834215 /nfs/dbraw/zinc/83/42/15/1117834215.db2.gz BMBOSUDKQHVCCZ-SJORKVTESA-N 1 3 274.452 3.909 20 0 CHADHO CC[C@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(C)cc1 ZINC000623337926 1117834222 /nfs/dbraw/zinc/83/42/22/1117834222.db2.gz BMBOSUDKQHVCCZ-SJORKVTESA-N 1 3 274.452 3.909 20 0 CHADHO c1ccc([C@@H](NC2CC[NH+](CC3CC3)CC2)C2CCC2)cc1 ZINC000119235838 1117876686 /nfs/dbraw/zinc/87/66/86/1117876686.db2.gz OINMBJFHLDITMS-HXUWFJFHSA-N 1 3 298.474 3.992 20 0 CHADHO CC[C@@H](C)[C@H](C)[NH2+]C1CCN(CC2CCCC2)CC1 ZINC000178158136 1117887970 /nfs/dbraw/zinc/88/79/70/1117887970.db2.gz JQGWNVLSNWUCAF-CABCVRRESA-N 1 3 266.473 3.665 20 0 CHADHO CC[C@H](C)[C@H](C)[NH2+]C1CCN(CC2CCCC2)CC1 ZINC000178158144 1117887407 /nfs/dbraw/zinc/88/74/07/1117887407.db2.gz JQGWNVLSNWUCAF-GJZGRUSLSA-N 1 3 266.473 3.665 20 0 CHADHO CC[C@H](C)[NH2+][C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000579288064 1128743241 /nfs/dbraw/zinc/74/32/41/1128743241.db2.gz IDMDKTJQHXIGKQ-GDAAHCPNSA-N 1 3 286.463 3.675 20 0 CHADHO CC[C@@H](NC[C@H]1CCCC[N@H+](C)C1)c1cccs1 ZINC000624120262 1117985009 /nfs/dbraw/zinc/98/50/09/1117985009.db2.gz VACWZPVSPSLYFC-ZIAGYGMSSA-N 1 3 266.454 3.521 20 0 CHADHO CC[C@@H](NC[C@H]1CCCC[N@@H+](C)C1)c1cccs1 ZINC000624120262 1117985011 /nfs/dbraw/zinc/98/50/11/1117985011.db2.gz VACWZPVSPSLYFC-ZIAGYGMSSA-N 1 3 266.454 3.521 20 0 CHADHO Cc1ccc(C2CC([NH2+]C[C@@H]3CCCCN(C)C3)C2)cc1 ZINC000624122003 1117985292 /nfs/dbraw/zinc/98/52/92/1117985292.db2.gz HPWVTQFERJNYBS-IVMQYODDSA-N 1 3 286.463 3.563 20 0 CHADHO C[C@H](c1ccccc1)[C@H](C)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000624121182 1117985371 /nfs/dbraw/zinc/98/53/71/1117985371.db2.gz PPARYTJDHMEOBO-YESZJQIVSA-N 1 3 274.452 3.500 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccc(F)c(Cl)c1 ZINC000624120714 1117985479 /nfs/dbraw/zinc/98/54/79/1117985479.db2.gz FPMDBIBTOOTLDO-STQMWFEESA-N 1 3 298.833 3.862 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@H]2CCCc3cc(F)ccc32)C1 ZINC000624122277 1117985682 /nfs/dbraw/zinc/98/56/82/1117985682.db2.gz NPWGTFIRPJKSTN-KDOFPFPSSA-N 1 3 290.426 3.525 20 0 CHADHO CC[C@H](CCc1ccccc1)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000624124832 1117986825 /nfs/dbraw/zinc/98/68/25/1117986825.db2.gz LYBOPJUAEIFHEC-RBUKOAKNSA-N 1 3 288.479 3.719 20 0 CHADHO CCCC[C@H](C)[C@@H](C)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000624123502 1117987147 /nfs/dbraw/zinc/98/71/47/1117987147.db2.gz NFQJPMOUDYVKSA-XHSDSOJGSA-N 1 3 254.462 3.523 20 0 CHADHO CCCC[C@H](C)[C@H](C)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000624123500 1117987539 /nfs/dbraw/zinc/98/75/39/1117987539.db2.gz NFQJPMOUDYVKSA-HRCADAONSA-N 1 3 254.462 3.523 20 0 CHADHO C[C@H]([NH2+]CCC1CCCC1)[C@H]1CCCN(C2CCC2)C1 ZINC000185725430 1118063281 /nfs/dbraw/zinc/06/32/81/1118063281.db2.gz UISUSVYPZZDNMI-RDJZCZTQSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCCC1)c1cccc(C2CC2)c1 ZINC000340183016 1118103351 /nfs/dbraw/zinc/10/33/51/1118103351.db2.gz SMOWSXYYAJWVMF-OAHLLOKOSA-N 1 3 272.436 3.701 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](C)c2cccc(C3CC3)c2)C1 ZINC000340188099 1118106766 /nfs/dbraw/zinc/10/67/66/1118106766.db2.gz DWYGJEZGKGYETG-CABCVRRESA-N 1 3 272.436 3.556 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](C)c2cccc(C3CC3)c2)C1 ZINC000340188099 1118106767 /nfs/dbraw/zinc/10/67/67/1118106767.db2.gz DWYGJEZGKGYETG-CABCVRRESA-N 1 3 272.436 3.556 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](C)c2cccc(C3CC3)c2)C1 ZINC000340188099 1118106768 /nfs/dbraw/zinc/10/67/68/1118106768.db2.gz DWYGJEZGKGYETG-CABCVRRESA-N 1 3 272.436 3.556 20 0 CHADHO C[C@@H]1CN(CCCC[NH2+]C2CCCCCCC2)C[C@@H](C)O1 ZINC000765404332 1118149347 /nfs/dbraw/zinc/14/93/47/1118149347.db2.gz CTUKYWSCQJZOHN-IAGOWNOFSA-N 1 3 296.499 3.578 20 0 CHADHO CC(C)CCC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000122131126 1118255911 /nfs/dbraw/zinc/25/59/11/1118255911.db2.gz MJMGWPURJJJNEE-UHFFFAOYSA-N 1 3 266.473 3.809 20 0 CHADHO CCCC[C@H](C)[C@H](C)[NH2+]CCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000580120649 1118383119 /nfs/dbraw/zinc/38/31/19/1118383119.db2.gz GLMNAHSZPIPTDC-XSLAGTTESA-N 1 3 298.515 3.680 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@H](C)c2cccc(C3CC3)c2)C1 ZINC000580906656 1118520039 /nfs/dbraw/zinc/52/00/39/1118520039.db2.gz HVGMUEUXCMGCSL-CVEARBPZSA-N 1 3 286.463 3.947 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@H](C)c2cccc(C3CC3)c2)C1 ZINC000580906656 1118520040 /nfs/dbraw/zinc/52/00/40/1118520040.db2.gz HVGMUEUXCMGCSL-CVEARBPZSA-N 1 3 286.463 3.947 20 0 CHADHO CCCN(CCC[NH+](C)C)Cc1ccc2nc(C)ccc2c1 ZINC000349379583 1118556706 /nfs/dbraw/zinc/55/67/06/1118556706.db2.gz BWZRFPVVBYDZCQ-UHFFFAOYSA-N 1 3 299.462 3.707 20 0 CHADHO c1csc(CN(Cc2cccc3c2CC[NH2+]C3)C2CC2)c1 ZINC000123929650 1118578175 /nfs/dbraw/zinc/57/81/75/1118578175.db2.gz IPSTVRQGQWMZRV-UHFFFAOYSA-N 1 3 298.455 3.558 20 0 CHADHO C[C@H](C[NH2+][C@H]1C[C@H](C)CC(C)(C)C1)CN1CCCCC1 ZINC000109920597 1118588455 /nfs/dbraw/zinc/58/84/55/1118588455.db2.gz NZNRRXHMXBVCHW-BBWFWOEESA-N 1 3 280.500 3.913 20 0 CHADHO CC[C@H]([NH2+]CC[C@@H]1CCCN1C)c1cccc(Cl)c1 ZINC000341106598 1118602930 /nfs/dbraw/zinc/60/29/30/1118602930.db2.gz QUUPOAOXWFRTAI-HOTGVXAUSA-N 1 3 280.843 3.865 20 0 CHADHO C[C@H](C[NH2+]C1CCC(C(C)(C)C)CC1)CN1CCCC1 ZINC000109961481 1118625996 /nfs/dbraw/zinc/62/59/96/1118625996.db2.gz SJOALIPSMPVAJJ-KLAILNCOSA-N 1 3 280.500 3.913 20 0 CHADHO C[C@@H](c1ccc(Cl)c(Cl)c1)N1CC[C@H](CC[NH3+])C1 ZINC000723691313 1118706993 /nfs/dbraw/zinc/70/69/93/1118706993.db2.gz MAGBJFWOEOBRSY-QWRGUYRKSA-N 1 3 287.234 3.725 20 0 CHADHO CC[NH2+]CC1CCN([C@H](C)c2ccccc2Cl)CC1 ZINC000131462967 1118760905 /nfs/dbraw/zinc/76/09/05/1118760905.db2.gz DZVHKMVLDOLLBE-CYBMUJFWSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@@H]1CCCC[C@@H]1C[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000401383559 1118902532 /nfs/dbraw/zinc/90/25/32/1118902532.db2.gz IDUPPFQJBMRZAH-GVDBMIGSSA-N 1 3 266.473 3.523 20 0 CHADHO CC[C@H]1CCC[C@H]1C[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000449433549 1118906448 /nfs/dbraw/zinc/90/64/48/1118906448.db2.gz MUCMYZKPIIBQKH-GJZGRUSLSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@H]1C[C@H](NCc2cccc(C3CCCC3)c2)CC[N@@H+]1C ZINC000657376480 1119040185 /nfs/dbraw/zinc/04/01/85/1119040185.db2.gz RADBEBPCCIAQAA-HNAYVOBHSA-N 1 3 286.463 3.917 20 0 CHADHO C[C@H]1C[C@H](NCc2cccc(C3CCCC3)c2)CC[N@H+]1C ZINC000657376480 1119040188 /nfs/dbraw/zinc/04/01/88/1119040188.db2.gz RADBEBPCCIAQAA-HNAYVOBHSA-N 1 3 286.463 3.917 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H]2C[C@@H](C)c3ccccc32)C1 ZINC000582383127 1119063855 /nfs/dbraw/zinc/06/38/55/1119063855.db2.gz MHZPQVAWNXHILB-MDZRGWNJSA-N 1 3 286.463 3.945 20 0 CHADHO C[C@@H](CC[NH+](C)C)N[C@@H]1CCC(C)(C)c2ccccc21 ZINC000049553766 1119104352 /nfs/dbraw/zinc/10/43/52/1119104352.db2.gz FMTBZCRTEUWGHB-WMLDXEAASA-N 1 3 274.452 3.729 20 0 CHADHO CCC[C@@H](NC1CC[NH+](CC)CC1)c1ccc(OC)cc1 ZINC000159267555 1119111491 /nfs/dbraw/zinc/11/14/91/1119111491.db2.gz NKQBGJUUIJTTGL-GOSISDBHSA-N 1 3 290.451 3.610 20 0 CHADHO CC[NH+]1CCC(CCN[C@@H](C)c2cccnc2Cl)CC1 ZINC000121700442 1119267701 /nfs/dbraw/zinc/26/77/01/1119267701.db2.gz OYWIJRARGIECDN-ZDUSSCGKSA-N 1 3 295.858 3.508 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H]2CCCc3c(C)ccc(C)c32)C1 ZINC000349812023 1119272322 /nfs/dbraw/zinc/27/23/22/1119272322.db2.gz JQHWPLAYBROSOM-WMZOPIPTSA-N 1 3 286.463 3.612 20 0 CHADHO C[C@@H](C[N@@H+]1CCC[C@@H](N(C)C)CC1)C1CCCCC1 ZINC000569628306 1119346961 /nfs/dbraw/zinc/34/69/61/1119346961.db2.gz ALWNAOSLOBRJAD-DOTOQJQBSA-N 1 3 266.473 3.619 20 0 CHADHO C[C@@H](C[N@H+]1CCC[C@@H](N(C)C)CC1)C1CCCCC1 ZINC000569628306 1119346964 /nfs/dbraw/zinc/34/69/64/1119346964.db2.gz ALWNAOSLOBRJAD-DOTOQJQBSA-N 1 3 266.473 3.619 20 0 CHADHO CC[C@@H](NCc1ccccc1C[NH2+]C)c1ccsc1 ZINC000650755280 1119413242 /nfs/dbraw/zinc/41/32/42/1119413242.db2.gz BALYFAPNZOYDJF-MRXNPFEDSA-N 1 3 274.433 3.708 20 0 CHADHO CC(C)c1ccc(C[N@H+](C)[C@H]2CCCC[C@H]2N)cc1 ZINC000252916160 1119449837 /nfs/dbraw/zinc/44/98/37/1119449837.db2.gz BBPAMZYKLQRATP-SJORKVTESA-N 1 3 260.425 3.512 20 0 CHADHO CC(C)c1ccc(C[N@@H+](C)[C@H]2CCCC[C@H]2N)cc1 ZINC000252916160 1119449839 /nfs/dbraw/zinc/44/98/39/1119449839.db2.gz BBPAMZYKLQRATP-SJORKVTESA-N 1 3 260.425 3.512 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H](N(C)C)C2)c2ccccc21 ZINC000343593411 1119464333 /nfs/dbraw/zinc/46/43/33/1119464333.db2.gz AWVWCPSNVSOOTD-FSZRXZPDSA-N 1 3 272.436 3.697 20 0 CHADHO Cc1ccc([C@H](C)CN2CC[C@@H](C[NH+]3CCCC3)C2)cc1 ZINC000628182038 1119492678 /nfs/dbraw/zinc/49/26/78/1119492678.db2.gz AMJQGOUHZLBPTA-MSOLQXFVSA-N 1 3 286.463 3.516 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H]2[C@@H]3CCC[C@@H]3C2(C)C)C1 ZINC000657872306 1119583988 /nfs/dbraw/zinc/58/39/88/1119583988.db2.gz MUEXPLDWPBIPHE-NCOADZHNSA-N 1 3 278.484 3.521 20 0 CHADHO C/C(=C/c1ccccc1)CN1CCC[C@@H]2C[N@H+](C)CC[C@H]21 ZINC000685470812 1119612551 /nfs/dbraw/zinc/61/25/51/1119612551.db2.gz SRZNORCJZLTQSJ-WREUSQSKSA-N 1 3 284.447 3.506 20 0 CHADHO C/C(=C/c1ccccc1)CN1CCC[C@@H]2C[N@@H+](C)CC[C@H]21 ZINC000685470812 1119612553 /nfs/dbraw/zinc/61/25/53/1119612553.db2.gz SRZNORCJZLTQSJ-WREUSQSKSA-N 1 3 284.447 3.506 20 0 CHADHO C/C(=C/c1ccccc1)CN1CCC[C@@H]2C[N@H+](C)CC[C@@H]21 ZINC000685470811 1119612653 /nfs/dbraw/zinc/61/26/53/1119612653.db2.gz SRZNORCJZLTQSJ-BLTVVPKDSA-N 1 3 284.447 3.506 20 0 CHADHO C/C(=C/c1ccccc1)CN1CCC[C@@H]2C[N@@H+](C)CC[C@@H]21 ZINC000685470811 1119612655 /nfs/dbraw/zinc/61/26/55/1119612655.db2.gz SRZNORCJZLTQSJ-BLTVVPKDSA-N 1 3 284.447 3.506 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCCSCC1)[C@H]1CCCN(C2CCC2)C1 ZINC000657969782 1119655439 /nfs/dbraw/zinc/65/54/39/1119655439.db2.gz UQICCUYOYRVNKG-HRCADAONSA-N 1 3 296.524 3.515 20 0 CHADHO C[C@H](CC[NH2+][C@@H](C)C(C)(C)C(F)F)N1CCCCC1 ZINC000657973299 1119657533 /nfs/dbraw/zinc/65/75/33/1119657533.db2.gz PQJGHMIQGLMOSI-OLZOCXBDSA-N 1 3 276.415 3.520 20 0 CHADHO Cc1cc([C@H](C)[NH2+]CCCN2CCCCC2)cs1 ZINC000381475052 1119697931 /nfs/dbraw/zinc/69/79/31/1119697931.db2.gz MELZNGZYSXZQBB-AWEZNQCLSA-N 1 3 266.454 3.583 20 0 CHADHO C[C@@H](Cc1ccccc1)[NH+]1CCC(NCC2=CCCC2)CC1 ZINC000658290473 1119718666 /nfs/dbraw/zinc/71/86/66/1119718666.db2.gz AQBIKBYZWSZNEW-KRWDZBQOSA-N 1 3 298.474 3.782 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2c(C)cc(C)cc2C)C[C@@H]1C ZINC000531139904 1119793264 /nfs/dbraw/zinc/79/32/64/1119793264.db2.gz BQXAETJUODIXPL-ZWKOTPCHSA-N 1 3 288.479 3.916 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2c(C)cc(C)cc2C)C[C@@H]1C ZINC000531139904 1119793267 /nfs/dbraw/zinc/79/32/67/1119793267.db2.gz BQXAETJUODIXPL-ZWKOTPCHSA-N 1 3 288.479 3.916 20 0 CHADHO CC(C)CCN1CCC([NH2+]CC[C@]2(C)CC2(F)F)CC1 ZINC000926704274 1119830702 /nfs/dbraw/zinc/83/07/02/1119830702.db2.gz IIIFSMRYDNWAGT-OAHLLOKOSA-N 1 3 288.426 3.522 20 0 CHADHO CCc1oc2ccccc2c1CN1CC[C@@H]([NH3+])[C@H](CC)C1 ZINC000647498938 1119851497 /nfs/dbraw/zinc/85/14/97/1119851497.db2.gz UINCCRUZXXXDIM-CZUORRHYSA-N 1 3 286.419 3.554 20 0 CHADHO C[C@@H](NCc1ccc(C[NH+](C)C)cc1)c1cccc(F)c1 ZINC000171126287 1119930561 /nfs/dbraw/zinc/93/05/61/1119930561.db2.gz DEVLLNVNJPPJRA-CQSZACIVSA-N 1 3 286.394 3.738 20 0 CHADHO C[NH+](C)Cc1ccc(CN[C@H]2CCc3cc(F)ccc32)cc1 ZINC000171132525 1119936925 /nfs/dbraw/zinc/93/69/25/1119936925.db2.gz XAFZLPSTUSDRPW-IBGZPJMESA-N 1 3 298.405 3.664 20 0 CHADHO Clc1sccc1CN1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647543903 1120004479 /nfs/dbraw/zinc/00/44/79/1120004479.db2.gz UGKAQBPUNSYOGZ-QWHCGFSZSA-N 1 3 298.883 3.613 20 0 CHADHO CCC[C@H](NC[C@H]1CCC[N@H+](C)C1)c1ccsc1 ZINC000187711262 1120032460 /nfs/dbraw/zinc/03/24/60/1120032460.db2.gz SNJYAUDQMBSQGL-HIFRSBDPSA-N 1 3 266.454 3.521 20 0 CHADHO CCC[C@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccsc1 ZINC000187711262 1120032465 /nfs/dbraw/zinc/03/24/65/1120032465.db2.gz SNJYAUDQMBSQGL-HIFRSBDPSA-N 1 3 266.454 3.521 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@@H](C)[C@H]1CC2CCC1CC2 ZINC000381724926 1128885738 /nfs/dbraw/zinc/88/57/38/1128885738.db2.gz RZJDBNVAONZFNH-ZGRYLRDCSA-N 1 3 266.473 3.521 20 0 CHADHO CCCc1ccc(C[NH2+]CCCN2CCCCC2)cc1 ZINC000588258013 1120051682 /nfs/dbraw/zinc/05/16/82/1120051682.db2.gz SGDMYALSYSBCIA-UHFFFAOYSA-N 1 3 274.452 3.605 20 0 CHADHO CN1CCCC[C@@H](C[NH2+][C@@H]2CC(C)(C)Cc3occc32)C1 ZINC000624120785 1120065228 /nfs/dbraw/zinc/06/52/28/1120065228.db2.gz GYXBOYCBWQVEIS-GOEBONIOSA-N 1 3 290.451 3.615 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000623657253 1120065444 /nfs/dbraw/zinc/06/54/44/1120065444.db2.gz MDZVGOSYJRDORU-QRQLOZEOSA-N 1 3 286.463 3.644 20 0 CHADHO CC[N@@H+]1CCC[C@@H](CN[C@@H](c2ccc(F)cc2)C2CC2)C1 ZINC001116473025 1120127801 /nfs/dbraw/zinc/12/78/01/1120127801.db2.gz JHCBZZJDPMBLRJ-KBXCAEBGSA-N 1 3 290.426 3.598 20 0 CHADHO CC[N@H+]1CCC[C@@H](CN[C@@H](c2ccc(F)cc2)C2CC2)C1 ZINC001116473025 1120127804 /nfs/dbraw/zinc/12/78/04/1120127804.db2.gz JHCBZZJDPMBLRJ-KBXCAEBGSA-N 1 3 290.426 3.598 20 0 CHADHO C[C@@H]([NH3+])[C@@H]1CCCN(Cc2ccc(C(C)(C)C)cc2)C1 ZINC000111695822 1120154765 /nfs/dbraw/zinc/15/47/65/1120154765.db2.gz NSHSDCRZGYIKTE-GDBMZVCRSA-N 1 3 274.452 3.543 20 0 CHADHO CC(C)(C)CCCN1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000499556134 1120321683 /nfs/dbraw/zinc/32/16/83/1120321683.db2.gz YQCJHSPDWMHBBZ-RDJZCZTQSA-N 1 3 278.484 3.761 20 0 CHADHO CC(C)(C)CCCN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000499556134 1120321687 /nfs/dbraw/zinc/32/16/87/1120321687.db2.gz YQCJHSPDWMHBBZ-RDJZCZTQSA-N 1 3 278.484 3.761 20 0 CHADHO CC[C@@H]([NH2+]CCCN1CCCCC1)c1ccsc1 ZINC000382159745 1120380589 /nfs/dbraw/zinc/38/05/89/1120380589.db2.gz UITYNDWDYURTPK-OAHLLOKOSA-N 1 3 266.454 3.665 20 0 CHADHO C[C@H](N[C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(C2CC2)cc1 ZINC000417356888 1120435440 /nfs/dbraw/zinc/43/54/40/1120435440.db2.gz QNRJSGXHKSMEFO-GLJUWKHASA-N 1 3 272.436 3.697 20 0 CHADHO C[C@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(C2CC2)cc1 ZINC000417356888 1120435443 /nfs/dbraw/zinc/43/54/43/1120435443.db2.gz QNRJSGXHKSMEFO-GLJUWKHASA-N 1 3 272.436 3.697 20 0 CHADHO C[C@H]([NH2+]CCCN1CCCC[C@@H]1C)c1ccccc1 ZINC000019913013 1120492159 /nfs/dbraw/zinc/49/21/59/1120492159.db2.gz KLWSNYSXZKFAJO-HOTGVXAUSA-N 1 3 260.425 3.602 20 0 CHADHO C[C@H]1C[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)CCS1 ZINC000922836465 1120607764 /nfs/dbraw/zinc/60/77/64/1120607764.db2.gz CIXCVFQDAGWFRZ-GOEBONIOSA-N 1 3 296.524 3.657 20 0 CHADHO CC[C@]1(C)CCC[C@@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000651731549 1120729253 /nfs/dbraw/zinc/72/92/53/1120729253.db2.gz RROIHQUERDSFFU-ZWKOTPCHSA-N 1 3 278.484 3.952 20 0 CHADHO C[C@H](CN1CCC[C@@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000247249050 1120875771 /nfs/dbraw/zinc/87/57/71/1120875771.db2.gz ZQSCIXLAENBPKK-IEBWSBKVSA-N 1 3 286.463 3.740 20 0 CHADHO C[NH2+]C[C@@H]1CCCN([C@H](C)c2cccc3ccccc32)C1 ZINC000251604484 1120882664 /nfs/dbraw/zinc/88/26/64/1120882664.db2.gz ZZFPDOUWXUFXDS-CVEARBPZSA-N 1 3 282.431 3.832 20 0 CHADHO C[C@@H](N)[C@H]1CCC[N@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000662245810 1120911082 /nfs/dbraw/zinc/91/10/82/1120911082.db2.gz OZDIRMUXZNMJSC-RWQQGDIJSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@@H](N)[C@H]1CCC[N@@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000662245810 1120911086 /nfs/dbraw/zinc/91/10/86/1120911086.db2.gz OZDIRMUXZNMJSC-RWQQGDIJSA-N 1 3 286.463 3.630 20 0 CHADHO CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663464146 1120980656 /nfs/dbraw/zinc/98/06/56/1120980656.db2.gz COWVDGNIRSDRPD-ZACQAIPSSA-N 1 3 278.484 3.523 20 0 CHADHO CCC[C@H]([NH2+]C[C@@H]1CCCN(CC2CC2)C1)C1CCC1 ZINC000663466207 1120980909 /nfs/dbraw/zinc/98/09/09/1120980909.db2.gz PKIPYTHMCCEQGS-WMZOPIPTSA-N 1 3 278.484 3.667 20 0 CHADHO c1ccc(C2CC([NH2+]C[C@H]3CCCN(CC4CC4)C3)C2)cc1 ZINC000663467431 1120981592 /nfs/dbraw/zinc/98/15/92/1120981592.db2.gz FUWLDHHEVFPXNN-QHGAOEGBSA-N 1 3 298.474 3.644 20 0 CHADHO C[C@@H]1Cc2ccccc2[C@@H]1NC[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663467308 1120981998 /nfs/dbraw/zinc/98/19/98/1120981998.db2.gz DTSHZNQNHRDYSR-WRWLIDTKSA-N 1 3 298.474 3.632 20 0 CHADHO C[C@@H]1Cc2ccccc2[C@@H]1NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663467308 1120982001 /nfs/dbraw/zinc/98/20/01/1120982001.db2.gz DTSHZNQNHRDYSR-WRWLIDTKSA-N 1 3 298.474 3.632 20 0 CHADHO C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663467308 1120982004 /nfs/dbraw/zinc/98/20/04/1120982004.db2.gz DTSHZNQNHRDYSR-WRWLIDTKSA-N 1 3 298.474 3.632 20 0 CHADHO c1ccc2c(c1)CCC[C@H]2NC[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663469088 1120982866 /nfs/dbraw/zinc/98/28/66/1120982866.db2.gz OEDLXFBKCQHKSW-YLJYHZDGSA-N 1 3 298.474 3.776 20 0 CHADHO c1ccc2c(c1)CCC[C@H]2NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663469088 1120982868 /nfs/dbraw/zinc/98/28/68/1120982868.db2.gz OEDLXFBKCQHKSW-YLJYHZDGSA-N 1 3 298.474 3.776 20 0 CHADHO CC(C)[C@H](N[C@@H]1CC[NH2+]C2(CCC2)C1)c1ccccc1 ZINC000643547898 1121012110 /nfs/dbraw/zinc/01/21/10/1121012110.db2.gz KMQPJIMZYXRAIR-SJORKVTESA-N 1 3 272.436 3.648 20 0 CHADHO CC(C)[C@H]([NH2+][C@@H]1CCNC2(CCC2)C1)c1ccccc1 ZINC000643547898 1121012112 /nfs/dbraw/zinc/01/21/12/1121012112.db2.gz KMQPJIMZYXRAIR-SJORKVTESA-N 1 3 272.436 3.648 20 0 CHADHO Cc1cc(C)cc(CC[NH2+]C2CCN(C(C)(C)C)CC2)c1 ZINC000766129860 1121291422 /nfs/dbraw/zinc/29/14/22/1121291422.db2.gz WSPDHCLOKWNPFI-UHFFFAOYSA-N 1 3 288.479 3.698 20 0 CHADHO CCN(CC)Cc1cc(NC(=[NH2+])C(C)(C)C)ccc1OC ZINC001162665853 1121334676 /nfs/dbraw/zinc/33/46/76/1121334676.db2.gz RKQFCLFDLJZGIJ-UHFFFAOYSA-N 1 3 291.439 3.972 20 0 CHADHO Cc1scc(CNCc2cccc(C[NH+](C)C)c2)c1C ZINC000631038288 1128979771 /nfs/dbraw/zinc/97/97/71/1128979771.db2.gz XLOVNRLTMSHLGN-UHFFFAOYSA-N 1 3 288.460 3.716 20 0 CHADHO CCC[C@H](C[N@@H+]1CCC[C@@H](N(C)C)CC1)c1ccccc1 ZINC000432796719 1121359221 /nfs/dbraw/zinc/35/92/21/1121359221.db2.gz IMYPQQCDXKRZSV-RTBURBONSA-N 1 3 288.479 3.986 20 0 CHADHO CCC[C@H](C[N@H+]1CCC[C@@H](N(C)C)CC1)c1ccccc1 ZINC000432796719 1121359229 /nfs/dbraw/zinc/35/92/29/1121359229.db2.gz IMYPQQCDXKRZSV-RTBURBONSA-N 1 3 288.479 3.986 20 0 CHADHO CCC[C@@H](C[N@@H+]1CCC[C@H](N(C)C)CC1)c1ccccc1 ZINC000432796716 1121360298 /nfs/dbraw/zinc/36/02/98/1121360298.db2.gz IMYPQQCDXKRZSV-OALUTQOASA-N 1 3 288.479 3.986 20 0 CHADHO CCC[C@@H](C[N@H+]1CCC[C@H](N(C)C)CC1)c1ccccc1 ZINC000432796716 1121360307 /nfs/dbraw/zinc/36/03/07/1121360307.db2.gz IMYPQQCDXKRZSV-OALUTQOASA-N 1 3 288.479 3.986 20 0 CHADHO C[C@H]1CCCCC[C@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000675906475 1121386406 /nfs/dbraw/zinc/38/64/06/1121386406.db2.gz WYJZHNIYXFCKCL-MAUKXSAKSA-N 1 3 278.484 3.952 20 0 CHADHO c1ccc(CN2C[C@@H]3CCC[C@H]([NH2+]CC4CCC4)[C@@H]3C2)cc1 ZINC000512614306 1121493846 /nfs/dbraw/zinc/49/38/46/1121493846.db2.gz VMQBSPJGUOGBMA-ZCNNSNEGSA-N 1 3 298.474 3.677 20 0 CHADHO c1ccc(CN2C[C@@H]3CCC[C@H]([NH2+]CC4CCC4)[C@H]3C2)cc1 ZINC000512614303 1121494034 /nfs/dbraw/zinc/49/40/34/1121494034.db2.gz VMQBSPJGUOGBMA-UFYCRDLUSA-N 1 3 298.474 3.677 20 0 CHADHO CC1(C[NH2+][C@@H]2CCC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1 ZINC000512632100 1121499855 /nfs/dbraw/zinc/49/98/55/1121499855.db2.gz WZFPPCMYKDZNHK-CEXWTWQISA-N 1 3 298.474 3.677 20 0 CHADHO C[C@@H]1C[C@@H](N[C@@H](c2cccc(F)c2)C(C)(C)C)CC[N@@H+]1C ZINC000162180613 1121662614 /nfs/dbraw/zinc/66/26/14/1121662614.db2.gz NSWOXAQLUSOEHQ-COXVUDFISA-N 1 3 292.442 3.985 20 0 CHADHO C[C@@H]1C[C@@H](N[C@@H](c2cccc(F)c2)C(C)(C)C)CC[N@H+]1C ZINC000162180613 1121662618 /nfs/dbraw/zinc/66/26/18/1121662618.db2.gz NSWOXAQLUSOEHQ-COXVUDFISA-N 1 3 292.442 3.985 20 0 CHADHO CCCC[C@@H](CC)CC[NH2+]C[C@@H]1CCN(CC)C1 ZINC000535597456 1121745699 /nfs/dbraw/zinc/74/56/99/1121745699.db2.gz HZJFVINHLIIMQA-CVEARBPZSA-N 1 3 254.462 3.524 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN(C[C@H](C)c2ccc(C)cc2)C1 ZINC001179855704 1121916561 /nfs/dbraw/zinc/91/65/61/1121916561.db2.gz ZXNCDWKHERAEGS-ZWKOTPCHSA-N 1 3 288.479 3.762 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN(C[C@H](C)c2ccc(C)cc2)C1 ZINC001179855704 1121916566 /nfs/dbraw/zinc/91/65/66/1121916566.db2.gz ZXNCDWKHERAEGS-ZWKOTPCHSA-N 1 3 288.479 3.762 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](C[C@H]2CCCC(C)(C)C2)C1 ZINC001180058436 1121943971 /nfs/dbraw/zinc/94/39/71/1121943971.db2.gz RACNMFAEOHRJDP-IRXDYDNUSA-N 1 3 280.500 3.867 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](C[C@H]2CCCC(C)(C)C2)C1 ZINC001180058436 1121943979 /nfs/dbraw/zinc/94/39/79/1121943979.db2.gz RACNMFAEOHRJDP-IRXDYDNUSA-N 1 3 280.500 3.867 20 0 CHADHO CCC[C@H](C)[N@@H+]1CCC[C@@H](CN2CCC(C)CC2)C1 ZINC000501152281 1121960350 /nfs/dbraw/zinc/96/03/50/1121960350.db2.gz WZLKPTFPCUJIAQ-IRXDYDNUSA-N 1 3 266.473 3.619 20 0 CHADHO CCC[C@H](C)[N@H+]1CCC[C@@H](CN2CCC(C)CC2)C1 ZINC000501152281 1121960354 /nfs/dbraw/zinc/96/03/54/1121960354.db2.gz WZLKPTFPCUJIAQ-IRXDYDNUSA-N 1 3 266.473 3.619 20 0 CHADHO [NH3+]CCCN[C@@H](Cc1ccccc1Cl)c1ccccc1 ZINC000420377973 1122003703 /nfs/dbraw/zinc/00/37/03/1122003703.db2.gz TWEJEAVIDYAQCE-KRWDZBQOSA-N 1 3 288.822 3.562 20 0 CHADHO C[C@H](CC[NH2+][C@H](C)C1CCCCC1)N1CCCCC1 ZINC001180809262 1122017356 /nfs/dbraw/zinc/01/73/56/1122017356.db2.gz CHLBFDBQGICQBR-HZPDHXFCSA-N 1 3 266.473 3.809 20 0 CHADHO CC[C@@H](Cc1ccccc1)[NH2+]CC(C)(C)CN1CCCC1 ZINC001181428306 1122053245 /nfs/dbraw/zinc/05/32/45/1122053245.db2.gz UXIMJYRASGMEKD-SFHVURJKSA-N 1 3 288.479 3.719 20 0 CHADHO CC(C)[C@@H](NCC[C@H]1CCC[N@@H+]1C)c1ccc(F)cc1 ZINC000502536437 1122100963 /nfs/dbraw/zinc/10/09/63/1122100963.db2.gz WPGNRACAIXHVBO-IAGOWNOFSA-N 1 3 278.415 3.597 20 0 CHADHO CC(C)[C@@H](NCC[C@H]1CCC[N@H+]1C)c1ccc(F)cc1 ZINC000502536437 1122100968 /nfs/dbraw/zinc/10/09/68/1122100968.db2.gz WPGNRACAIXHVBO-IAGOWNOFSA-N 1 3 278.415 3.597 20 0 CHADHO CC(C)[C@@H]([NH2+]CC[C@H]1CCCN1C)c1ccc(F)cc1 ZINC000502536437 1122100971 /nfs/dbraw/zinc/10/09/71/1122100971.db2.gz WPGNRACAIXHVBO-IAGOWNOFSA-N 1 3 278.415 3.597 20 0 CHADHO CC(C)(C)N1CCC([NH2+]C[C@H]2C[C@H]2c2ccccc2)CC1 ZINC000503035308 1122163767 /nfs/dbraw/zinc/16/37/67/1122163767.db2.gz NHIRFPVLXYHWEX-AEFFLSMTSA-N 1 3 286.463 3.643 20 0 CHADHO C[C@@H]1CC[C@H](C)[C@@H]([NH2+]C[C@H]2CCCN(CC3CC3)C2)C1 ZINC001183093437 1122206325 /nfs/dbraw/zinc/20/63/25/1122206325.db2.gz BQEAZAXEKJYOIP-ATLSCFEFSA-N 1 3 278.484 3.523 20 0 CHADHO C[C@@H](c1ccc2ccccc2c1)N1CCC(C)([NH3+])CC1 ZINC000647925296 1122220268 /nfs/dbraw/zinc/22/02/68/1122220268.db2.gz CFXILKMEFBZXJG-AWEZNQCLSA-N 1 3 268.404 3.714 20 0 CHADHO CC(C)(C)c1cccc(CN2CCC[C@](C)([NH3+])CC2)c1 ZINC001205273655 1122227445 /nfs/dbraw/zinc/22/74/45/1122227445.db2.gz NOSIDKOTJCYHPJ-SFHVURJKSA-N 1 3 274.452 3.687 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+]C[C@@H]1C(C)=CCC[C@@H]1C ZINC001184418064 1122276299 /nfs/dbraw/zinc/27/62/99/1122276299.db2.gz KJIUUZUBFWHYAA-YESZJQIVSA-N 1 3 266.473 3.689 20 0 CHADHO CCc1oc2ccccc2c1CN1CC[C@@]2(CC[N@H+](C)C2)C1 ZINC000430117645 1122408050 /nfs/dbraw/zinc/40/80/50/1122408050.db2.gz ZGZRWDVMAPCJDC-LJQANCHMSA-N 1 3 298.430 3.523 20 0 CHADHO CCc1oc2ccccc2c1CN1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000430117645 1122408051 /nfs/dbraw/zinc/40/80/51/1122408051.db2.gz ZGZRWDVMAPCJDC-LJQANCHMSA-N 1 3 298.430 3.523 20 0 CHADHO CC[C@@H](C[NH2+]C[C@@H]1CCN(C(C)C)C1)c1ccccc1 ZINC000516099461 1122567929 /nfs/dbraw/zinc/56/79/29/1122567929.db2.gz BHIPUAVXBWXVPA-IRXDYDNUSA-N 1 3 274.452 3.500 20 0 CHADHO C[C@@H](C[N@@H+]1CC[C@H](CN2CCCCC2)C1)CC(C)(C)C ZINC001191070329 1122568099 /nfs/dbraw/zinc/56/80/99/1122568099.db2.gz KNKPQHFHGSOPHW-IAGOWNOFSA-N 1 3 280.500 3.867 20 0 CHADHO C[C@@H](C[N@H+]1CC[C@H](CN2CCCCC2)C1)CC(C)(C)C ZINC001191070329 1122568101 /nfs/dbraw/zinc/56/81/01/1122568101.db2.gz KNKPQHFHGSOPHW-IAGOWNOFSA-N 1 3 280.500 3.867 20 0 CHADHO C[C@H](C[NH2+][C@H](CC1CCC1)c1ccccc1)CN(C)C ZINC000425916473 1122658833 /nfs/dbraw/zinc/65/88/33/1122658833.db2.gz FQXCFOVJEBYCRL-CRAIPNDOSA-N 1 3 274.452 3.705 20 0 CHADHO C[C@H](CN[C@H](CC1CCC1)c1ccccc1)C[NH+](C)C ZINC000425916473 1122658836 /nfs/dbraw/zinc/65/88/36/1122658836.db2.gz FQXCFOVJEBYCRL-CRAIPNDOSA-N 1 3 274.452 3.705 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCC[C@H]1c1ccccc1Cl)CN(C)C ZINC000425939318 1122670542 /nfs/dbraw/zinc/67/05/42/1122670542.db2.gz ZRNMTEMMPBUUHL-UKPHBRMFSA-N 1 3 294.870 3.763 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC000438070560 1122672743 /nfs/dbraw/zinc/67/27/43/1122672743.db2.gz FCZOJMGWNZCQFR-MOPGFXCFSA-N 1 3 288.479 3.817 20 0 CHADHO C[C@H](CCc1ccc(Cl)s1)[NH2+]C[C@H](C)CN(C)C ZINC000425947110 1122675929 /nfs/dbraw/zinc/67/59/29/1122675929.db2.gz ZHZDJWZZFBHIFA-NWDGAFQWSA-N 1 3 288.888 3.510 20 0 CHADHO FC1(F)CCC[C@@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C1 ZINC001167967929 1122848577 /nfs/dbraw/zinc/84/85/77/1122848577.db2.gz LLSLWZCMCIEILI-WZYMTQMTSA-N 1 3 298.421 3.559 20 0 CHADHO FC1(F)CCC[C@@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)C1 ZINC001167967929 1122848581 /nfs/dbraw/zinc/84/85/81/1122848581.db2.gz LLSLWZCMCIEILI-WZYMTQMTSA-N 1 3 298.421 3.559 20 0 CHADHO C[C@@H]1CCC[C@@H](C)[NH+]1C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167981679 1122896714 /nfs/dbraw/zinc/89/67/14/1122896714.db2.gz DXAWVZRGGNWNKI-SUQXETJPSA-N 1 3 276.468 3.655 20 0 CHADHO Cc1cccc([C@H]([NH2+]CC[C@@H]2CCCN2C)C(C)C)c1 ZINC001196781366 1122933771 /nfs/dbraw/zinc/93/37/71/1122933771.db2.gz ACNYZZOUBNKQSP-ZWKOTPCHSA-N 1 3 274.452 3.766 20 0 CHADHO Cc1cccc([C@H](NCC[C@@H]2CCC[N@@H+]2C)C(C)C)c1 ZINC001196781366 1122933779 /nfs/dbraw/zinc/93/37/79/1122933779.db2.gz ACNYZZOUBNKQSP-ZWKOTPCHSA-N 1 3 274.452 3.766 20 0 CHADHO Cc1cccc([C@H](NCC[C@@H]2CCC[N@H+]2C)C(C)C)c1 ZINC001196781366 1122933785 /nfs/dbraw/zinc/93/37/85/1122933785.db2.gz ACNYZZOUBNKQSP-ZWKOTPCHSA-N 1 3 274.452 3.766 20 0 CHADHO C[C@H]1C[N@H+](CC2CCC3(CC3)CC2)CCN1c1ccncc1 ZINC001197378401 1122955829 /nfs/dbraw/zinc/95/58/29/1122955829.db2.gz YJBJFNKEBDXBIK-INIZCTEOSA-N 1 3 299.462 3.563 20 0 CHADHO C[C@H]1C[N@@H+](CC2CCC3(CC3)CC2)CCN1c1ccncc1 ZINC001197378401 1122955833 /nfs/dbraw/zinc/95/58/33/1122955833.db2.gz YJBJFNKEBDXBIK-INIZCTEOSA-N 1 3 299.462 3.563 20 0 CHADHO CC[C@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)c1cccc(F)c1 ZINC000187964726 1122981172 /nfs/dbraw/zinc/98/11/72/1122981172.db2.gz SXSDWFSGSASGBR-YJBOKZPZSA-N 1 3 292.442 3.987 20 0 CHADHO FC1(F)CCC([NH2+]C2CCN(C3CCCC3)CC2)CC1 ZINC000334395147 1123005176 /nfs/dbraw/zinc/00/51/76/1123005176.db2.gz BKHBJLUSSZWVJC-UHFFFAOYSA-N 1 3 286.410 3.561 20 0 CHADHO CCc1oc2ccccc2c1CNCc1ccc(C[NH3+])cc1 ZINC000519710621 1123019829 /nfs/dbraw/zinc/01/98/29/1123019829.db2.gz QJZPKMWQHMPHQN-UHFFFAOYSA-N 1 3 294.398 3.744 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001205902003 1123060133 /nfs/dbraw/zinc/06/01/33/1123060133.db2.gz GUTUPTJRPZWDIZ-ULQDDVLXSA-N 1 3 266.473 3.818 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001205902003 1123060142 /nfs/dbraw/zinc/06/01/42/1123060142.db2.gz GUTUPTJRPZWDIZ-ULQDDVLXSA-N 1 3 266.473 3.818 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1CC1CCCCC1 ZINC001201400015 1123092323 /nfs/dbraw/zinc/09/23/23/1123092323.db2.gz MNIAIELDJINRSR-ROUUACIJSA-N 1 3 278.484 3.906 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@H+]1CC1CCCCC1 ZINC001201400015 1123092327 /nfs/dbraw/zinc/09/23/27/1123092327.db2.gz MNIAIELDJINRSR-ROUUACIJSA-N 1 3 278.484 3.906 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)c2cc3ccc(C)cc3o2)C1 ZINC000425924541 1123113612 /nfs/dbraw/zinc/11/36/12/1123113612.db2.gz MVCVXCHDMAEVJH-LSDHHAIUSA-N 1 3 286.419 3.734 20 0 CHADHO CC(C)=CCC[C@H](C)C[NH+]1CCN(c2ccncc2)CC1 ZINC001201482842 1123115734 /nfs/dbraw/zinc/11/57/34/1123115734.db2.gz OCACQPIYTMVWMR-KRWDZBQOSA-N 1 3 287.451 3.586 20 0 CHADHO CC(C)=CCC[C@H](C)CN1CCN(c2cc[nH+]cc2)CC1 ZINC001201482842 1123115736 /nfs/dbraw/zinc/11/57/36/1123115736.db2.gz OCACQPIYTMVWMR-KRWDZBQOSA-N 1 3 287.451 3.586 20 0 CHADHO CC(C)CN1CCC[C@@H](C[NH2+][C@H]2CCCC(C)(C)C2)C1 ZINC001201557504 1123123643 /nfs/dbraw/zinc/12/36/43/1123123643.db2.gz KHNBAQJSPPJCMV-IRXDYDNUSA-N 1 3 280.500 3.913 20 0 CHADHO CCC[N@H+]1C[C@H]2c3ccccc3[C@H](N(C)C(C)C)[C@H]2C1 ZINC001201641438 1123135124 /nfs/dbraw/zinc/13/51/24/1123135124.db2.gz MJAHFMXEFMZQON-BZSNNMDCSA-N 1 3 272.436 3.507 20 0 CHADHO CCC[N@@H+]1C[C@H]2c3ccccc3[C@H](N(C)C(C)C)[C@H]2C1 ZINC001201641438 1123135125 /nfs/dbraw/zinc/13/51/25/1123135125.db2.gz MJAHFMXEFMZQON-BZSNNMDCSA-N 1 3 272.436 3.507 20 0 CHADHO CCCC[NH+]1CCC(N(CC)Cc2ccccc2)CC1 ZINC001201713725 1123139064 /nfs/dbraw/zinc/13/90/64/1123139064.db2.gz QOXOACGPVXZMCV-UHFFFAOYSA-N 1 3 274.452 3.773 20 0 CHADHO CCCCCN1CCC([N@H+](C)Cc2ccc(F)cc2)CC1 ZINC001201737173 1123143436 /nfs/dbraw/zinc/14/34/36/1123143436.db2.gz GFGBHKRFXYPPSQ-UHFFFAOYSA-N 1 3 292.442 3.912 20 0 CHADHO CCCCCN1CCC([N@@H+](C)Cc2ccc(F)cc2)CC1 ZINC001201737173 1123143438 /nfs/dbraw/zinc/14/34/38/1123143438.db2.gz GFGBHKRFXYPPSQ-UHFFFAOYSA-N 1 3 292.442 3.912 20 0 CHADHO C(C1CCCC1)N1CCC([NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)CC1 ZINC001201857662 1123153378 /nfs/dbraw/zinc/15/33/78/1123153378.db2.gz SMPVYLFXXLENSJ-IZZQQSIFSA-N 1 3 290.495 3.809 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1CC1CCCC1 ZINC001202178560 1123181886 /nfs/dbraw/zinc/18/18/86/1123181886.db2.gz VKRCIJNZKSYWEK-IRXDYDNUSA-N 1 3 264.457 3.515 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@H+]1CC1CCCC1 ZINC001202178560 1123181887 /nfs/dbraw/zinc/18/18/87/1123181887.db2.gz VKRCIJNZKSYWEK-IRXDYDNUSA-N 1 3 264.457 3.515 20 0 CHADHO c1ccc(C[N@H+]2C[C@@H]3CCN(CC4CCCC4)C[C@@H]3C2)cc1 ZINC001202189937 1123184519 /nfs/dbraw/zinc/18/45/19/1123184519.db2.gz GUXXHEHVYFQDPF-VQTJNVASSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(C[N@@H+]2C[C@@H]3CCN(CC4CCCC4)C[C@@H]3C2)cc1 ZINC001202189937 1123184521 /nfs/dbraw/zinc/18/45/21/1123184521.db2.gz GUXXHEHVYFQDPF-VQTJNVASSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(C[N@H+]2C[C@@H]3CCN(CC4CCCC4)C[C@H]3C2)cc1 ZINC001202189935 1123184653 /nfs/dbraw/zinc/18/46/53/1123184653.db2.gz GUXXHEHVYFQDPF-PMACEKPBSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(C[N@@H+]2C[C@@H]3CCN(CC4CCCC4)C[C@H]3C2)cc1 ZINC001202189935 1123184654 /nfs/dbraw/zinc/18/46/54/1123184654.db2.gz GUXXHEHVYFQDPF-PMACEKPBSA-N 1 3 298.474 3.631 20 0 CHADHO CCCC1(CN[C@H]2C[C@H]([NH3+])c3ccccc32)CCC1 ZINC000391796551 1123215550 /nfs/dbraw/zinc/21/55/50/1123215550.db2.gz DGLCEVJMXBFKGS-HOTGVXAUSA-N 1 3 258.409 3.691 20 0 CHADHO CC(C)[C@@H](CSc1ccccc1)[NH2+]CC1(N)CCCC1 ZINC000665247731 1123257681 /nfs/dbraw/zinc/25/76/81/1123257681.db2.gz IVJHYGQPGUUZTJ-MRXNPFEDSA-N 1 3 292.492 3.664 20 0 CHADHO CC(C)[C@@H](CSc1ccccc1)NCC1([NH3+])CCCC1 ZINC000665247731 1123257683 /nfs/dbraw/zinc/25/76/83/1123257683.db2.gz IVJHYGQPGUUZTJ-MRXNPFEDSA-N 1 3 292.492 3.664 20 0 CHADHO CC(C)CC[C@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1ccoc1 ZINC000428217989 1123282911 /nfs/dbraw/zinc/28/29/11/1123282911.db2.gz IQAQTHDFKNRVIJ-YJBOKZPZSA-N 1 3 290.451 3.831 20 0 CHADHO [NH3+][C@H]1C[C@H](N[C@@H]2CC[C@@H]2c2ccccc2)c2ccccc21 ZINC000665274153 1123303635 /nfs/dbraw/zinc/30/36/35/1123303635.db2.gz KZJGZEJSXOKWHM-FDPIWHGQSA-N 1 3 278.399 3.667 20 0 CHADHO CC[C@H](NCC[C@@H]([NH3+])C(C)C)c1ccc(Cl)s1 ZINC000665281243 1123313495 /nfs/dbraw/zinc/31/34/95/1123313495.db2.gz YECMMNIEMNGEBD-MNOVXSKESA-N 1 3 274.861 3.816 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@@H](C)c1cccc(-c2ccncc2)c1 ZINC000665280521 1123313574 /nfs/dbraw/zinc/31/35/74/1123313574.db2.gz FCQCOKOGISWHEY-HNAYVOBHSA-N 1 3 297.446 3.773 20 0 CHADHO C[C@H]1C[C@H]([NH2+]CCCN2CCCC[C@H]2C)C[C@@H](C)C1 ZINC000252114853 1123412620 /nfs/dbraw/zinc/41/26/20/1123412620.db2.gz IISPYOIGOZHJRR-TWMKSMIVSA-N 1 3 266.473 3.665 20 0 CHADHO CCN1CCC[C@@H](C[NH2+]Cc2c(C)oc3ccccc32)C1 ZINC001648959994 1123442111 /nfs/dbraw/zinc/44/21/11/1123442111.db2.gz IPDJXCUXNZEEBM-HNNXBMFYSA-N 1 3 286.419 3.563 20 0 CHADHO CCc1ccccc1C[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000052202901 1123480005 /nfs/dbraw/zinc/48/00/05/1123480005.db2.gz MRIAPQGEWMEGOJ-UHFFFAOYSA-N 1 3 274.452 3.602 20 0 CHADHO CCCC[C@H](CC)C[N@@H+]1CCC[C@H](N(C)C)CC1 ZINC000429524783 1123537550 /nfs/dbraw/zinc/53/75/50/1123537550.db2.gz AYNAHWMKXDBQGS-HOTGVXAUSA-N 1 3 254.462 3.619 20 0 CHADHO CCCC[C@H](CC)C[N@H+]1CCC[C@H](N(C)C)CC1 ZINC000429524783 1123537554 /nfs/dbraw/zinc/53/75/54/1123537554.db2.gz AYNAHWMKXDBQGS-HOTGVXAUSA-N 1 3 254.462 3.619 20 0 CHADHO CCCC[C@H](CC)C[N@@H+]1CCC[C@@H](N(C)C)CC1 ZINC000429524785 1123538048 /nfs/dbraw/zinc/53/80/48/1123538048.db2.gz AYNAHWMKXDBQGS-JKSUJKDBSA-N 1 3 254.462 3.619 20 0 CHADHO CCCC[C@H](CC)C[N@H+]1CCC[C@@H](N(C)C)CC1 ZINC000429524785 1123538051 /nfs/dbraw/zinc/53/80/51/1123538051.db2.gz AYNAHWMKXDBQGS-JKSUJKDBSA-N 1 3 254.462 3.619 20 0 CHADHO CCN1CCC[C@H](C[NH2+]C[C@H](c2ccccc2)C(C)C)C1 ZINC000474604004 1123557288 /nfs/dbraw/zinc/55/72/88/1123557288.db2.gz PYMCCEIBJHDQEA-MJGOQNOKSA-N 1 3 288.479 3.748 20 0 CHADHO C[NH+](C)CC[C@H](N[C@@H]1CCc2c1cccc2F)C(C)(C)C ZINC000474934523 1123615782 /nfs/dbraw/zinc/61/57/82/1123615782.db2.gz QNNJHSLNGMHHRX-SJORKVTESA-N 1 3 292.442 3.769 20 0 CHADHO Cc1ccc([C@H](C)N[C@@H]2CC[N@H+](C)C(C)(C)C2)s1 ZINC000858106881 1123632136 /nfs/dbraw/zinc/63/21/36/1123632136.db2.gz CICXDQKOTPINGE-QWHCGFSZSA-N 1 3 266.454 3.580 20 0 CHADHO Cc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C)C(C)(C)C2)s1 ZINC000858106881 1123632137 /nfs/dbraw/zinc/63/21/37/1123632137.db2.gz CICXDQKOTPINGE-QWHCGFSZSA-N 1 3 266.454 3.580 20 0 CHADHO CN(C)[C@@H]1CCC[N@H+](CCCc2ccc(Cl)cc2)CC1 ZINC000429547358 1123726090 /nfs/dbraw/zinc/72/60/90/1123726090.db2.gz LEOFQULWZKBZEI-QGZVFWFLSA-N 1 3 294.870 3.689 20 0 CHADHO CN(C)[C@@H]1CCC[N@@H+](CCCc2ccc(Cl)cc2)CC1 ZINC000429547358 1123726091 /nfs/dbraw/zinc/72/60/91/1123726091.db2.gz LEOFQULWZKBZEI-QGZVFWFLSA-N 1 3 294.870 3.689 20 0 CHADHO C[NH+](C)[C@@H]1CCCN(CCCc2ccc(Cl)cc2)CC1 ZINC000429547358 1123726094 /nfs/dbraw/zinc/72/60/94/1123726094.db2.gz LEOFQULWZKBZEI-QGZVFWFLSA-N 1 3 294.870 3.689 20 0 CHADHO Cc1ccc([C@@H]2CCCCN2C[C@H]2CCC[NH2+]C2)cc1 ZINC000346982109 1123739104 /nfs/dbraw/zinc/73/91/04/1123739104.db2.gz MYSKPAHGRGJSRA-WMZOPIPTSA-N 1 3 272.436 3.522 20 0 CHADHO Cc1ccc2nccc(N[C@H]3CCC[C@H]([NH+](C)C)C3)c2c1 ZINC000302162790 1123958624 /nfs/dbraw/zinc/95/86/24/1123958624.db2.gz QBURYVNGKZQTPZ-GJZGRUSLSA-N 1 3 283.419 3.828 20 0 CHADHO Cc1ccc2c(c1)[C@@H](NC1CC[NH+](C3CCC3)CC1)CCC2 ZINC000339071892 1123971697 /nfs/dbraw/zinc/97/16/97/1123971697.db2.gz VELSONQZWJCGGF-FQEVSTJZSA-N 1 3 298.474 3.979 20 0 CHADHO CC(C)[NH+](CCCN[C@@H](C)CCc1cccnc1)C(C)C ZINC000866276629 1124046428 /nfs/dbraw/zinc/04/64/28/1124046428.db2.gz BQMRSXDQUSJTNB-KRWDZBQOSA-N 1 3 291.483 3.501 20 0 CHADHO Cc1csc([C@@H](C)NCCC2CC[NH+](C(C)C)CC2)n1 ZINC000866470111 1124069289 /nfs/dbraw/zinc/06/92/89/1124069289.db2.gz RQDILUZXPYXGPC-CQSZACIVSA-N 1 3 295.496 3.613 20 0 CHADHO FC(F)(F)CCC[NH2+]C1CCN(CC2CCCC2)CC1 ZINC001119943365 1131267460 /nfs/dbraw/zinc/26/74/60/1131267460.db2.gz NWAXLEVJBFIMRS-UHFFFAOYSA-N 1 3 292.389 3.573 20 0 CHADHO CC(C)CCC[NH2+][C@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000527354873 1124572705 /nfs/dbraw/zinc/57/27/05/1124572705.db2.gz BXCVHYBFSCWJIB-CVEARBPZSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H](C)CC(C)(C)C)C1 ZINC000449129832 1124652543 /nfs/dbraw/zinc/65/25/43/1124652543.db2.gz DRVBQLVPOUGJNB-LSDHHAIUSA-N 1 3 254.462 3.521 20 0 CHADHO CSCC1CCC([NH2+]C[C@H]2CCCN(C(C)C)C2)CC1 ZINC000449131674 1124654017 /nfs/dbraw/zinc/65/40/17/1124654017.db2.gz OSRGFQTVSYQQNJ-AQFXKWCLSA-N 1 3 298.540 3.618 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1cc(F)cc(F)c1 ZINC000449177465 1124661124 /nfs/dbraw/zinc/66/11/24/1124661124.db2.gz VTCSNAQJLAYUJD-CSMYWGQOSA-N 1 3 296.405 3.531 20 0 CHADHO CC(C)=CCNC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449278654 1124682040 /nfs/dbraw/zinc/68/20/40/1124682040.db2.gz LFHDNGBGAZXWQG-KRWDZBQOSA-N 1 3 286.463 3.638 20 0 CHADHO CN1CCCC[C@H]1CC[N@H+](C)C[C@H]1CCCCC1(F)F ZINC000450439370 1125026021 /nfs/dbraw/zinc/02/60/21/1125026021.db2.gz MLWOKNKTYPXDHW-CABCVRRESA-N 1 3 288.426 3.618 20 0 CHADHO CN1CCCC[C@H]1CC[N@@H+](C)C[C@H]1CCCCC1(F)F ZINC000450439370 1125026029 /nfs/dbraw/zinc/02/60/29/1125026029.db2.gz MLWOKNKTYPXDHW-CABCVRRESA-N 1 3 288.426 3.618 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)C[C@@H]2CCCCC2(F)F)C[C@@H]1C ZINC000450471563 1125038800 /nfs/dbraw/zinc/03/88/00/1125038800.db2.gz WFYGGSOBCWDXMJ-KKUMJFAQSA-N 1 3 288.426 3.617 20 0 CHADHO c1ccc(C2CCC([NH2+][C@@H]3CCNC34CCC4)CC2)cc1 ZINC000530176115 1125129931 /nfs/dbraw/zinc/12/99/31/1125129931.db2.gz BLZWEXYHQVAQBQ-DAWZGUTISA-N 1 3 284.447 3.587 20 0 CHADHO CC[NH2+]CC1CCN([C@H](C)c2cccc(Cl)c2)CC1 ZINC000131467353 1125392602 /nfs/dbraw/zinc/39/26/02/1125392602.db2.gz KJVONGDAHAZAAF-CYBMUJFWSA-N 1 3 280.843 3.723 20 0 CHADHO CC(C)C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCN(C(C)C)C2)C1 ZINC000230770223 1125395847 /nfs/dbraw/zinc/39/58/47/1125395847.db2.gz PDTVREQOONSWSO-BZSNNMDCSA-N 1 3 280.500 3.911 20 0 CHADHO C[C@@H]1CC[C@H](N[C@@H](C[NH3+])c2ccc3ccccc3c2)C1 ZINC000131642968 1125403318 /nfs/dbraw/zinc/40/33/18/1125403318.db2.gz HOPZDBDYOOZPMX-BVGQSLNGSA-N 1 3 268.404 3.618 20 0 CHADHO CC(C)[C@H](NC1CC[NH+](C(C)C)CC1)c1ccc(F)cc1 ZINC000035016489 1125422707 /nfs/dbraw/zinc/42/27/07/1125422707.db2.gz FXDNEMUJFHZULW-SFHVURJKSA-N 1 3 292.442 3.985 20 0 CHADHO CC[C@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)c1ccc(F)cc1 ZINC000125950450 1125452850 /nfs/dbraw/zinc/45/28/50/1125452850.db2.gz UQCPYZUWSBXLLW-QAPCUYQASA-N 1 3 292.442 3.987 20 0 CHADHO C[N@@H+](Cc1ccccc1)CC1CCN(Cc2ccoc2)CC1 ZINC000093006852 1129415325 /nfs/dbraw/zinc/41/53/25/1129415325.db2.gz JKGUADSNQUEZCE-UHFFFAOYSA-N 1 3 298.430 3.624 20 0 CHADHO C[N@H+](Cc1ccccc1)CC1CCN(Cc2ccoc2)CC1 ZINC000093006852 1129415326 /nfs/dbraw/zinc/41/53/26/1129415326.db2.gz JKGUADSNQUEZCE-UHFFFAOYSA-N 1 3 298.430 3.624 20 0 CHADHO CC[NH+](CC)CC1CCN(Cc2cccc(Cl)c2)CC1 ZINC000642643463 1129422999 /nfs/dbraw/zinc/42/29/99/1129422999.db2.gz PIZCGLNXQGFVSU-UHFFFAOYSA-N 1 3 294.870 3.894 20 0 CHADHO NC[C@@H]1CCC[C@@H]1[NH2+]CCc1ccc(-c2ccccc2)cc1 ZINC000643467720 1129442529 /nfs/dbraw/zinc/44/25/29/1129442529.db2.gz XGGPLUBUFGTDBF-PMACEKPBSA-N 1 3 294.442 3.613 20 0 CHADHO Cc1ccc(C[C@H]([NH2+][C@H]2CCNC3(CCC3)C2)C2CC2)cc1 ZINC000643548176 1129445682 /nfs/dbraw/zinc/44/56/82/1129445682.db2.gz NMPDKVKYYYRQGF-OALUTQOASA-N 1 3 298.474 3.580 20 0 CHADHO C1CC2(C1)C[C@H]([NH2+][C@@H]1CCCC13CCCCC3)CCN2 ZINC000643548697 1129446283 /nfs/dbraw/zinc/44/62/83/1129446283.db2.gz TYGBRWYIVLCMOY-HZPDHXFCSA-N 1 3 276.468 3.754 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)C1 ZINC000250520303 1129483194 /nfs/dbraw/zinc/48/31/94/1129483194.db2.gz SLSWYLUJORKMEP-BRSBDYLESA-N 1 3 278.484 3.665 20 0 CHADHO C[C@@H]1SCC[C@H]1[NH2+]C1CCN([C@H]2CCC[C@@H](C)C2)CC1 ZINC000647357646 1129575276 /nfs/dbraw/zinc/57/52/76/1129575276.db2.gz GELKQOTWADHWBF-YQFWSFKMSA-N 1 3 296.524 3.513 20 0 CHADHO CC[C@H]1CN(CCCc2cccc3ccccc32)CC[C@H]1[NH3+] ZINC000647936280 1129587768 /nfs/dbraw/zinc/58/77/68/1129587768.db2.gz ATUGROIZTGPUIP-OXJNMPFZSA-N 1 3 296.458 3.832 20 0 CHADHO CC[C@H]1C[N@H+](CCCc2cccc3ccccc32)CC[C@H]1N ZINC000647936280 1129587771 /nfs/dbraw/zinc/58/77/71/1129587771.db2.gz ATUGROIZTGPUIP-OXJNMPFZSA-N 1 3 296.458 3.832 20 0 CHADHO CC[C@H]1C[N@@H+](CCCc2cccc3ccccc32)CC[C@H]1N ZINC000647936280 1129587775 /nfs/dbraw/zinc/58/77/75/1129587775.db2.gz ATUGROIZTGPUIP-OXJNMPFZSA-N 1 3 296.458 3.832 20 0 CHADHO C[C@@H]1CCC[C@H](C[NH+]2CCC(N3CCCCC3)CC2)C1 ZINC001459317098 1129628463 /nfs/dbraw/zinc/62/84/63/1129628463.db2.gz ROEJPMQPKKBWQI-SJORKVTESA-N 1 3 278.484 3.763 20 0 CHADHO C[C@@H]1CCC[C@H](CN2CCC([NH+]3CCCCC3)CC2)C1 ZINC001459317098 1129628466 /nfs/dbraw/zinc/62/84/66/1129628466.db2.gz ROEJPMQPKKBWQI-SJORKVTESA-N 1 3 278.484 3.763 20 0 CHADHO CC[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(C)cc1 ZINC001169099322 1129696342 /nfs/dbraw/zinc/69/63/42/1129696342.db2.gz PTUGUJFWLZWPPQ-FJIDUMEYSA-N 1 3 272.436 3.661 20 0 CHADHO CC[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(C)cc1 ZINC001169099322 1129696343 /nfs/dbraw/zinc/69/63/43/1129696343.db2.gz PTUGUJFWLZWPPQ-FJIDUMEYSA-N 1 3 272.436 3.661 20 0 CHADHO CC(C)[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001169101271 1129697380 /nfs/dbraw/zinc/69/73/80/1129697380.db2.gz QEOAHCNKLZYPHX-XMTFNYHQSA-N 1 3 290.426 3.738 20 0 CHADHO CC(C)[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001169101271 1129697383 /nfs/dbraw/zinc/69/73/83/1129697383.db2.gz QEOAHCNKLZYPHX-XMTFNYHQSA-N 1 3 290.426 3.738 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](NCc1cccc3ccccc31)C2 ZINC001169077959 1129697473 /nfs/dbraw/zinc/69/74/73/1129697473.db2.gz CKDFJJVMCLZJRS-BCDXTJNWSA-N 1 3 280.415 3.555 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](NCc1cccc3ccccc31)C2 ZINC001169077959 1129697475 /nfs/dbraw/zinc/69/74/75/1129697475.db2.gz CKDFJJVMCLZJRS-BCDXTJNWSA-N 1 3 280.415 3.555 20 0 CHADHO CN(Cc1cccc2ccccc21)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169140216 1129699841 /nfs/dbraw/zinc/69/98/41/1129699841.db2.gz JBEWJOISIFYIPK-REPLKXPHSA-N 1 3 294.442 3.897 20 0 CHADHO CN(Cc1cccc2ccccc21)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169140216 1129699842 /nfs/dbraw/zinc/69/98/42/1129699842.db2.gz JBEWJOISIFYIPK-REPLKXPHSA-N 1 3 294.442 3.897 20 0 CHADHO CC[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cc(C)ccc1C ZINC001169118045 1129700124 /nfs/dbraw/zinc/70/01/24/1129700124.db2.gz CHDBQHLOVBOBGA-SFNKJDCFSA-N 1 3 286.463 3.969 20 0 CHADHO CC[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc(C)ccc1C ZINC001169118045 1129700126 /nfs/dbraw/zinc/70/01/26/1129700126.db2.gz CHDBQHLOVBOBGA-SFNKJDCFSA-N 1 3 286.463 3.969 20 0 CHADHO CC[NH+]1CCC(N[C@H](CC2CC2)c2cccc(F)c2)CC1 ZINC001169241201 1129712454 /nfs/dbraw/zinc/71/24/54/1129712454.db2.gz JQYOEBWTMCIQMC-GOSISDBHSA-N 1 3 290.426 3.741 20 0 CHADHO C(C1CCCCC1)N1CCC([NH2+][C@H]2CCCSC2)CC1 ZINC000769018120 1129889032 /nfs/dbraw/zinc/88/90/32/1129889032.db2.gz QRRWFRSTTWZVCS-KRWDZBQOSA-N 1 3 296.524 3.516 20 0 CHADHO C[C@]1(C[NH3+])CCCCN(Cc2ccc3ccsc3c2)C1 ZINC001206563935 1129996598 /nfs/dbraw/zinc/99/65/98/1129996598.db2.gz KYSYUSRKHQFTQM-QGZVFWFLSA-N 1 3 288.460 3.852 20 0 CHADHO COc1cc([C@H](C)N[C@H](C)C[C@@H](C)[NH3+])cc2ccccc21 ZINC000902514704 1130018293 /nfs/dbraw/zinc/01/82/93/1130018293.db2.gz USBCXDUTCMTHLW-MCIONIFRSA-N 1 3 286.419 3.625 20 0 CHADHO CCC[C@H](N[C@H](CC[NH+](C)C)c1cccnc1)C1CCC1 ZINC000903376335 1130168164 /nfs/dbraw/zinc/16/81/64/1130168164.db2.gz BUTILFIIIAPDOY-ZWKOTPCHSA-N 1 3 289.467 3.633 20 0 CHADHO CCCC[C@@H](CC)N[C@@H](CC[NH+](C)C)c1cccnc1 ZINC000903383782 1130168971 /nfs/dbraw/zinc/16/89/71/1130168971.db2.gz OOOBHUQYIDKCFU-SJORKVTESA-N 1 3 277.456 3.633 20 0 CHADHO CC[C@H](NC[C@H]([NH3+])CC(F)F)c1cccc2ccccc21 ZINC000903959997 1130213265 /nfs/dbraw/zinc/21/32/65/1130213265.db2.gz URDGGWKHLQTNFR-CJNGLKHVSA-N 1 3 292.373 3.863 20 0 CHADHO C[C@@H]1CC[C@@H](N2CCC([NH3+])(c3ccc(Cl)cc3)CC2)C1 ZINC001170122408 1130282891 /nfs/dbraw/zinc/28/28/91/1130282891.db2.gz QDTAGZXFWCXVIX-CZUORRHYSA-N 1 3 292.854 3.778 20 0 CHADHO C(CN1CCC[C@@H](C2CC2)C1)C[N@@H+]1CCC[C@@H](C2CC2)C1 ZINC000677056887 1130285709 /nfs/dbraw/zinc/28/57/09/1130285709.db2.gz KOTPVLVEXKUJFK-RTBURBONSA-N 1 3 290.495 3.621 20 0 CHADHO C(CN1CCC[C@@H](C2CC2)C1)C[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000677056887 1130285711 /nfs/dbraw/zinc/28/57/11/1130285711.db2.gz KOTPVLVEXKUJFK-RTBURBONSA-N 1 3 290.495 3.621 20 0 CHADHO C[C@@H](CSC(C)(C)C)[NH2+]CC(C)(C)CN1CCCC1 ZINC000790751974 1130328284 /nfs/dbraw/zinc/32/82/84/1130328284.db2.gz ZGNQFAXMWUPLKR-AWEZNQCLSA-N 1 3 286.529 3.618 20 0 CHADHO CCC(CC)C[NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000679738934 1130552844 /nfs/dbraw/zinc/55/28/44/1130552844.db2.gz GVHQFAIWSVLKPB-GOEBONIOSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@H]([NH2+]CC1CCCCC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000679740022 1130554978 /nfs/dbraw/zinc/55/49/78/1130554978.db2.gz UALZJBJEAYUSSD-DOTOQJQBSA-N 1 3 278.484 3.809 20 0 CHADHO c1cc(C2CC2)ccc1C[N@@H+]1CCCCC12CCNCC2 ZINC001235190594 1130720678 /nfs/dbraw/zinc/72/06/78/1130720678.db2.gz XFVWQGGRTBFHDM-UHFFFAOYSA-N 1 3 284.447 3.672 20 0 CHADHO c1cc(C2CC2)ccc1C[N@H+]1CCCCC12CCNCC2 ZINC001235190594 1130720681 /nfs/dbraw/zinc/72/06/81/1130720681.db2.gz XFVWQGGRTBFHDM-UHFFFAOYSA-N 1 3 284.447 3.672 20 0 CHADHO c1cc(C2CC2)ccc1CN1CCCCC12CC[NH2+]CC2 ZINC001235190594 1130720683 /nfs/dbraw/zinc/72/06/83/1130720683.db2.gz XFVWQGGRTBFHDM-UHFFFAOYSA-N 1 3 284.447 3.672 20 0 CHADHO CC/C=C\CCCN1CC[C@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001235380878 1130736868 /nfs/dbraw/zinc/73/68/68/1130736868.db2.gz WUZMBQIBENPBAU-QZPVUJMKSA-N 1 3 298.474 3.812 20 0 CHADHO Cc1ccccc1[C@H]1CCCN1CC[C@@H]1CCCC[NH2+]1 ZINC001235446275 1130745416 /nfs/dbraw/zinc/74/54/16/1130745416.db2.gz XNNXGZJPYGALAC-FUHWJXTLSA-N 1 3 272.436 3.664 20 0 CHADHO [NH3+]CCCCCCN1CCC[C@H]1c1cc(F)ccc1F ZINC001235712513 1130772370 /nfs/dbraw/zinc/77/23/70/1130772370.db2.gz BLAXWPZZXZMHBA-INIZCTEOSA-N 1 3 282.378 3.621 20 0 CHADHO C[C@H](C[NH2+]Cc1ccccc1-c1ccccc1)CN(C)C ZINC000813784748 1130783360 /nfs/dbraw/zinc/78/33/60/1130783360.db2.gz QFMXUPZYFOVRIO-MRXNPFEDSA-N 1 3 282.431 3.641 20 0 CHADHO C[C@H](CNCc1ccccc1-c1ccccc1)C[NH+](C)C ZINC000813784748 1130783367 /nfs/dbraw/zinc/78/33/67/1130783367.db2.gz QFMXUPZYFOVRIO-MRXNPFEDSA-N 1 3 282.431 3.641 20 0 CHADHO Cc1c(C[N@H+]2C[C@@H](N)CC[C@@H]2C)cccc1-c1ccccc1 ZINC001235891745 1130795384 /nfs/dbraw/zinc/79/53/84/1130795384.db2.gz IQJMHKCVFVLDFS-KXBFYZLASA-N 1 3 294.442 3.974 20 0 CHADHO Cc1c(C[N@@H+]2C[C@@H](N)CC[C@@H]2C)cccc1-c1ccccc1 ZINC001235891745 1130795389 /nfs/dbraw/zinc/79/53/89/1130795389.db2.gz IQJMHKCVFVLDFS-KXBFYZLASA-N 1 3 294.442 3.974 20 0 CHADHO C[C@@H]1CC[C@@H](N)C[N@@H+]1Cc1ccccc1-c1ccccc1 ZINC001235906860 1130803227 /nfs/dbraw/zinc/80/32/27/1130803227.db2.gz OZXZIDCWXSTSBK-CRAIPNDOSA-N 1 3 280.415 3.665 20 0 CHADHO C[C@@H]1CC[C@@H](N)C[N@H+]1Cc1ccccc1-c1ccccc1 ZINC001235906860 1130803231 /nfs/dbraw/zinc/80/32/31/1130803231.db2.gz OZXZIDCWXSTSBK-CRAIPNDOSA-N 1 3 280.415 3.665 20 0 CHADHO Cc1cc(Cl)cc(C)c1CN1CC2(C1)CCC[NH2+]CC2 ZINC001236004133 1130828745 /nfs/dbraw/zinc/82/87/45/1130828745.db2.gz BWMCZGNBJXUQQG-UHFFFAOYSA-N 1 3 292.854 3.532 20 0 CHADHO CCC[N@H+](Cc1ccc2ccn(CC)c2c1)C1CCNCC1 ZINC001236182237 1130880610 /nfs/dbraw/zinc/88/06/10/1130880610.db2.gz HXDAELBGGPETCA-UHFFFAOYSA-N 1 3 299.462 3.625 20 0 CHADHO CCC[N@@H+](Cc1ccc2ccn(CC)c2c1)C1CCNCC1 ZINC001236182237 1130880617 /nfs/dbraw/zinc/88/06/17/1130880617.db2.gz HXDAELBGGPETCA-UHFFFAOYSA-N 1 3 299.462 3.625 20 0 CHADHO CCCN(Cc1ccc2ccn(CC)c2c1)C1CC[NH2+]CC1 ZINC001236182237 1130880623 /nfs/dbraw/zinc/88/06/23/1130880623.db2.gz HXDAELBGGPETCA-UHFFFAOYSA-N 1 3 299.462 3.625 20 0 CHADHO Cc1c2ccccc2sc1C[N@@H+](C)C1(C)CCNCC1 ZINC001236226666 1130897815 /nfs/dbraw/zinc/89/78/15/1130897815.db2.gz QUWKBNLXOLJMRW-UHFFFAOYSA-N 1 3 288.460 3.784 20 0 CHADHO Cc1c2ccccc2sc1C[N@H+](C)C1(C)CCNCC1 ZINC001236226666 1130897821 /nfs/dbraw/zinc/89/78/21/1130897821.db2.gz QUWKBNLXOLJMRW-UHFFFAOYSA-N 1 3 288.460 3.784 20 0 CHADHO Cc1c2ccccc2sc1CN(C)C1(C)CC[NH2+]CC1 ZINC001236226666 1130897825 /nfs/dbraw/zinc/89/78/25/1130897825.db2.gz QUWKBNLXOLJMRW-UHFFFAOYSA-N 1 3 288.460 3.784 20 0 CHADHO [NH3+]Cc1ccccc1-c1ccc(CN2CCCCC2)c(F)c1 ZINC001236251978 1130906156 /nfs/dbraw/zinc/90/61/56/1130906156.db2.gz VXHVCLXOWWRNLM-UHFFFAOYSA-N 1 3 298.405 3.937 20 0 CHADHO C[C@H](CC[N@H+](C[C@H]1CCCNC1)C1CC1)CC(C)(C)C ZINC001236584548 1130980756 /nfs/dbraw/zinc/98/07/56/1130980756.db2.gz LURVNLRTXIGCKM-CVEARBPZSA-N 1 3 280.500 3.913 20 0 CHADHO C[C@H](CC[N@@H+](C[C@H]1CCCNC1)C1CC1)CC(C)(C)C ZINC001236584548 1130980758 /nfs/dbraw/zinc/98/07/58/1130980758.db2.gz LURVNLRTXIGCKM-CVEARBPZSA-N 1 3 280.500 3.913 20 0 CHADHO Cc1cccc(-c2ccc(CN3CC[C@](C)(C[NH3+])C3)cc2)c1 ZINC001236618150 1130985604 /nfs/dbraw/zinc/98/56/04/1130985604.db2.gz YYDOENLZWACYOJ-HXUWFJFHSA-N 1 3 294.442 3.833 20 0 CHADHO CC(C)c1ccc(C[N@H+](C2CCC2)C2CCNCC2)cc1 ZINC001236633408 1130986232 /nfs/dbraw/zinc/98/62/32/1130986232.db2.gz HACIPIAKCSWQHB-UHFFFAOYSA-N 1 3 286.463 3.917 20 0 CHADHO CC(C)c1ccc(C[N@@H+](C2CCC2)C2CCNCC2)cc1 ZINC001236633408 1130986239 /nfs/dbraw/zinc/98/62/39/1130986239.db2.gz HACIPIAKCSWQHB-UHFFFAOYSA-N 1 3 286.463 3.917 20 0 CHADHO CC(C)c1ccc(CN(C2CCC2)C2CC[NH2+]CC2)cc1 ZINC001236633408 1130986243 /nfs/dbraw/zinc/98/62/43/1130986243.db2.gz HACIPIAKCSWQHB-UHFFFAOYSA-N 1 3 286.463 3.917 20 0 CHADHO Cc1ccc(CN(C2CCC2)C2CC[NH2+]CC2)cc1Cl ZINC001236637159 1130987186 /nfs/dbraw/zinc/98/71/86/1130987186.db2.gz NMCCONKZJFOKQY-UHFFFAOYSA-N 1 3 292.854 3.755 20 0 CHADHO Cc1ccc(C[N@H+](C2CCC2)C2CCNCC2)cc1Cl ZINC001236637159 1130987189 /nfs/dbraw/zinc/98/71/89/1130987189.db2.gz NMCCONKZJFOKQY-UHFFFAOYSA-N 1 3 292.854 3.755 20 0 CHADHO Cc1ccc(C[N@@H+](C2CCC2)C2CCNCC2)cc1Cl ZINC001236637159 1130987193 /nfs/dbraw/zinc/98/71/93/1130987193.db2.gz NMCCONKZJFOKQY-UHFFFAOYSA-N 1 3 292.854 3.755 20 0 CHADHO C[N@H+](CCCN1CCCC1)Cc1cccc2sccc21 ZINC001236678826 1130992755 /nfs/dbraw/zinc/99/27/55/1130992755.db2.gz HTFPHSGAPRGKRR-UHFFFAOYSA-N 1 3 288.460 3.819 20 0 CHADHO C[N@@H+](CCCN1CCCC1)Cc1cccc2sccc21 ZINC001236678826 1130992759 /nfs/dbraw/zinc/99/27/59/1130992759.db2.gz HTFPHSGAPRGKRR-UHFFFAOYSA-N 1 3 288.460 3.819 20 0 CHADHO Cc1cc(F)ccc1[C@@H](C)[NH2+]C1CCN(CC(C)C)CC1 ZINC000815557197 1130999721 /nfs/dbraw/zinc/99/97/21/1130999721.db2.gz OLNSWVAGGXJPKI-OAHLLOKOSA-N 1 3 292.442 3.905 20 0 CHADHO Cc1ccc(-c2ccc(C[N@H+]3C[C@@H](N)C[C@H]3C)cc2)cc1 ZINC001237203659 1131070941 /nfs/dbraw/zinc/07/09/41/1131070941.db2.gz JSZJGXDSLRDYOW-BEFAXECRSA-N 1 3 280.415 3.584 20 0 CHADHO Cc1ccc(-c2ccc(C[N@@H+]3C[C@@H](N)C[C@H]3C)cc2)cc1 ZINC001237203659 1131070944 /nfs/dbraw/zinc/07/09/44/1131070944.db2.gz JSZJGXDSLRDYOW-BEFAXECRSA-N 1 3 280.415 3.584 20 0 CHADHO CN1CCCC[C@@H]1CC[N@H+](C)[C@H]1CCc2c1cccc2F ZINC001116195864 1131132844 /nfs/dbraw/zinc/13/28/44/1131132844.db2.gz QMWXUAPYRHUJPX-KDOFPFPSSA-N 1 3 290.426 3.619 20 0 CHADHO CN1CCCC[C@@H]1CC[N@@H+](C)[C@H]1CCc2c1cccc2F ZINC001116195864 1131132850 /nfs/dbraw/zinc/13/28/50/1131132850.db2.gz QMWXUAPYRHUJPX-KDOFPFPSSA-N 1 3 290.426 3.619 20 0 CHADHO CC(C)C1=NCCc2ccc(C[NH+]3CCCCC3)cc21 ZINC001237880690 1131147988 /nfs/dbraw/zinc/14/79/88/1131147988.db2.gz IQLUWUKITKVHMN-UHFFFAOYSA-N 1 3 270.420 3.674 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+](C)CCC3CC3)cc21 ZINC001237890634 1131148792 /nfs/dbraw/zinc/14/87/92/1131148792.db2.gz ZZJUTQWUUXFMIK-UHFFFAOYSA-N 1 3 284.447 3.920 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+](C)CCC3CC3)cc21 ZINC001237890634 1131148794 /nfs/dbraw/zinc/14/87/94/1131148794.db2.gz ZZJUTQWUUXFMIK-UHFFFAOYSA-N 1 3 284.447 3.920 20 0 CHADHO CCCCCC[C@H](C)[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000817893197 1131187296 /nfs/dbraw/zinc/18/72/96/1131187296.db2.gz QMIAJQPGTGWKTR-UONOGXRCSA-N 1 3 277.456 3.858 20 0 CHADHO C[C@@H](N[C@H](c1ccccc1)C1CCCCC1)C1C[NH2+]C1 ZINC000817909103 1131187767 /nfs/dbraw/zinc/18/77/67/1131187767.db2.gz XULLHUZBBPOQIN-RDTXWAMCSA-N 1 3 272.436 3.506 20 0 CHADHO CCOc1cccc([C@H](C)NCc2ccc3c(c2)C[NH2+]C3)c1 ZINC000817969010 1131193539 /nfs/dbraw/zinc/19/35/39/1131193539.db2.gz PHMFNHMSESGBCZ-AWEZNQCLSA-N 1 3 296.414 3.539 20 0 CHADHO CC[C@@]1(CN[C@@H](C)C[C@@H](C)CC(C)C)CCC[NH2+]1 ZINC001246458547 1131507773 /nfs/dbraw/zinc/50/77/73/1131507773.db2.gz YYEICPCFZHGKSE-JYJNAYRXSA-N 1 3 254.462 3.569 20 0 CHADHO C[C@@H]1[C@@H](CN)CCC[N@@H+]1[C@@H]1CCCC2(CCCCC2)C1 ZINC001246565081 1131631192 /nfs/dbraw/zinc/63/11/92/1131631192.db2.gz OORMQGCWPDPDOL-BRWVUGGUSA-N 1 3 278.484 3.939 20 0 CHADHO C[C@@H]1[C@@H](CN)CCC[N@H+]1[C@@H]1CCCC2(CCCCC2)C1 ZINC001246565081 1131631195 /nfs/dbraw/zinc/63/11/95/1131631195.db2.gz OORMQGCWPDPDOL-BRWVUGGUSA-N 1 3 278.484 3.939 20 0 CHADHO CN1CC[C@]2(CC[N@H+](Cc3ccc(F)c4ccccc34)C2)C1 ZINC001139891502 1131647381 /nfs/dbraw/zinc/64/73/81/1131647381.db2.gz ATPMXHBLQRXMMP-IBGZPJMESA-N 1 3 298.405 3.507 20 0 CHADHO CN1CC[C@]2(CC[N@@H+](Cc3ccc(F)c4ccccc34)C2)C1 ZINC001139891502 1131647382 /nfs/dbraw/zinc/64/73/82/1131647382.db2.gz ATPMXHBLQRXMMP-IBGZPJMESA-N 1 3 298.405 3.507 20 0 CHADHO C[C@@H]1CCC[N@@H+]([C@H]2CCNC3(CCCCC3)C2)C[C@@H]1C ZINC001246577431 1131664929 /nfs/dbraw/zinc/66/49/29/1131664929.db2.gz WLTYRIYXCQNGGH-IKGGRYGDSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H]1CCC[N@H+]([C@H]2CCNC3(CCCCC3)C2)C[C@@H]1C ZINC001246577431 1131664931 /nfs/dbraw/zinc/66/49/31/1131664931.db2.gz WLTYRIYXCQNGGH-IKGGRYGDSA-N 1 3 278.484 3.809 20 0 CHADHO CCN(CCC[NH+](C)C)Cc1ccccc1-c1cccnc1 ZINC001140318612 1131695506 /nfs/dbraw/zinc/69/55/06/1131695506.db2.gz FLPCDSNPAOPSSP-UHFFFAOYSA-N 1 3 297.446 3.522 20 0 CHADHO CCCC1CCC([N@@H+]2CCC[C@]23CCCNC3)CC1 ZINC001246605700 1131714239 /nfs/dbraw/zinc/71/42/39/1131714239.db2.gz CJLOGFOYQOCRSW-JCYILVPMSA-N 1 3 264.457 3.563 20 0 CHADHO CCCC1CCC([N@H+]2CCC[C@]23CCCNC3)CC1 ZINC001246605700 1131714243 /nfs/dbraw/zinc/71/42/43/1131714243.db2.gz CJLOGFOYQOCRSW-JCYILVPMSA-N 1 3 264.457 3.563 20 0 CHADHO C[C@@H]1C[C@@H]([N@@H+]2CCC[C@]3(CCCCN3)C2)CC(C)(C)C1 ZINC001246614158 1131718116 /nfs/dbraw/zinc/71/81/16/1131718116.db2.gz MNXWGLQKFDMUFJ-JFIYKMOQSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H]1C[C@@H]([N@H+]2CCC[C@]3(CCCCN3)C2)CC(C)(C)C1 ZINC001246614158 1131718119 /nfs/dbraw/zinc/71/81/19/1131718119.db2.gz MNXWGLQKFDMUFJ-JFIYKMOQSA-N 1 3 278.484 3.809 20 0 CHADHO CCCCC(CCCC)[N@@H+]1C[C@H](CF)[C@H](C2(N)CC2)C1 ZINC001246698426 1131781091 /nfs/dbraw/zinc/78/10/91/1131781091.db2.gz XWNICBXKUHTFET-GOEBONIOSA-N 1 3 284.463 3.744 20 0 CHADHO CCCCC(CCCC)[N@H+]1C[C@H](CF)[C@H](C2(N)CC2)C1 ZINC001246698426 1131781097 /nfs/dbraw/zinc/78/10/97/1131781097.db2.gz XWNICBXKUHTFET-GOEBONIOSA-N 1 3 284.463 3.744 20 0 CHADHO CCCCCC[C@@H](CC)[N@H+](C)C[C@H]1CCCNC1 ZINC001246839114 1131787612 /nfs/dbraw/zinc/78/76/12/1131787612.db2.gz BIFXJABYPFDAEN-JKSUJKDBSA-N 1 3 254.462 3.667 20 0 CHADHO CCCCCC[C@@H](CC)[N@@H+](C)C[C@H]1CCCNC1 ZINC001246839114 1131787616 /nfs/dbraw/zinc/78/76/16/1131787616.db2.gz BIFXJABYPFDAEN-JKSUJKDBSA-N 1 3 254.462 3.667 20 0 CHADHO CCCCN1CCC([N@H+](C)Cc2cc(F)ccc2C)CC1 ZINC001140592236 1131815355 /nfs/dbraw/zinc/81/53/55/1131815355.db2.gz BLCICNCXZAFQLL-UHFFFAOYSA-N 1 3 292.442 3.830 20 0 CHADHO CCCCN1CCC([N@@H+](C)Cc2cc(F)ccc2C)CC1 ZINC001140592236 1131815359 /nfs/dbraw/zinc/81/53/59/1131815359.db2.gz BLCICNCXZAFQLL-UHFFFAOYSA-N 1 3 292.442 3.830 20 0 CHADHO CCCC[C@H]1C[C@@H]([N@H+](C)[C@H]2CC[C@H](C)CC2)CCN1 ZINC001246995023 1131837593 /nfs/dbraw/zinc/83/75/93/1131837593.db2.gz FELLKIDXSUHQBZ-QAETUUGQSA-N 1 3 266.473 3.808 20 0 CHADHO CCCC[C@H]1C[C@@H]([N@@H+](C)[C@H]2CC[C@H](C)CC2)CCN1 ZINC001246995023 1131837602 /nfs/dbraw/zinc/83/76/02/1131837602.db2.gz FELLKIDXSUHQBZ-QAETUUGQSA-N 1 3 266.473 3.808 20 0 CHADHO CCC1([NH3+])CCN(Cc2cccc3ccccc32)CC1 ZINC000714749640 1131975956 /nfs/dbraw/zinc/97/59/56/1131975956.db2.gz HCGUQYZIIUKWNP-UHFFFAOYSA-N 1 3 268.404 3.543 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CC1(C)C ZINC001171623244 1132067051 /nfs/dbraw/zinc/06/70/51/1132067051.db2.gz QAHUGQHEHQHYCF-BPUTZDHNSA-N 1 3 278.484 3.806 20 0 CHADHO C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)N2C)c1ccc(F)cc1F ZINC001172104330 1132131016 /nfs/dbraw/zinc/13/10/16/1132131016.db2.gz DXKRDXCWDWTJQQ-CYUUQNCZSA-N 1 3 294.389 3.631 20 0 CHADHO Cc1ccc(F)cc1[C@H](C)N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172115615 1132132695 /nfs/dbraw/zinc/13/26/95/1132132695.db2.gz TZSARIAFJBTWLV-QSPRXWTASA-N 1 3 290.426 3.800 20 0 CHADHO Cc1ccc(F)cc1[C@H](C)N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172115615 1132132699 /nfs/dbraw/zinc/13/26/99/1132132699.db2.gz TZSARIAFJBTWLV-QSPRXWTASA-N 1 3 290.426 3.800 20 0 CHADHO CC[C@H](CC(C)C)[NH2+]CCCN1CCCC[C@@H]1C ZINC001172390274 1132214980 /nfs/dbraw/zinc/21/49/80/1132214980.db2.gz SIGCFIWFZNPWEU-JKSUJKDBSA-N 1 3 254.462 3.665 20 0 CHADHO CCCN1C[C@@H]2C[N@H+]([C@@H]3CC[C@@H](c4ccccc4)C3)C[C@@H]2C1 ZINC001172570833 1132271933 /nfs/dbraw/zinc/27/19/33/1132271933.db2.gz XTHOEDAACKOKHX-YSTOQKLRSA-N 1 3 298.474 3.596 20 0 CHADHO CCCN1C[C@@H]2C[N@@H+]([C@@H]3CC[C@@H](c4ccccc4)C3)C[C@@H]2C1 ZINC001172570833 1132271940 /nfs/dbraw/zinc/27/19/40/1132271940.db2.gz XTHOEDAACKOKHX-YSTOQKLRSA-N 1 3 298.474 3.596 20 0 CHADHO C[C@H](Cc1c(F)cccc1Cl)[NH2+]C(C)(C)C(C)(C)N ZINC001172853058 1132339683 /nfs/dbraw/zinc/33/96/83/1132339683.db2.gz YBMNTKHQTWHIDW-SNVBAGLBSA-N 1 3 286.822 3.516 20 0 CHADHO C[C@H](Cc1c(F)cccc1Cl)NC(C)(C)C(C)(C)[NH3+] ZINC001172853058 1132339687 /nfs/dbraw/zinc/33/96/87/1132339687.db2.gz YBMNTKHQTWHIDW-SNVBAGLBSA-N 1 3 286.822 3.516 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+]C1CCC2(CCCCC2)CC1 ZINC001173116048 1132396431 /nfs/dbraw/zinc/39/64/31/1132396431.db2.gz NRPZGODSKKKTGE-QGZVFWFLSA-N 1 3 278.484 3.953 20 0 CHADHO CC[C@@H]1CC[C@H]([N@@H+](Cc2ccccc2)C[C@H](C)CN)C1 ZINC001173272853 1132437936 /nfs/dbraw/zinc/43/79/36/1132437936.db2.gz LNLCIFRWRUKATM-NUJGCVRESA-N 1 3 274.452 3.662 20 0 CHADHO CC[C@@H]1CC[C@H]([N@H+](Cc2ccccc2)C[C@H](C)CN)C1 ZINC001173272853 1132437937 /nfs/dbraw/zinc/43/79/37/1132437937.db2.gz LNLCIFRWRUKATM-NUJGCVRESA-N 1 3 274.452 3.662 20 0 CHADHO CC(C)[N@H+](CCCN)[C@H]1CCCC2(CCCCC2)C1 ZINC001173339841 1132466947 /nfs/dbraw/zinc/46/69/47/1132466947.db2.gz QPLSRBZQVIDYMZ-INIZCTEOSA-N 1 3 266.473 3.939 20 0 CHADHO CC(C)[N@@H+](CCCN)[C@H]1CCCC2(CCCCC2)C1 ZINC001173339841 1132466950 /nfs/dbraw/zinc/46/69/50/1132466950.db2.gz QPLSRBZQVIDYMZ-INIZCTEOSA-N 1 3 266.473 3.939 20 0 CHADHO [NH3+]C1C[C@H]2CCC[C@@H](C1)N2Cc1csc2ccccc12 ZINC000843053583 1132494720 /nfs/dbraw/zinc/49/47/20/1132494720.db2.gz CUIJMWDVYZFZFW-GOOCMWNKSA-N 1 3 286.444 3.746 20 0 CHADHO c1cc(Nc2ccc3c(c2)CC[NH2+]C3)cc(C2CCC2)n1 ZINC001159363863 1132833048 /nfs/dbraw/zinc/83/30/48/1132833048.db2.gz CQIUIAXJSHXUCM-UHFFFAOYSA-N 1 3 279.387 3.738 20 0 CHADHO Cc1nc2ccc(Nc3ccc(C4([NH3+])CCC4)cc3)cc2[nH]1 ZINC001159729268 1132900175 /nfs/dbraw/zinc/90/01/75/1132900175.db2.gz DBYBYUJFZGVLCR-UHFFFAOYSA-N 1 3 292.386 3.953 20 0 CHADHO CCC[N@H+]1C[C@H]2CN(Cc3cccc4ccccc43)C[C@H]2C1 ZINC001203989072 1133394808 /nfs/dbraw/zinc/39/48/08/1133394808.db2.gz SAVLQXYVRLAOEG-KDURUIRLSA-N 1 3 294.442 3.613 20 0 CHADHO CCC[N@@H+]1C[C@H]2CN(Cc3cccc4ccccc43)C[C@H]2C1 ZINC001203989072 1133394814 /nfs/dbraw/zinc/39/48/14/1133394814.db2.gz SAVLQXYVRLAOEG-KDURUIRLSA-N 1 3 294.442 3.613 20 0 CHADHO C[C@@]1(N)CC[N@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001204782257 1133485583 /nfs/dbraw/zinc/48/55/83/1133485583.db2.gz BJCKNUSESSBTRP-GOSISDBHSA-N 1 3 280.371 3.509 20 0 CHADHO C[C@@]1(N)CC[N@@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001204782257 1133485584 /nfs/dbraw/zinc/48/55/84/1133485584.db2.gz BJCKNUSESSBTRP-GOSISDBHSA-N 1 3 280.371 3.509 20 0 CHADHO CC(C)CCN1CCC([NH2+]C/C=C\c2ccccc2)CC1 ZINC001204984690 1133512757 /nfs/dbraw/zinc/51/27/57/1133512757.db2.gz NZZRPRQZTMNSRV-TWGQIWQCSA-N 1 3 286.463 3.800 20 0 CHADHO [NH3+][C@H]1CCCN(Cc2ccc(-c3ccccc3)s2)CC1 ZINC001205101274 1133529935 /nfs/dbraw/zinc/52/99/35/1133529935.db2.gz CSPLLFWVSAXESM-HNNXBMFYSA-N 1 3 286.444 3.728 20 0 CHADHO CCCCCCc1csc(CN2C[C@H](C)[C@H](C[NH3+])C2)c1 ZINC001205156170 1133538325 /nfs/dbraw/zinc/53/83/25/1133538325.db2.gz PQQSWGBHRKIMCS-GOEBONIOSA-N 1 3 294.508 3.898 20 0 CHADHO C[C@H]1CN(Cc2ccc(F)c(-c3ccccc3)c2)C[C@H]1C[NH3+] ZINC001205155973 1133538657 /nfs/dbraw/zinc/53/86/57/1133538657.db2.gz KGRBHNFHBDTWAM-WMLDXEAASA-N 1 3 298.405 3.519 20 0 CHADHO CCC(C)(C)c1ccc(CN2CC[C@@H](C)[C@H](C[NH3+])C2)cc1 ZINC001205305518 1133557773 /nfs/dbraw/zinc/55/77/73/1133557773.db2.gz SBEDSRHZOUYPBR-NVXWUHKLSA-N 1 3 288.479 3.791 20 0 CHADHO Cc1ccc(-c2cccc(C[N@H+]3CCNCC[C@H]3C)c2)cc1 ZINC001205331495 1133562560 /nfs/dbraw/zinc/56/25/60/1133562560.db2.gz GZEYPGIFMJDNAH-QGZVFWFLSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1ccc(-c2cccc(C[N@@H+]3CCNCC[C@H]3C)c2)cc1 ZINC001205331495 1133562562 /nfs/dbraw/zinc/56/25/62/1133562562.db2.gz GZEYPGIFMJDNAH-QGZVFWFLSA-N 1 3 294.442 3.846 20 0 CHADHO CC[C@H](C[C@@H](C)CC)[NH2+]CC(C)(C)CN1CCCC1 ZINC001205645659 1133598383 /nfs/dbraw/zinc/59/83/83/1133598383.db2.gz MXZZDFFMAOINHG-JKSUJKDBSA-N 1 3 268.489 3.913 20 0 CHADHO C[C@@H]1CC[C@H](CN)[N@H+](Cc2ccc(F)c3ccccc23)C1 ZINC001205816515 1133618008 /nfs/dbraw/zinc/61/80/08/1133618008.db2.gz NFUAEXDQSPEQOH-UKRRQHHQSA-N 1 3 286.394 3.538 20 0 CHADHO C[C@@H]1CC[C@H](CN)[N@@H+](Cc2ccc(F)c3ccccc23)C1 ZINC001205816515 1133618010 /nfs/dbraw/zinc/61/80/10/1133618010.db2.gz NFUAEXDQSPEQOH-UKRRQHHQSA-N 1 3 286.394 3.538 20 0 CHADHO C[C@H]1[C@@H](C[NH3+])CCCN1Cc1ccc(F)c2ccccc12 ZINC001205903010 1133628632 /nfs/dbraw/zinc/62/86/32/1133628632.db2.gz MSGAWBXZRIQQNL-UONOGXRCSA-N 1 3 286.394 3.538 20 0 CHADHO Cc1ccc2ccccc2c1C[N@H+]1CCC[C@H](CN)[C@H]1C ZINC001205917427 1133630260 /nfs/dbraw/zinc/63/02/60/1133630260.db2.gz YOSVWKMBDXXAFQ-NVXWUHKLSA-N 1 3 282.431 3.707 20 0 CHADHO Cc1ccc2ccccc2c1C[N@@H+]1CCC[C@H](CN)[C@H]1C ZINC001205917427 1133630262 /nfs/dbraw/zinc/63/02/62/1133630262.db2.gz YOSVWKMBDXXAFQ-NVXWUHKLSA-N 1 3 282.431 3.707 20 0 CHADHO Cc1c2ccccc2sc1C[N@@H+]1CCCC[C@@H](N)C1 ZINC001205931829 1133632879 /nfs/dbraw/zinc/63/28/79/1133632879.db2.gz LRYYOFMFSLKINA-CYBMUJFWSA-N 1 3 274.433 3.523 20 0 CHADHO Cc1c2ccccc2sc1C[N@H+]1CCCC[C@@H](N)C1 ZINC001205931829 1133632883 /nfs/dbraw/zinc/63/28/83/1133632883.db2.gz LRYYOFMFSLKINA-CYBMUJFWSA-N 1 3 274.433 3.523 20 0 CHADHO CC(C)N(Cc1ccc(Cl)c(F)c1)[C@@H]1CCC[NH2+]CC1 ZINC001206581553 1133722081 /nfs/dbraw/zinc/72/20/81/1133722081.db2.gz KEBJYLAHYVKEFR-CQSZACIVSA-N 1 3 298.833 3.832 20 0 CHADHO CC(C)N(Cc1ccccc1C(F)F)[C@H]1CCC[NH2+]CC1 ZINC001206591513 1133724180 /nfs/dbraw/zinc/72/41/80/1133724180.db2.gz SGQSDCVDOBXAMK-HNNXBMFYSA-N 1 3 296.405 3.977 20 0 CHADHO Cc1ccc(C[N@@H+]2CCCC[C@H](CN)C2)c2ccccc12 ZINC001206616063 1133727635 /nfs/dbraw/zinc/72/76/35/1133727635.db2.gz NBLREORSZCOOJZ-MRXNPFEDSA-N 1 3 282.431 3.709 20 0 CHADHO Cc1ccc(C[N@H+]2CCCC[C@H](CN)C2)c2ccccc12 ZINC001206616063 1133727640 /nfs/dbraw/zinc/72/76/40/1133727640.db2.gz NBLREORSZCOOJZ-MRXNPFEDSA-N 1 3 282.431 3.709 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@@H+]1C[C@@H](CN)CC[C@@H]1C ZINC001206761295 1133743991 /nfs/dbraw/zinc/74/39/91/1133743991.db2.gz WDAWPGXZMMHREV-YESZJQIVSA-N 1 3 298.515 3.667 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@H+]1C[C@@H](CN)CC[C@@H]1C ZINC001206761295 1133743994 /nfs/dbraw/zinc/74/39/94/1133743994.db2.gz WDAWPGXZMMHREV-YESZJQIVSA-N 1 3 298.515 3.667 20 0 CHADHO C[C@@H]1CC[C@H](C[NH3+])CN1Cc1ccc(C2CCC2)cc1 ZINC001206811213 1133751826 /nfs/dbraw/zinc/75/18/26/1133751826.db2.gz RUNLZVVCGYYFSE-GDBMZVCRSA-N 1 3 272.436 3.513 20 0 CHADHO C[C@@H]1CCC(C)(C)C[C@H]1[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC001206827457 1133753081 /nfs/dbraw/zinc/75/30/81/1133753081.db2.gz NVHJANHNKPNGDX-KBAYOESNSA-N 1 3 292.511 3.913 20 0 CHADHO COC(C)(C)CC[N@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001209409648 1134012396 /nfs/dbraw/zinc/01/23/96/1134012396.db2.gz RATXQRWDTKJCGI-UHFFFAOYSA-N 1 3 296.499 3.530 20 0 CHADHO COC(C)(C)CC[N@@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001209409648 1134012401 /nfs/dbraw/zinc/01/24/01/1134012401.db2.gz RATXQRWDTKJCGI-UHFFFAOYSA-N 1 3 296.499 3.530 20 0 CHADHO COC(C)(C)CCN(C)C1CC[NH+](C2CCCCC2)CC1 ZINC001209409648 1134012408 /nfs/dbraw/zinc/01/24/08/1134012408.db2.gz RATXQRWDTKJCGI-UHFFFAOYSA-N 1 3 296.499 3.530 20 0 CHADHO c1cc(NC2=CC[C@H]([NH+]3CCCC3)CC2)cc(C2CC2)n1 ZINC001210707946 1134277160 /nfs/dbraw/zinc/27/71/60/1134277160.db2.gz GOHVOVQRVBCMDB-KRWDZBQOSA-N 1 3 283.419 3.903 20 0 CHADHO CNc1cc(Nc2ccnc(C(C)(C)C)c2)cc[nH+]1 ZINC001216333591 1134857178 /nfs/dbraw/zinc/85/71/78/1134857178.db2.gz ALDAJSOONIGSMS-UHFFFAOYSA-N 1 3 256.353 3.559 20 0 CHADHO CC(C)c1cc(CN2CCC3(C[NH2+]C3)CC2)ccc1Cl ZINC001222207645 1135206721 /nfs/dbraw/zinc/20/67/21/1135206721.db2.gz ANJNOSXTLTYWKH-UHFFFAOYSA-N 1 3 292.854 3.649 20 0 CHADHO C[N@@H+]1CC[C@H](N[C@@H]2CCCc3ccccc32)[C@H]2CCC[C@@H]21 ZINC000353453212 529807064 /nfs/dbraw/zinc/80/70/64/529807064.db2.gz FDMPLUIJUZJSGG-YRXWBPOGSA-N 1 3 284.447 3.526 20 0 CHADHO C[N@H+]1CC[C@H](N[C@@H]2CCCc3ccccc32)[C@H]2CCC[C@@H]21 ZINC000353453212 529807065 /nfs/dbraw/zinc/80/70/65/529807065.db2.gz FDMPLUIJUZJSGG-YRXWBPOGSA-N 1 3 284.447 3.526 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)[NH2+][C@@H]2CCC[C@H](N)C2)cc1 ZINC000574290122 335007652 /nfs/dbraw/zinc/00/76/52/335007652.db2.gz HJQPJJBDGGTVHQ-FHLIZLRMSA-N 1 3 274.452 3.601 20 0 CHADHO C[NH+](C)Cc1ccc(CN[C@@H]2CCc3ccccc32)cc1 ZINC000171127951 335056094 /nfs/dbraw/zinc/05/60/94/335056094.db2.gz WBOMSIHOJOKEAL-LJQANCHMSA-N 1 3 280.415 3.525 20 0 CHADHO CC(C)C1CCC(C[NH2+][C@H]2CCN3CCC[C@H]3C2)CC1 ZINC000312455831 260034055 /nfs/dbraw/zinc/03/40/55/260034055.db2.gz PDGJRKSINBDOLA-FOIPXRHGSA-N 1 3 278.484 3.665 20 0 CHADHO CCCCC[C@@H](C)[NH2+]CCCN1CCCC[C@@H]1C ZINC000020553055 171248029 /nfs/dbraw/zinc/24/80/29/171248029.db2.gz KRHOFVWLKKLGMJ-CVEARBPZSA-N 1 3 254.462 3.809 20 0 CHADHO Cc1ccccc1CNC[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000192917309 227382865 /nfs/dbraw/zinc/38/28/65/227382865.db2.gz KEWMOWWHCKESKH-LJQANCHMSA-N 1 3 294.442 3.607 20 0 CHADHO Cc1ccccc1CNC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192917309 227382870 /nfs/dbraw/zinc/38/28/70/227382870.db2.gz KEWMOWWHCKESKH-LJQANCHMSA-N 1 3 294.442 3.607 20 0 CHADHO CCc1ccc([C@H](CC)NC[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000037648980 260115035 /nfs/dbraw/zinc/11/50/35/260115035.db2.gz VWTAWAUVHPHEBN-APWZRJJASA-N 1 3 286.463 3.774 20 0 CHADHO CCc1ccc([C@H](CC)NC[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000037648980 260115037 /nfs/dbraw/zinc/11/50/37/260115037.db2.gz VWTAWAUVHPHEBN-APWZRJJASA-N 1 3 286.463 3.774 20 0 CHADHO C[C@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1ccccc1 ZINC000037786203 260118002 /nfs/dbraw/zinc/11/80/02/260118002.db2.gz WTXJTAGNIMESRX-AWEZNQCLSA-N 1 3 260.425 3.600 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000516815503 260132724 /nfs/dbraw/zinc/13/27/24/260132724.db2.gz UGDVLMUQSIOQTL-HUUCEWRRSA-N 1 3 294.870 3.763 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+]Cc1cccc2[nH]ccc21 ZINC000070938679 260158573 /nfs/dbraw/zinc/15/85/73/260158573.db2.gz DOTGKXKVMBIAAC-OAHLLOKOSA-N 1 3 285.435 3.522 20 0 CHADHO CCC[C@H](C)[N@H+](C)CCC1CCN(c2ccncc2)CC1 ZINC000187723903 260166966 /nfs/dbraw/zinc/16/69/66/260166966.db2.gz RYMDOEQSAZBUMR-INIZCTEOSA-N 1 3 289.467 3.809 20 0 CHADHO CCC[C@H](C)[N@@H+](C)CCC1CCN(c2ccncc2)CC1 ZINC000187723903 260166968 /nfs/dbraw/zinc/16/69/68/260166968.db2.gz RYMDOEQSAZBUMR-INIZCTEOSA-N 1 3 289.467 3.809 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1)CN(C)C ZINC000310780137 260228593 /nfs/dbraw/zinc/22/85/93/260228593.db2.gz RKKPHQQMPNSYTL-MNOVXSKESA-N 1 3 289.250 3.842 20 0 CHADHO C[C@@H]([NH2+]C[C@H](C)CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000310780141 260228725 /nfs/dbraw/zinc/22/87/25/260228725.db2.gz RKKPHQQMPNSYTL-WDEREUQCSA-N 1 3 289.250 3.842 20 0 CHADHO CSc1ccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000091959889 260266969 /nfs/dbraw/zinc/26/69/69/260266969.db2.gz LJMYAGNKCUUPPZ-VNHYZAJKSA-N 1 3 278.465 3.542 20 0 CHADHO CSc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000091959889 260266971 /nfs/dbraw/zinc/26/69/71/260266971.db2.gz LJMYAGNKCUUPPZ-VNHYZAJKSA-N 1 3 278.465 3.542 20 0 CHADHO N[C@H]1CCC[C@H]([NH2+]C2CCC(c3ccccc3)CC2)C1 ZINC000093211223 260273067 /nfs/dbraw/zinc/27/30/67/260273067.db2.gz LENXAQPDWIYRHD-IKJBURDNSA-N 1 3 272.436 3.572 20 0 CHADHO Cc1ccc([C@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1C ZINC000088163886 260280066 /nfs/dbraw/zinc/28/00/66/260280066.db2.gz SDEMAWLJCUNUSZ-UXDRXVOSSA-N 1 3 286.463 3.969 20 0 CHADHO Cc1ccc([C@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1C ZINC000088163886 260280068 /nfs/dbraw/zinc/28/00/68/260280068.db2.gz SDEMAWLJCUNUSZ-UXDRXVOSSA-N 1 3 286.463 3.969 20 0 CHADHO CC[C@H](N[C@H](C)C[C@@H]1CCC[NH2+]1)c1ccc(C)cc1 ZINC000093463941 260286760 /nfs/dbraw/zinc/28/67/60/260286760.db2.gz KTTKQOQWKCOAIZ-PVAVHDDUSA-N 1 3 260.425 3.566 20 0 CHADHO C[C@H](NCCCC[N@@H+]1CCCC[C@@H]1C)c1cncc(F)c1 ZINC000157886939 261154582 /nfs/dbraw/zinc/15/45/82/261154582.db2.gz WFVXOXYNENSBMV-GJZGRUSLSA-N 1 3 293.430 3.526 20 0 CHADHO C[C@H](NCCCC[N@H+]1CCCC[C@@H]1C)c1cncc(F)c1 ZINC000157886939 261154584 /nfs/dbraw/zinc/15/45/84/261154584.db2.gz WFVXOXYNENSBMV-GJZGRUSLSA-N 1 3 293.430 3.526 20 0 CHADHO Cc1cc2c(cc1C)[C@H](NC1CC[NH+](C)CC1)CCS2 ZINC000186947002 262117126 /nfs/dbraw/zinc/11/71/26/262117126.db2.gz IWYACZKLVWNWLW-MRXNPFEDSA-N 1 3 290.476 3.524 20 0 CHADHO C[C@H](C[NH2+]C[C@H]1C[C@H]1c1ccccc1)CN1CCCCC1 ZINC000503031157 262236636 /nfs/dbraw/zinc/23/66/36/262236636.db2.gz CIOZUEFZNYRGBT-QRQLOZEOSA-N 1 3 286.463 3.502 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]C2CC(C)(C)NC(C)(C)C2)[C@@H](C)C1 ZINC000221691265 262290948 /nfs/dbraw/zinc/29/09/48/262290948.db2.gz QVYHVTOYWVOMMG-IPYPFGDCSA-N 1 3 266.473 3.710 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@H]1C[C@H](C)c2ccccc21 ZINC000311721014 262339918 /nfs/dbraw/zinc/33/99/18/262339918.db2.gz PCTVMWVKJLIYJS-YOEHRIQHSA-N 1 3 260.425 3.555 20 0 CHADHO CCN(Cc1c(C)oc2ccccc21)[C@@H]1CCC[NH2+]CC1 ZINC000414720222 263034357 /nfs/dbraw/zinc/03/43/57/263034357.db2.gz XSOSUJLDPJSVGT-OAHLLOKOSA-N 1 3 286.419 3.705 20 0 CHADHO C[C@@H](c1ccc2ccccc2c1)N(CCC[NH3+])C1CC1 ZINC000414748972 263037895 /nfs/dbraw/zinc/03/78/95/263037895.db2.gz OYVBKEXDYOJOHU-AWEZNQCLSA-N 1 3 268.404 3.714 20 0 CHADHO CCCc1cccc(CNCc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000414805807 263051684 /nfs/dbraw/zinc/05/16/84/263051684.db2.gz AWYWMJOSFWCBOR-HNNXBMFYSA-N 1 3 282.431 3.949 20 0 CHADHO CCC([NH3+])(CC)CNC[C@H](C)c1cccc(Cl)c1 ZINC000414803948 263051858 /nfs/dbraw/zinc/05/18/58/263051858.db2.gz DJWMHTNWDIVQKP-LBPRGKRZSA-N 1 3 268.832 3.551 20 0 CHADHO CC(C)Oc1cccc(CNCc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000414808885 263052599 /nfs/dbraw/zinc/05/25/99/263052599.db2.gz LEMMTYBDCMQSTF-OAHLLOKOSA-N 1 3 298.430 3.783 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CNCc2cc(F)cc(Cl)c2)cc1 ZINC000414816537 263054272 /nfs/dbraw/zinc/05/42/72/263054272.db2.gz PYULFXMIDJHINO-LLVKDONJSA-N 1 3 292.785 3.789 20 0 CHADHO [NH3+]C1(CN[C@@H]2CCC[C@H]2c2ccccc2)CCCCC1 ZINC000414848030 263064438 /nfs/dbraw/zinc/06/44/38/263064438.db2.gz VPQQTJFCWLWHAO-DLBZAZTESA-N 1 3 272.436 3.574 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000282997869 263080355 /nfs/dbraw/zinc/08/03/55/263080355.db2.gz GAAOFOSRQFDAPP-FPAYPSAMSA-N 1 3 286.463 3.500 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3)s2)CCN1 ZINC000414941509 263150098 /nfs/dbraw/zinc/15/00/98/263150098.db2.gz CVPWTGOJVCGTFB-HIFRSBDPSA-N 1 3 286.444 3.645 20 0 CHADHO CC(C)C[C@@H](C[NH2+]C1(C)CCNCC1)c1ccccc1 ZINC000414948737 263157609 /nfs/dbraw/zinc/15/76/09/263157609.db2.gz YXSZSDXSXRVASN-KRWDZBQOSA-N 1 3 274.452 3.548 20 0 CHADHO CC(C)C[C@H](C[NH2+][C@H]1CCN[C@@H](C)C1)c1ccccc1 ZINC000414952955 263158117 /nfs/dbraw/zinc/15/81/17/263158117.db2.gz RGUKBQRRVGODDP-JQHSSLGASA-N 1 3 274.452 3.546 20 0 CHADHO CC(C)C[C@H](CN[C@H]1CC[NH2+][C@@H](C)C1)c1ccccc1 ZINC000414952955 263158118 /nfs/dbraw/zinc/15/81/18/263158118.db2.gz RGUKBQRRVGODDP-JQHSSLGASA-N 1 3 274.452 3.546 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H](c3ccccc3)C2)CCN1 ZINC000414954996 263158855 /nfs/dbraw/zinc/15/88/55/263158855.db2.gz TVSQVEVOUXFXFN-QXCFHYIPSA-N 1 3 286.463 3.833 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2CCCC[C@H](c3ccccc3)C2)CCN1 ZINC000414954997 263158890 /nfs/dbraw/zinc/15/88/90/263158890.db2.gz TVSQVEVOUXFXFN-XGXHKWSGSA-N 1 3 286.463 3.833 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](CNCc2cccc(Cl)c2Cl)C1 ZINC000414985935 263183295 /nfs/dbraw/zinc/18/32/95/263183295.db2.gz BWJQMCXDPQAUIH-CMPLNLGQSA-N 1 3 287.234 3.601 20 0 CHADHO C[C@@H](CCCC[NH3+])NCc1cccc(Cl)c1Cl ZINC000415015634 263255569 /nfs/dbraw/zinc/25/55/69/263255569.db2.gz OMMJGVWHEZCAOR-JTQLQIEISA-N 1 3 275.223 3.601 20 0 CHADHO Cc1ccc(CN[C@H](CCC[NH3+])c2ccccc2)s1 ZINC000415056695 263258966 /nfs/dbraw/zinc/25/89/66/263258966.db2.gz QIWLQJKPKXUNAP-MRXNPFEDSA-N 1 3 274.433 3.626 20 0 CHADHO C[C@@H](NC1CCC(C[NH3+])CC1)c1nc(C(C)(C)C)cs1 ZINC000415073403 263262135 /nfs/dbraw/zinc/26/21/35/263262135.db2.gz BEVNGJIUIJEESQ-PNESKVBLSA-N 1 3 295.496 3.609 20 0 CHADHO C[C@H](N[C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccccc1 ZINC000415078724 263267901 /nfs/dbraw/zinc/26/79/01/263267901.db2.gz GVLNCSFTFZLYJS-SNRMKQJTSA-N 1 3 280.415 3.831 20 0 CHADHO C[C@H](N[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccccc1 ZINC000415078721 263267955 /nfs/dbraw/zinc/26/79/55/263267955.db2.gz GVLNCSFTFZLYJS-KFKAGJAMSA-N 1 3 280.415 3.831 20 0 CHADHO [NH3+]CC1CCC(NCc2ccc(Cl)cc2Cl)CC1 ZINC000415107966 263273483 /nfs/dbraw/zinc/27/34/83/263273483.db2.gz OJCUSKCYHBOILA-UHFFFAOYSA-N 1 3 287.234 3.601 20 0 CHADHO CCSc1ccccc1[C@@H](C)[NH2+]C[C@H](C)CN(C)C ZINC000425952056 264070812 /nfs/dbraw/zinc/07/08/12/264070812.db2.gz RPGSMIPQGUTECH-UONOGXRCSA-N 1 3 280.481 3.647 20 0 CHADHO CC[NH+](CC)Cc1cccc(CN[C@H]2CC[C@H]2SC)c1 ZINC000425359413 264140873 /nfs/dbraw/zinc/14/08/73/264140873.db2.gz PZLJFFSZNSBDDL-DLBZAZTESA-N 1 3 292.492 3.512 20 0 CHADHO c1ccc(CCC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCCN2)cc1 ZINC000093488389 265182368 /nfs/dbraw/zinc/18/23/68/265182368.db2.gz WXXZLLQXQZBJPW-GBESFXJTSA-N 1 3 286.463 3.520 20 0 CHADHO c1ccc(CCCN[C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000093488389 265182369 /nfs/dbraw/zinc/18/23/69/265182369.db2.gz WXXZLLQXQZBJPW-GBESFXJTSA-N 1 3 286.463 3.520 20 0 CHADHO Cc1oc2ccccc2c1C[N@H+]1CCC[C@@H]2CN(C)CC[C@@H]21 ZINC000519033709 265300304 /nfs/dbraw/zinc/30/03/04/265300304.db2.gz ZRQLAKIURNVAEH-QAPCUYQASA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1C[N@@H+]1CCC[C@@H]2CN(C)CC[C@@H]21 ZINC000519033709 265300307 /nfs/dbraw/zinc/30/03/07/265300307.db2.gz ZRQLAKIURNVAEH-QAPCUYQASA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1CN1CCC[C@@H]2C[N@H+](C)CC[C@@H]21 ZINC000519033709 265300310 /nfs/dbraw/zinc/30/03/10/265300310.db2.gz ZRQLAKIURNVAEH-QAPCUYQASA-N 1 3 298.430 3.657 20 0 CHADHO Cc1oc2ccccc2c1CN1CCC[C@@H]2C[N@@H+](C)CC[C@@H]21 ZINC000519033709 265300313 /nfs/dbraw/zinc/30/03/13/265300313.db2.gz ZRQLAKIURNVAEH-QAPCUYQASA-N 1 3 298.430 3.657 20 0 CHADHO [NH3+]C[C@H]1CCCC[C@@H]1NCc1csc2ccccc12 ZINC000414791114 328226485 /nfs/dbraw/zinc/22/64/85/328226485.db2.gz AYCRQXHQDXISAU-DOMZBBRYSA-N 1 3 274.433 3.508 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@H]2NC1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000296064922 328288794 /nfs/dbraw/zinc/28/87/94/328288794.db2.gz WESDGZPMESYEEW-RNIUXLFRSA-N 1 3 284.447 3.758 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@H]2NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000296064922 328288795 /nfs/dbraw/zinc/28/87/95/328288795.db2.gz WESDGZPMESYEEW-RNIUXLFRSA-N 1 3 284.447 3.758 20 0 CHADHO [NH3+]CCC[C@@H](NCc1sccc1Cl)c1ccccc1 ZINC000415052372 328299072 /nfs/dbraw/zinc/29/90/72/328299072.db2.gz KWHRHKZQJCQFMA-CQSZACIVSA-N 1 3 294.851 3.971 20 0 CHADHO Cc1cc(C)c(CN[C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)c(C)c1 ZINC000415081555 328302406 /nfs/dbraw/zinc/30/24/06/328302406.db2.gz KUNFHGZOBHFJLY-NZSAHSFTSA-N 1 3 286.463 3.622 20 0 CHADHO Cc1cccc([C@H](N[C@@H]2CCC[NH2+]CC2)C(C)(C)C)c1 ZINC000415082807 328302660 /nfs/dbraw/zinc/30/26/60/328302660.db2.gz OVYWXPYBAFSJFY-SJORKVTESA-N 1 3 274.452 3.814 20 0 CHADHO CCSc1ccc([C@H](C)NC[C@H]2CCC[N@H+](C)C2)cc1 ZINC000534496749 328304772 /nfs/dbraw/zinc/30/47/72/328304772.db2.gz VAICCWUGKMOYHX-LSDHHAIUSA-N 1 3 292.492 3.791 20 0 CHADHO CCSc1ccc([C@H](C)NC[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000534496749 328304774 /nfs/dbraw/zinc/30/47/74/328304774.db2.gz VAICCWUGKMOYHX-LSDHHAIUSA-N 1 3 292.492 3.791 20 0 CHADHO CC(C)(C)CC[NH2+]CC1CCN(Cc2cccs2)CC1 ZINC000187769599 328302034 /nfs/dbraw/zinc/30/20/34/328302034.db2.gz PCFOWXOYIGMEOX-UHFFFAOYSA-N 1 3 294.508 3.986 20 0 CHADHO C[C@@H]1C[C@@H](N[C@H]2CCCc3ccc(Cl)cc32)CC[N@@H+]1C ZINC000534972176 328372416 /nfs/dbraw/zinc/37/24/16/328372416.db2.gz LIZKAWCPXGJDBL-PVUWLOKVSA-N 1 3 292.854 3.790 20 0 CHADHO C[C@@H]1C[C@@H](N[C@H]2CCCc3ccc(Cl)cc32)CC[N@H+]1C ZINC000534972176 328372417 /nfs/dbraw/zinc/37/24/17/328372417.db2.gz LIZKAWCPXGJDBL-PVUWLOKVSA-N 1 3 292.854 3.790 20 0 CHADHO Cc1cc(C[NH2+]C2CCN(C(C)(C)C)CC2)c(C)s1 ZINC000049686898 328378282 /nfs/dbraw/zinc/37/82/82/328378282.db2.gz KNXXJOOZWSATBX-UHFFFAOYSA-N 1 3 280.481 3.717 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCc3c2cccc3Cl)C1 ZINC000531995142 328387726 /nfs/dbraw/zinc/38/77/26/328387726.db2.gz APZTVSYVVXSZQS-XNJGSVPQSA-N 1 3 292.854 3.790 20 0 CHADHO CCC(CC)[C@H](CC[NH2+]C1CCN(C(C)(C)C)CC1)OC ZINC000537954520 326902046 /nfs/dbraw/zinc/90/20/46/326902046.db2.gz KXCZVVALVRCSRK-KRWDZBQOSA-N 1 3 298.515 3.680 20 0 CHADHO CC(C)(C[NH2+]C1CCN(c2ccncc2)CC1)C1=CCCC1 ZINC000308753784 332778304 /nfs/dbraw/zinc/77/83/04/332778304.db2.gz HHFTXSWTJKLCFE-UHFFFAOYSA-N 1 3 299.462 3.777 20 0 CHADHO Cc1cc(N2C[C@@H]([NH+]3CCCC3)C[C@H]2C)c2ccccc2n1 ZINC000557735454 327023509 /nfs/dbraw/zinc/02/35/09/327023509.db2.gz YTMACBCRUUNDQQ-CVEARBPZSA-N 1 3 295.430 3.606 20 0 CHADHO C[C@H](c1ccc(C(C)(C)C)cc1)N1CC[C@](C)(C[NH3+])C1 ZINC000261732284 327080913 /nfs/dbraw/zinc/08/09/13/327080913.db2.gz LGZIJESIBKIAQI-RDTXWAMCSA-N 1 3 274.452 3.716 20 0 CHADHO C[C@H](c1ccc(C(C)(C)C)cc1)[N@@H+]1CC[C@](C)(CN)C1 ZINC000261732284 327080914 /nfs/dbraw/zinc/08/09/14/327080914.db2.gz LGZIJESIBKIAQI-RDTXWAMCSA-N 1 3 274.452 3.716 20 0 CHADHO C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@](C)(CN)C1 ZINC000261732284 327080915 /nfs/dbraw/zinc/08/09/15/327080915.db2.gz LGZIJESIBKIAQI-RDTXWAMCSA-N 1 3 274.452 3.716 20 0 CHADHO C/C(=C\c1ccccc1)CN1CCC(C[NH+]2CCCC2)CC1 ZINC000506865475 332781235 /nfs/dbraw/zinc/78/12/35/332781235.db2.gz FICWBWWLMAEDFV-OBGWFSINSA-N 1 3 298.474 3.898 20 0 CHADHO C1=C(CC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCCN2)CCCC1 ZINC000093488359 327123667 /nfs/dbraw/zinc/12/36/67/327123667.db2.gz YPZCODHOTFPPOF-FGTMMUONSA-N 1 3 276.468 3.777 20 0 CHADHO c1ccc2c(c1)cccc2CN[C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000262063953 327128622 /nfs/dbraw/zinc/12/86/22/327128622.db2.gz FIAHUVNZWQACRY-SLFFLAALSA-N 1 3 294.442 3.850 20 0 CHADHO CN(CC(C)(C)C[NH3+])C1c2ccccc2-c2ccccc21 ZINC000093861247 327145814 /nfs/dbraw/zinc/14/58/14/327145814.db2.gz RDZNAVPVLNJJAV-UHFFFAOYSA-N 1 3 280.415 3.673 20 0 CHADHO C[N@H+](CC(C)(C)CN)C1c2ccccc2-c2ccccc21 ZINC000093861247 327145815 /nfs/dbraw/zinc/14/58/15/327145815.db2.gz RDZNAVPVLNJJAV-UHFFFAOYSA-N 1 3 280.415 3.673 20 0 CHADHO C[N@@H+](CC(C)(C)CN)C1c2ccccc2-c2ccccc21 ZINC000093861247 327145816 /nfs/dbraw/zinc/14/58/16/327145816.db2.gz RDZNAVPVLNJJAV-UHFFFAOYSA-N 1 3 280.415 3.673 20 0 CHADHO CCC[N@H+](Cc1cc(C)nc2ccccc12)C1CCNCC1 ZINC000262088989 327159996 /nfs/dbraw/zinc/15/99/96/327159996.db2.gz HWBFHZWXXMFXGW-UHFFFAOYSA-N 1 3 297.446 3.507 20 0 CHADHO CCC[N@@H+](Cc1cc(C)nc2ccccc12)C1CCNCC1 ZINC000262088989 327159997 /nfs/dbraw/zinc/15/99/97/327159997.db2.gz HWBFHZWXXMFXGW-UHFFFAOYSA-N 1 3 297.446 3.507 20 0 CHADHO CCCN(Cc1cc(C)nc2ccccc12)C1CC[NH2+]CC1 ZINC000262088989 327159998 /nfs/dbraw/zinc/15/99/98/327159998.db2.gz HWBFHZWXXMFXGW-UHFFFAOYSA-N 1 3 297.446 3.507 20 0 CHADHO CC(C)C[C@@H](C)C[N@@H+]1CCC[C@H](N2CCCC2)CC1 ZINC000410378054 327189015 /nfs/dbraw/zinc/18/90/15/327189015.db2.gz KASZIEKUFYVOLV-SJORKVTESA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)C[C@@H](C)C[N@H+]1CCC[C@H](N2CCCC2)CC1 ZINC000410378054 327189016 /nfs/dbraw/zinc/18/90/16/327189016.db2.gz KASZIEKUFYVOLV-SJORKVTESA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)C[C@@H](C)CN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000410378054 327189017 /nfs/dbraw/zinc/18/90/17/327189017.db2.gz KASZIEKUFYVOLV-SJORKVTESA-N 1 3 266.473 3.619 20 0 CHADHO CC[C@H](C)[C@H](C)[NH2+]CC1CCN(Cc2cccs2)CC1 ZINC000125451754 327273775 /nfs/dbraw/zinc/27/37/75/327273775.db2.gz JNIFDPVFZNFLBG-GJZGRUSLSA-N 1 3 294.508 3.984 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]C[C@H]2CCCC(C)(C)C2)C1 ZINC000583408939 327349005 /nfs/dbraw/zinc/34/90/05/327349005.db2.gz SYOAMYHDEZWDRB-JKSUJKDBSA-N 1 3 266.473 3.523 20 0 CHADHO COc1ccc([C@H](NCc2ccc(C[NH3+])cc2)C(C)C)cc1 ZINC000572961497 327534363 /nfs/dbraw/zinc/53/43/63/327534363.db2.gz BZJISWKEJKJTCS-LJQANCHMSA-N 1 3 298.430 3.641 20 0 CHADHO CCN(CC)CCC[NH2+]CC[C@@H](C)c1ccccc1 ZINC000043532774 328801983 /nfs/dbraw/zinc/80/19/83/328801983.db2.gz STDDFEWSAOYYJY-MRXNPFEDSA-N 1 3 262.441 3.502 20 0 CHADHO C[C@H](CCN1CC[C@H](C[NH+]2CCCC2)C1)c1ccccc1 ZINC000193992325 329064499 /nfs/dbraw/zinc/06/44/99/329064499.db2.gz IEOLZAIFFRFSIG-QZTJIDSGSA-N 1 3 286.463 3.598 20 0 CHADHO C[C@H](CC[N@@H+]1CC[C@H](CN2CCCC2)C1)c1ccccc1 ZINC000193992325 329064500 /nfs/dbraw/zinc/06/45/00/329064500.db2.gz IEOLZAIFFRFSIG-QZTJIDSGSA-N 1 3 286.463 3.598 20 0 CHADHO C[C@H](CC[N@H+]1CC[C@H](CN2CCCC2)C1)c1ccccc1 ZINC000193992325 329064501 /nfs/dbraw/zinc/06/45/01/329064501.db2.gz IEOLZAIFFRFSIG-QZTJIDSGSA-N 1 3 286.463 3.598 20 0 CHADHO CC[NH+](CC)C[C@H]1CCN(CC[C@@H](C)c2ccccc2)C1 ZINC000194012861 329064907 /nfs/dbraw/zinc/06/49/07/329064907.db2.gz HDFOYQUGVGNRRS-QZTJIDSGSA-N 1 3 288.479 3.844 20 0 CHADHO CCN(CC)C[C@H]1CC[N@H+](CC[C@@H](C)c2ccccc2)C1 ZINC000194012861 329064909 /nfs/dbraw/zinc/06/49/09/329064909.db2.gz HDFOYQUGVGNRRS-QZTJIDSGSA-N 1 3 288.479 3.844 20 0 CHADHO CCN(CC)C[C@H]1CC[N@@H+](CC[C@@H](C)c2ccccc2)C1 ZINC000194012861 329064911 /nfs/dbraw/zinc/06/49/11/329064911.db2.gz HDFOYQUGVGNRRS-QZTJIDSGSA-N 1 3 288.479 3.844 20 0 CHADHO C[C@H](NCCCC[N@@H+]1CCC[C@H](C)C1)c1ccsc1 ZINC000178099011 329192532 /nfs/dbraw/zinc/19/25/32/329192532.db2.gz UXLLBRIDDJOQPD-GJZGRUSLSA-N 1 3 280.481 3.911 20 0 CHADHO C[C@H](NCCCC[N@H+]1CCC[C@H](C)C1)c1ccsc1 ZINC000178099011 329192533 /nfs/dbraw/zinc/19/25/33/329192533.db2.gz UXLLBRIDDJOQPD-GJZGRUSLSA-N 1 3 280.481 3.911 20 0 CHADHO Cc1nc(C)c([C@@H](C)[NH2+]CC2(CN(C)C)CCCC2)s1 ZINC000183953267 329255227 /nfs/dbraw/zinc/25/52/27/329255227.db2.gz OCUDSLOFHVOSBI-GFCCVEGCSA-N 1 3 295.496 3.533 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)NCc1ccc(Cl)o1 ZINC000037487029 329550320 /nfs/dbraw/zinc/55/03/20/329550320.db2.gz YJYSEMCDXKTONE-GFCCVEGCSA-N 1 3 272.820 3.533 20 0 CHADHO C[C@@H](NCC[C@@H]1CC[NH2+]C1)c1cccc(Cl)c1Cl ZINC000420401222 329763944 /nfs/dbraw/zinc/76/39/44/329763944.db2.gz IWNGAUOJXUTBPH-MNOVXSKESA-N 1 3 287.234 3.644 20 0 CHADHO Clc1ccc([C@@H](NC[C@@H]2CC[NH2+]C2)C2CCCC2)cc1 ZINC000420406851 329764182 /nfs/dbraw/zinc/76/41/82/329764182.db2.gz OCICXRYFYIDPQV-DYVFJYSZSA-N 1 3 292.854 3.770 20 0 CHADHO C[C@H](NCCCCC[NH+]1CCCC1)c1cc(F)cc(F)c1 ZINC000572384111 330037562 /nfs/dbraw/zinc/03/75/62/330037562.db2.gz ALQDEEYBODBIAR-AWEZNQCLSA-N 1 3 296.405 3.882 20 0 CHADHO C[C@H](NCCCCCOC1CCCCC1)[C@@H]1CCCC[NH2+]1 ZINC000422700585 330150805 /nfs/dbraw/zinc/15/08/05/330150805.db2.gz AHBVKHSPIZQRGH-WMZOPIPTSA-N 1 3 296.499 3.626 20 0 CHADHO C[C@@H](CCCC[NH3+])N[C@H](CC(F)(F)F)c1ccccc1 ZINC000422707283 330151094 /nfs/dbraw/zinc/15/10/94/330151094.db2.gz HEQWJMQJMSABBO-GXTWGEPZSA-N 1 3 288.357 3.787 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@@H]1CCCC[C@H]1Cc1ccccc1 ZINC000422710425 330151384 /nfs/dbraw/zinc/15/13/84/330151384.db2.gz LFRNFSVKAUSAAO-UOVPBQLFSA-N 1 3 274.452 3.503 20 0 CHADHO CCC1CCC(C[NH2+][C@H](C)c2ccc(CN)nc2C)CC1 ZINC000422722456 330152032 /nfs/dbraw/zinc/15/20/32/330152032.db2.gz XXFNWXSMJHGZOU-IUDNXUCKSA-N 1 3 289.467 3.716 20 0 CHADHO CC[C@H](N[C@@H](C)C[C@@H](C)[NH3+])c1ccc(Cl)s1 ZINC000422730325 330152409 /nfs/dbraw/zinc/15/24/09/330152409.db2.gz LZTIPJCZROWZSV-UTLUCORTSA-N 1 3 260.834 3.568 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC[C@@H]1CCCC[C@@H]1C ZINC000422730607 330152537 /nfs/dbraw/zinc/15/25/37/330152537.db2.gz MHWMBAZAHDJKNO-DZKIICNBSA-N 1 3 289.467 3.716 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](c1ccc(Cl)cc1)C1CC1 ZINC000422757625 330153513 /nfs/dbraw/zinc/15/35/13/330153513.db2.gz HWAOMKAEOGQESN-FIXISWKDSA-N 1 3 266.816 3.507 20 0 CHADHO C[C@H](CCC[NH3+])N[C@H](C)c1cccc(Cl)c1Cl ZINC000422756309 330153545 /nfs/dbraw/zinc/15/35/45/330153545.db2.gz HUNFVJFCDVAAFJ-NXEZZACHSA-N 1 3 275.223 3.771 20 0 CHADHO C[C@H](N[C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccc2c(c1)CCCC2 ZINC000422759017 330153588 /nfs/dbraw/zinc/15/35/88/330153588.db2.gz FHXVPLIVNKCQDC-YZVOILCLSA-N 1 3 286.463 3.604 20 0 CHADHO CC(C)(CN[C@@H]1C[C@H]([NH3+])c2ccccc21)c1cccc(F)c1 ZINC000422762885 330154101 /nfs/dbraw/zinc/15/41/01/330154101.db2.gz OOTURZMRTPIGCN-ZWKOTPCHSA-N 1 3 298.405 3.838 20 0 CHADHO CC(C)c1ccc(CCCNC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000422762044 330154103 /nfs/dbraw/zinc/15/41/03/330154103.db2.gz NKHWALTYFCTOAH-DFNIBXOVSA-N 1 3 286.463 3.615 20 0 CHADHO c1ccc([C@@H](NC2C[C@H]3CC[C@@H](C2)[NH2+]3)C2CCCC2)cc1 ZINC000422778791 330154683 /nfs/dbraw/zinc/15/46/83/330154683.db2.gz HUJDSMTWDZTKEB-ZZJWQFMZSA-N 1 3 284.447 3.791 20 0 CHADHO CC(C)c1ccc([C@@H](N[C@@H](C)C2C[NH2+]C2)C(C)C)cc1 ZINC000422775024 330154687 /nfs/dbraw/zinc/15/46/87/330154687.db2.gz ZMAQMKUOAKXIEC-KSSFIOAISA-N 1 3 274.452 3.705 20 0 CHADHO CC(C)c1ccc([C@@H]([NH2+][C@@H](C)C2CNC2)C(C)C)cc1 ZINC000422775024 330154688 /nfs/dbraw/zinc/15/46/88/330154688.db2.gz ZMAQMKUOAKXIEC-KSSFIOAISA-N 1 3 274.452 3.705 20 0 CHADHO c1ccc([C@@H](N[C@H]2CCC[NH2+]CC2)C2CCCC2)cc1 ZINC000422782777 330155033 /nfs/dbraw/zinc/15/50/33/330155033.db2.gz MHBUOGXEZQYWAH-ZWKOTPCHSA-N 1 3 272.436 3.650 20 0 CHADHO CC[C@H](C)[C@H]([NH2+]C1CCNCC1)c1ccc(Cl)cc1 ZINC000422788036 330155352 /nfs/dbraw/zinc/15/53/52/330155352.db2.gz VBJLXFQZFQWQKK-LRDDRELGSA-N 1 3 280.843 3.769 20 0 CHADHO CCC(CC)(CNC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1 ZINC000422799480 330155568 /nfs/dbraw/zinc/15/55/68/330155568.db2.gz WXJNPPFBXOWIKM-JWTNVVGKSA-N 1 3 286.463 3.617 20 0 CHADHO COc1cccc(-c2ccc(CN[C@@H](C)C[C@@H](C)[NH3+])cc2)c1 ZINC000422796645 330155714 /nfs/dbraw/zinc/15/57/14/330155714.db2.gz YVFJFRHVALDPIL-CABCVRRESA-N 1 3 298.430 3.578 20 0 CHADHO Cc1cccc(CN[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC000422810149 330156153 /nfs/dbraw/zinc/15/61/53/330156153.db2.gz SVUIWHPJCHEZHY-MOPGFXCFSA-N 1 3 280.415 3.578 20 0 CHADHO C[C@@H]1CCNCC[C@@H]1[NH2+]CC(C)(C)c1cccc(Cl)c1 ZINC000422819897 330156450 /nfs/dbraw/zinc/15/64/50/330156450.db2.gz JHANSNCQWRHQGE-CJNGLKHVSA-N 1 3 294.870 3.595 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](C)c1ccc(-c2cccnc2)cc1 ZINC000422831989 330156866 /nfs/dbraw/zinc/15/68/66/330156866.db2.gz XDLISNUFIKMQEG-ZNMIVQPWSA-N 1 3 283.419 3.525 20 0 CHADHO C[C@H](CCCC[NH3+])N[C@H](C)c1nc(C(C)(C)C)cs1 ZINC000422856521 330157843 /nfs/dbraw/zinc/15/78/43/330157843.db2.gz FOHFOYXRFRGYGN-VXGBXAGGSA-N 1 3 283.485 3.609 20 0 CHADHO C[C@H](Cc1ccc(Cl)cc1Cl)N[C@H](C)C[C@H](C)[NH3+] ZINC000422864869 330158016 /nfs/dbraw/zinc/15/80/16/330158016.db2.gz WPHWWYONDHPRPY-HBNTYKKESA-N 1 3 289.250 3.640 20 0 CHADHO C[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@H](C)C[C@H](C)N ZINC000422864869 330158018 /nfs/dbraw/zinc/15/80/18/330158018.db2.gz WPHWWYONDHPRPY-HBNTYKKESA-N 1 3 289.250 3.640 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H](c1ccccc1F)C1CCCC1 ZINC000422869869 330158248 /nfs/dbraw/zinc/15/82/48/330158248.db2.gz AWBLMSUZBIGYNP-OGHNNQOOSA-N 1 3 278.415 3.772 20 0 CHADHO CCC(CC)(CN[C@H](C)C1C[NH2+]C1)c1ccc(Cl)cc1 ZINC000422880539 330158833 /nfs/dbraw/zinc/15/88/33/330158833.db2.gz OHIDVLMMJNOMTE-CYBMUJFWSA-N 1 3 294.870 3.595 20 0 CHADHO CCC(CC)(C[NH2+][C@H](C)C1CNC1)c1ccc(Cl)cc1 ZINC000422880539 330158834 /nfs/dbraw/zinc/15/88/34/330158834.db2.gz OHIDVLMMJNOMTE-CYBMUJFWSA-N 1 3 294.870 3.595 20 0 CHADHO C[C@@H](N)C[C@@H](C)[NH2+]CC1CCC(c2ccccc2)CC1 ZINC000422892386 330159184 /nfs/dbraw/zinc/15/91/84/330159184.db2.gz YEVXLSWZVGJTAS-RSIVFMTNSA-N 1 3 274.452 3.676 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H]1CCC(C)(C)c2ccccc21 ZINC000422939492 330161572 /nfs/dbraw/zinc/16/15/72/330161572.db2.gz FWMYLJKFOFZAFB-WOSRLPQWSA-N 1 3 260.425 3.515 20 0 CHADHO Cc1ccccc1C1(CN[C@@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC000422901430 330162154 /nfs/dbraw/zinc/16/21/54/330162154.db2.gz KTRPITIBBBDHJZ-RBUKOAKNSA-N 1 3 292.426 3.761 20 0 CHADHO Cc1ccccc1C1(CN[C@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC000422901425 330162363 /nfs/dbraw/zinc/16/23/63/330162363.db2.gz KTRPITIBBBDHJZ-MOPGFXCFSA-N 1 3 292.426 3.761 20 0 CHADHO C[C@@H](N)C[C@H](C)[NH2+]CC(C)(C)CCCc1ccccc1 ZINC000422983920 330162776 /nfs/dbraw/zinc/16/27/76/330162776.db2.gz VWRQBLRKOLHBLK-CVEARBPZSA-N 1 3 276.468 3.751 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC000422989888 330163053 /nfs/dbraw/zinc/16/30/53/330163053.db2.gz MKTHQGBHYXQWJL-WPAPPDIDSA-N 1 3 274.452 3.602 20 0 CHADHO c1ccc(CC2(CN[C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)CC2)cc1 ZINC000422998904 330163428 /nfs/dbraw/zinc/16/34/28/330163428.db2.gz RPPZIFZHZSSZNY-CEXWTWQISA-N 1 3 298.474 3.520 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000422954078 330164158 /nfs/dbraw/zinc/16/41/58/330164158.db2.gz HFUVOSMFPMETBN-IGJMFERPSA-N 1 3 287.234 3.696 20 0 CHADHO CC[C@@H](CSc1ccc(C)c(C)c1)NC1CC[NH2+]CC1 ZINC000423004869 330164895 /nfs/dbraw/zinc/16/48/95/330164895.db2.gz QBKYOMSFPRIOTD-HNNXBMFYSA-N 1 3 292.492 3.516 20 0 CHADHO CC[C@@H](CSc1ccc(C)c(C)c1)[NH2+]C1CCNCC1 ZINC000423004869 330164897 /nfs/dbraw/zinc/16/48/97/330164897.db2.gz QBKYOMSFPRIOTD-HNNXBMFYSA-N 1 3 292.492 3.516 20 0 CHADHO c1ccc([C@@H](CC2CCC2)N[C@@H]2CCC[NH2+]CC2)cc1 ZINC000423038882 330166601 /nfs/dbraw/zinc/16/66/01/330166601.db2.gz DJCPNIMXOQUFHS-QZTJIDSGSA-N 1 3 272.436 3.650 20 0 CHADHO C[C@H]1CCCc2ccccc2[C@H]1NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423048069 330167126 /nfs/dbraw/zinc/16/71/26/330167126.db2.gz IDLNKUPMRKNEQP-IVUHKYNISA-N 1 3 284.447 3.573 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]C[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000423056471 330167372 /nfs/dbraw/zinc/16/73/72/330167372.db2.gz FXRYKYNNUUDWDY-SDDRHHMPSA-N 1 3 288.357 3.524 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NC[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000423056471 330167374 /nfs/dbraw/zinc/16/73/74/330167374.db2.gz FXRYKYNNUUDWDY-SDDRHHMPSA-N 1 3 288.357 3.524 20 0 CHADHO C[C@@H](N[C@@H]1CCC[NH2+]CC1)c1cc2ccccc2s1 ZINC000423062654 330167913 /nfs/dbraw/zinc/16/79/13/330167913.db2.gz UOXLFFKBDUTLAH-TZMCWYRMSA-N 1 3 274.433 3.694 20 0 CHADHO C[C@@H]1CCNCC[C@@H]1[NH2+][C@@H]1CCC[C@H](c2ccccc2)C1 ZINC000423069861 330168334 /nfs/dbraw/zinc/16/83/34/330168334.db2.gz FDNFZEZMJKKEPH-LULLPPNCSA-N 1 3 286.463 3.691 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCC[C@H](c2ccccc2)C1 ZINC000423077673 330168614 /nfs/dbraw/zinc/16/86/14/330168614.db2.gz MPHRVNFJYXNYLX-OKYOBFRVSA-N 1 3 286.463 3.820 20 0 CHADHO CC(C)[C@@H]1C[C@@H](CNC2C[C@H]3CC[C@@H](C2)[NH2+]3)c2ccccc21 ZINC000423082575 330168831 /nfs/dbraw/zinc/16/88/31/330168831.db2.gz DMHPNGSYRXLYAL-MHSFOPAHSA-N 1 3 298.474 3.786 20 0 CHADHO CC(C)[C@H]1C[C@@H](N[C@@H](C)C[C@@H](C)[NH3+])c2ccccc21 ZINC000423088330 330169152 /nfs/dbraw/zinc/16/91/52/330169152.db2.gz RMNTUERPGLUAFA-DLTLXFJOSA-N 1 3 260.425 3.586 20 0 CHADHO Cc1ccccc1[C@@H](CC(F)(F)F)N[C@H](C)CCC[NH3+] ZINC000423089075 330169216 /nfs/dbraw/zinc/16/92/16/330169216.db2.gz ROBIPKRABCADKC-TZMCWYRMSA-N 1 3 288.357 3.706 20 0 CHADHO CSc1ccc(CCN[C@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000423094923 330169545 /nfs/dbraw/zinc/16/95/45/330169545.db2.gz KZNIJBJCTRZLSC-ROUUACIJSA-N 1 3 298.455 3.685 20 0 CHADHO C[C@@H](C[C@@H]1CCCCC[NH2+]1)NCCc1ccc2[nH]ccc2c1 ZINC000423096656 330169775 /nfs/dbraw/zinc/16/97/75/330169775.db2.gz HXCLIBGKTHLOSW-YJBOKZPZSA-N 1 3 299.462 3.611 20 0 CHADHO [NH3+][C@H]1CCCCC[C@H]1N[C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423099767 330170170 /nfs/dbraw/zinc/17/01/70/330170170.db2.gz UGOJGIJWPHJIHL-QSPRXWTASA-N 1 3 292.854 3.836 20 0 CHADHO C[C@@H]1CCNCC[C@H]1[NH2+][C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423103714 330170434 /nfs/dbraw/zinc/17/04/34/330170434.db2.gz XXJBAOGUNAWYPG-ODVANORSSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@@H]1CC[NH2+]CC[C@H]1N[C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423103714 330170435 /nfs/dbraw/zinc/17/04/35/330170435.db2.gz XXJBAOGUNAWYPG-ODVANORSSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@H]1CCNCC[C@H]1[NH2+][C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423104157 330170606 /nfs/dbraw/zinc/17/06/06/330170606.db2.gz XXJBAOGUNAWYPG-ZFZWDLNGSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@H]1CC[NH2+]CC[C@H]1N[C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423104157 330170608 /nfs/dbraw/zinc/17/06/08/330170608.db2.gz XXJBAOGUNAWYPG-ZFZWDLNGSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@@H](C[C@@H]1CCCCC[NH2+]1)NCC1(C(F)(F)F)CCC1 ZINC000423111256 330170942 /nfs/dbraw/zinc/17/09/42/330170942.db2.gz QKRYYFVEYOGQFD-STQMWFEESA-N 1 3 292.389 3.619 20 0 CHADHO c1ccc([C@H](CN[C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)C2CC2)cc1 ZINC000423122788 330171427 /nfs/dbraw/zinc/17/14/27/330171427.db2.gz CZULOODJUZLJSF-IYWMVGAKSA-N 1 3 298.474 3.691 20 0 CHADHO C[C@@H](N[C@@H](C)c1cccc(C2CC2)c1)[C@H]1CCC[NH2+]C1 ZINC000423143148 330172485 /nfs/dbraw/zinc/17/24/85/330172485.db2.gz CLXYQJSJSOYTMV-IYOUNJFTSA-N 1 3 272.436 3.603 20 0 CHADHO C[C@@H]1CCNCC[C@H]1[NH2+][C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423144799 330172621 /nfs/dbraw/zinc/17/26/21/330172621.db2.gz ICAWMACNWZFFBS-VMUDFCTBSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@@H]1CC[NH2+]CC[C@H]1N[C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423144799 330172623 /nfs/dbraw/zinc/17/26/23/330172623.db2.gz ICAWMACNWZFFBS-VMUDFCTBSA-N 1 3 292.854 3.564 20 0 CHADHO Cc1ccc(CN[C@@H]2CC[NH2+]CC[C@H]2C)c2ccccc12 ZINC000423172107 330174512 /nfs/dbraw/zinc/17/45/12/330174512.db2.gz RIMZWDLAPSDYTK-DNVCBOLYSA-N 1 3 282.431 3.626 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@@H](c2cccc(Cl)c2)C1)C1CNC1 ZINC000423170771 330174523 /nfs/dbraw/zinc/17/45/23/330174523.db2.gz YUSQGCXGKWRRMW-DXCKQFNASA-N 1 3 292.854 3.564 20 0 CHADHO C[C@@H](NCCC[NH3+])c1ccc(-c2ccc(F)cc2)s1 ZINC000423187968 330175613 /nfs/dbraw/zinc/17/56/13/330175613.db2.gz YUXUVDHHRPFXQW-LLVKDONJSA-N 1 3 278.396 3.554 20 0 CHADHO CC(C)[C@@H](CCc1ccc(Cl)cc1)[NH2+]C1CCNCC1 ZINC000423185875 330175621 /nfs/dbraw/zinc/17/56/21/330175621.db2.gz NUBYORPLZNEUGU-QGZVFWFLSA-N 1 3 294.870 3.639 20 0 CHADHO C[C@@H](CCc1ccc(F)cc1F)NCC1([NH3+])CCCCC1 ZINC000423187249 330175735 /nfs/dbraw/zinc/17/57/35/330175735.db2.gz XPPPYQIUJDZPBQ-ZDUSSCGKSA-N 1 3 296.405 3.537 20 0 CHADHO C[C@@H](N[C@H]1CC[C@@H](C)c2ccsc21)[C@@H]1CCC[NH2+]C1 ZINC000423209965 330177689 /nfs/dbraw/zinc/17/76/89/330177689.db2.gz FQYDVOVESRWIJL-BHPKHCPMSA-N 1 3 278.465 3.664 20 0 CHADHO C[C@@H]([NH2+][C@H]1CC[C@@H](C)c2ccsc21)[C@@H]1CCCNC1 ZINC000423209965 330177691 /nfs/dbraw/zinc/17/76/91/330177691.db2.gz FQYDVOVESRWIJL-BHPKHCPMSA-N 1 3 278.465 3.664 20 0 CHADHO CCCC[C@H](NC[C@@H]1CCC[NH2+]C1)c1ccccc1 ZINC000423215356 330178223 /nfs/dbraw/zinc/17/82/23/330178223.db2.gz QMEUYMNGWHZYAC-WBVHZDCISA-N 1 3 260.425 3.507 20 0 CHADHO CCCC[C@H]([NH2+]C[C@@H]1CCCNC1)c1ccccc1 ZINC000423215356 330178224 /nfs/dbraw/zinc/17/82/24/330178224.db2.gz QMEUYMNGWHZYAC-WBVHZDCISA-N 1 3 260.425 3.507 20 0 CHADHO C[C@H](N[C@@H]1CCCc2c(Cl)cccc21)[C@@H]1CCC[NH2+]C1 ZINC000423215684 330178733 /nfs/dbraw/zinc/17/87/33/330178733.db2.gz NJNHLWDHNSBFBE-OGHNNQOOSA-N 1 3 292.854 3.695 20 0 CHADHO C[C@H](N[C@H]1CCCc2c3ccccc3[nH]c21)[C@H]1CCC[NH2+]C1 ZINC000423222068 330179687 /nfs/dbraw/zinc/17/96/87/330179687.db2.gz ZMJZVKKYKFHBOR-DEYYWGMASA-N 1 3 297.446 3.523 20 0 CHADHO C[C@H]([NH2+][C@H]1CCCc2c3ccccc3[nH]c21)[C@H]1CCCNC1 ZINC000423222068 330179688 /nfs/dbraw/zinc/17/96/88/330179688.db2.gz ZMJZVKKYKFHBOR-DEYYWGMASA-N 1 3 297.446 3.523 20 0 CHADHO COc1ccccc1-c1ccc([C@@H](C)NCC[C@H](C)[NH3+])cc1 ZINC000423225503 330180112 /nfs/dbraw/zinc/18/01/12/330180112.db2.gz NAPNGRISVDNEJB-LSDHHAIUSA-N 1 3 298.430 3.750 20 0 CHADHO CC[C@H](CSc1ccc(Cl)cc1)NCC[C@H](C)[NH3+] ZINC000423223745 330180159 /nfs/dbraw/zinc/18/01/59/330180159.db2.gz HLMJFLXLVYYCKR-WCQYABFASA-N 1 3 286.872 3.538 20 0 CHADHO C[NH2+]C[C@H](C)CN[C@H]1CCCc2c3ccccc3sc21 ZINC000423276717 330185155 /nfs/dbraw/zinc/18/51/55/330185155.db2.gz OWLWLMQGZFMGGA-WFASDCNBSA-N 1 3 288.460 3.724 20 0 CHADHO CC(C)(N)C[NH2+][C@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423283241 330185752 /nfs/dbraw/zinc/18/57/52/330185752.db2.gz FAZKORXNBARELA-CQSZACIVSA-N 1 3 266.816 3.508 20 0 CHADHO CCC(N)(CC)C[NH2+][C@H](C)c1cc(C)sc1C ZINC000423287011 330185984 /nfs/dbraw/zinc/18/59/84/330185984.db2.gz JWEQFRFEKBMBHF-LLVKDONJSA-N 1 3 254.443 3.533 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2ccccc2N(C)C)cc1 ZINC000423290079 330186920 /nfs/dbraw/zinc/18/69/20/330186920.db2.gz CHYFIWZBLVBVQS-GJZGRUSLSA-N 1 3 297.446 3.623 20 0 CHADHO CC[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccccc1 ZINC000423291692 330187455 /nfs/dbraw/zinc/18/74/55/330187455.db2.gz JLFXYRIAWFGLIW-KDOFPFPSSA-N 1 3 268.404 3.947 20 0 CHADHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccc(F)c(F)c1 ZINC000423293179 330187633 /nfs/dbraw/zinc/18/76/33/330187633.db2.gz QCSWTPQKMULJDQ-NWDGAFQWSA-N 1 3 290.357 3.835 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2cc(F)cc(F)c2)cc1 ZINC000423293153 330187802 /nfs/dbraw/zinc/18/78/02/330187802.db2.gz PZWKKVQIQGNNJK-NEPJUHHUSA-N 1 3 290.357 3.835 20 0 CHADHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccc(F)cc1 ZINC000423294505 330187920 /nfs/dbraw/zinc/18/79/20/330187920.db2.gz UNEGSEVDRXJRTH-QWHCGFSZSA-N 1 3 272.367 3.696 20 0 CHADHO COc1ccc([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000423296253 330188275 /nfs/dbraw/zinc/18/82/75/330188275.db2.gz YSQRWCRMEZAHCX-KGLIPLIRSA-N 1 3 284.403 3.566 20 0 CHADHO COc1ccc([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000423296252 330188370 /nfs/dbraw/zinc/18/83/70/330188370.db2.gz YSQRWCRMEZAHCX-KBPBESRZSA-N 1 3 284.403 3.566 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H]2CCc3c2cccc3F)cc1 ZINC000423295001 330188379 /nfs/dbraw/zinc/18/83/79/330188379.db2.gz WAYDCUGNSROIDT-KZULUSFZSA-N 1 3 284.378 3.623 20 0 CHADHO NC1(C[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)CCC1 ZINC000423315519 330189763 /nfs/dbraw/zinc/18/97/63/330189763.db2.gz AVMFFPWPNNIDAC-CQSZACIVSA-N 1 3 299.245 3.916 20 0 CHADHO CC(C)CC[C@H]([NH2+][C@H]1CCN[C@H](C)C1)C(C)(C)C ZINC000423374693 330191041 /nfs/dbraw/zinc/19/10/41/330191041.db2.gz IABFEPPXDPLTKB-ILXRZTDVSA-N 1 3 254.462 3.567 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]C[C@@]1(C)CCCNC1 ZINC000423329840 330191259 /nfs/dbraw/zinc/19/12/59/330191259.db2.gz FLAIEPPSYCDFSL-KYJSFNMBSA-N 1 3 272.436 3.523 20 0 CHADHO CC(C)[C@H](CCc1ccccc1)[NH2+]C[C@@]1(C)CCCNC1 ZINC000423338853 330191792 /nfs/dbraw/zinc/19/17/92/330191792.db2.gz UZSFKSFDVGBHHD-OALUTQOASA-N 1 3 288.479 3.623 20 0 CHADHO C[C@@H]1CC[C@H](NC[C@@]2(C)CCC[NH2+]C2)c2ccccc21 ZINC000423343858 330192439 /nfs/dbraw/zinc/19/24/39/330192439.db2.gz XKMUYXZTDLTMDU-JLSDUUJJSA-N 1 3 272.436 3.604 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]C[C@@]2(C)CCCNC2)c2ccccc21 ZINC000423343858 330192440 /nfs/dbraw/zinc/19/24/40/330192440.db2.gz XKMUYXZTDLTMDU-JLSDUUJJSA-N 1 3 272.436 3.604 20 0 CHADHO Cc1ccc([C@@H](NCC2=CC[NH2+]CC2)c2ccccc2)cc1 ZINC000423348168 330192561 /nfs/dbraw/zinc/19/25/61/330192561.db2.gz RYXQPASYUOJKPP-FQEVSTJZSA-N 1 3 292.426 3.594 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000423361352 330193646 /nfs/dbraw/zinc/19/36/46/330193646.db2.gz AFHDZWLJJITMOE-UOJCXKCYSA-N 1 3 292.854 3.564 20 0 CHADHO CC(C)=CCC[C@@H](C)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423360338 330193759 /nfs/dbraw/zinc/19/37/59/330193759.db2.gz QLMMTYTYXRNZAP-CQSZACIVSA-N 1 3 258.409 3.514 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](N[C@@H]2CCCc3c(Cl)cccc32)C1 ZINC000423364391 330194288 /nfs/dbraw/zinc/19/42/88/330194288.db2.gz AMOVIXHGYNHUGV-XHBSWPGZSA-N 1 3 278.827 3.577 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](N[C@H]2CCc3c2ccc(Cl)c3Cl)C1 ZINC000423366809 330194735 /nfs/dbraw/zinc/19/47/35/330194735.db2.gz CHGZUCYNJUYGSI-RULNRJAQSA-N 1 3 299.245 3.840 20 0 CHADHO C[C@@H]1C[C@H](N[C@@H](c2cccs2)C2CCCC2)CC[NH2+]1 ZINC000423369233 330194971 /nfs/dbraw/zinc/19/49/71/330194971.db2.gz FTSQQYYJZOQNRZ-XNRPHZJLSA-N 1 3 278.465 3.710 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H](c2cccs2)C2CCCC2)CCN1 ZINC000423369233 330194973 /nfs/dbraw/zinc/19/49/73/330194973.db2.gz FTSQQYYJZOQNRZ-XNRPHZJLSA-N 1 3 278.465 3.710 20 0 CHADHO COc1ccc2cc([C@H](C)N[C@H]3CCC[C@H]([NH3+])C3)ccc2c1 ZINC000423372112 330195205 /nfs/dbraw/zinc/19/52/05/330195205.db2.gz GTPKJCNDXPTUJZ-KKXDTOCCSA-N 1 3 298.430 3.769 20 0 CHADHO CC(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423371496 330195392 /nfs/dbraw/zinc/19/53/92/330195392.db2.gz GJEMTMFKBZZEMG-MSOLQXFVSA-N 1 3 272.436 3.594 20 0 CHADHO CCC[C@H]([NH2+]C[C@H](N)C1CC1)c1ccc(Cl)cc1 ZINC000423325550 330195644 /nfs/dbraw/zinc/19/56/44/330195644.db2.gz QECHFYQMCDITRD-GJZGRUSLSA-N 1 3 266.816 3.508 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@H]1N[C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423399487 330195913 /nfs/dbraw/zinc/19/59/13/330195913.db2.gz POECMFKQHGWHTE-CSMYWGQOSA-N 1 3 292.854 3.769 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423399487 330195914 /nfs/dbraw/zinc/19/59/14/330195914.db2.gz POECMFKQHGWHTE-CSMYWGQOSA-N 1 3 292.854 3.769 20 0 CHADHO Cc1ccc(CC[C@H](C)[NH2+]Cc2ccc3c(c2)CNC3)cc1 ZINC000423406500 330196662 /nfs/dbraw/zinc/19/66/62/330196662.db2.gz YTXSIIARNHUTTP-INIZCTEOSA-N 1 3 294.442 3.709 20 0 CHADHO CC(C)CCC[C@@H](C)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423404000 330196665 /nfs/dbraw/zinc/19/66/65/330196665.db2.gz XMDSYWBJTVHRPR-CQSZACIVSA-N 1 3 260.425 3.594 20 0 CHADHO CCSc1ccccc1[C@H](C)N[C@@H]1CCC[C@H]([NH3+])C1 ZINC000423383634 330199153 /nfs/dbraw/zinc/19/91/53/330199153.db2.gz KMKAHIKNSSCYBY-MELADBBJSA-N 1 3 278.465 3.719 20 0 CHADHO CCCC[C@H](N[C@H]1CC[NH2+]C[C@@H]1C)c1ccccc1 ZINC000423384495 330199606 /nfs/dbraw/zinc/19/96/06/330199606.db2.gz GAAXVVPWWHYOFI-XIRDDKMYSA-N 1 3 260.425 3.506 20 0 CHADHO CCCC[C@H]([NH2+][C@H]1CCNC[C@@H]1C)c1ccccc1 ZINC000423384495 330199607 /nfs/dbraw/zinc/19/96/07/330199607.db2.gz GAAXVVPWWHYOFI-XIRDDKMYSA-N 1 3 260.425 3.506 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H](c3ccc(Cl)cc3)C2)CCN1 ZINC000423387603 330199855 /nfs/dbraw/zinc/19/98/55/330199855.db2.gz SOJLORXZLHIULR-QIJZBDPFSA-N 1 3 292.854 3.706 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)N[C@H]1CC[NH2+][C@@H](C)C1 ZINC000423387354 330199990 /nfs/dbraw/zinc/19/99/90/330199990.db2.gz SBSBFOOAMSLIAH-BQFCYCMXSA-N 1 3 274.452 3.812 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)[NH2+][C@H]1CCN[C@@H](C)C1 ZINC000423387354 330199992 /nfs/dbraw/zinc/19/99/92/330199992.db2.gz SBSBFOOAMSLIAH-BQFCYCMXSA-N 1 3 274.452 3.812 20 0 CHADHO CC(C)C[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1ccccc1 ZINC000423386864 330200137 /nfs/dbraw/zinc/20/01/37/330200137.db2.gz RUMLAJUXCPTEMV-OIISXLGYSA-N 1 3 260.425 3.504 20 0 CHADHO C[C@@H]1C[C@H](N[C@@H](c2ccccc2)C2CCCC2)CC[NH2+]1 ZINC000423395950 330201034 /nfs/dbraw/zinc/20/10/34/330201034.db2.gz TXAWYDTTXCSTKV-OLMNPRSZSA-N 1 3 272.436 3.648 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2)C2CCCC2)CCN1 ZINC000423395950 330201035 /nfs/dbraw/zinc/20/10/35/330201035.db2.gz TXAWYDTTXCSTKV-OLMNPRSZSA-N 1 3 272.436 3.648 20 0 CHADHO COc1ccccc1-c1ccc([C@H](C)[NH2+][C@H](C)[C@@H](C)N)cc1 ZINC000423436612 330201464 /nfs/dbraw/zinc/20/14/64/330201464.db2.gz FKHVSCRAOZTZRS-KFWWJZLASA-N 1 3 298.430 3.749 20 0 CHADHO C[C@@H](N)[C@@H](C)[NH2+][C@@H](C)c1ccc(-c2ccccc2)s1 ZINC000423446999 330202355 /nfs/dbraw/zinc/20/23/55/330202355.db2.gz OLWHTZMXFFACDP-UPJWGTAASA-N 1 3 274.433 3.801 20 0 CHADHO CC(C)Sc1ccc([C@H](C)[NH2+][C@H](C)[C@H](C)N)cc1 ZINC000423447414 330202541 /nfs/dbraw/zinc/20/25/41/330202541.db2.gz OXNKEEAASZKYHD-XQQFMLRXSA-N 1 3 266.454 3.573 20 0 CHADHO C[C@H](CCC[NH3+])N[C@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000423451973 330202930 /nfs/dbraw/zinc/20/29/30/330202930.db2.gz JCJLOXGNZSBCGC-RNCFNFMXSA-N 1 3 287.234 3.698 20 0 CHADHO CC[C@@H]([NH3+])CN[C@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000423459146 330203713 /nfs/dbraw/zinc/20/37/13/330203713.db2.gz HSRKWIXMSZYLPE-ZIAGYGMSSA-N 1 3 287.451 3.551 20 0 CHADHO CC[C@H]([NH3+])CN[C@@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000423459142 330203745 /nfs/dbraw/zinc/20/37/45/330203745.db2.gz HSRKWIXMSZYLPE-KBPBESRZSA-N 1 3 287.451 3.551 20 0 CHADHO CC[C@H]([NH3+])CN[C@@H](C)C(c1ccccc1)c1ccccc1 ZINC000423457426 330203758 /nfs/dbraw/zinc/20/37/58/330203758.db2.gz FQBQHDSRGPQIFC-YJBOKZPZSA-N 1 3 282.431 3.534 20 0 CHADHO CC[C@H](N)C[NH2+][C@@H](c1ccc(C(F)(F)F)cc1)C(C)C ZINC000423465185 330204318 /nfs/dbraw/zinc/20/43/18/330204318.db2.gz MOZPEOAPIBQJDC-UONOGXRCSA-N 1 3 288.357 3.729 20 0 CHADHO CC[C@H](N)C[NH2+][C@@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423465615 330204390 /nfs/dbraw/zinc/20/43/90/330204390.db2.gz MURSPONCDUXHSO-GJZGRUSLSA-N 1 3 266.816 3.508 20 0 CHADHO C[C@@H](N[C@@H](CCC[NH3+])c1ccccc1)c1cccc(F)c1 ZINC000423496398 330207776 /nfs/dbraw/zinc/20/77/76/330207776.db2.gz DPRXIKGKGQETTK-KDOFPFPSSA-N 1 3 286.394 3.957 20 0 CHADHO Cc1ccc([C@@H](C)N[C@H](CCC[NH3+])c2ccccc2)o1 ZINC000423511530 330209292 /nfs/dbraw/zinc/20/92/92/330209292.db2.gz UAOIQOJDHCZJCT-GDBMZVCRSA-N 1 3 272.392 3.719 20 0 CHADHO C[C@H](C[NH2+]C1CCC(C)(C)CC1)CN1CCCCC1 ZINC000079627450 330252903 /nfs/dbraw/zinc/25/29/03/330252903.db2.gz IHYYUOHUABMQOX-OAHLLOKOSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@H]([NH2+]C1CCN(CC2CCCC2)CC1)[C@@H]1C[C@H]1C1CC1 ZINC000527647298 330269072 /nfs/dbraw/zinc/26/90/72/330269072.db2.gz BCRGTOGBPPDTHM-JVPBZIDWSA-N 1 3 290.495 3.665 20 0 CHADHO CCCC[N@H+](C)CC1CCN(C/C=C(\C)Cl)CC1 ZINC000528358427 330322036 /nfs/dbraw/zinc/32/20/36/330322036.db2.gz ZXXMPWKJBWBDAG-MKMNVTDBSA-N 1 3 272.864 3.573 20 0 CHADHO CCCC[N@@H+](C)CC1CCN(C/C=C(\C)Cl)CC1 ZINC000528358427 330322037 /nfs/dbraw/zinc/32/20/37/330322037.db2.gz ZXXMPWKJBWBDAG-MKMNVTDBSA-N 1 3 272.864 3.573 20 0 CHADHO CCCc1ccc([C@@H](C)NC[C@H]2CCC[N@H+](C)C2)cc1 ZINC000044534927 330330061 /nfs/dbraw/zinc/33/00/61/330330061.db2.gz WJJLQZXHTXKZKN-NVXWUHKLSA-N 1 3 274.452 3.632 20 0 CHADHO CCCc1ccc([C@@H](C)NC[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000044534927 330330062 /nfs/dbraw/zinc/33/00/62/330330062.db2.gz WJJLQZXHTXKZKN-NVXWUHKLSA-N 1 3 274.452 3.632 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCCC[C@H]1N)c1cccc(Cl)c1 ZINC000424370583 330348374 /nfs/dbraw/zinc/34/83/74/330348374.db2.gz DRNNTEZPEZLREG-QLFBSQMISA-N 1 3 266.816 3.651 20 0 CHADHO C/C(=C\c1ccc(Cl)cc1)CNC[C@H]1CCC[N@@H+](C)C1 ZINC000119150187 330371375 /nfs/dbraw/zinc/37/13/75/330371375.db2.gz IFVMATPREAFGIY-HFQYIWAZSA-N 1 3 292.854 3.675 20 0 CHADHO C/C(=C\c1ccc(Cl)cc1)CNC[C@H]1CCC[N@H+](C)C1 ZINC000119150187 330371376 /nfs/dbraw/zinc/37/13/76/330371376.db2.gz IFVMATPREAFGIY-HFQYIWAZSA-N 1 3 292.854 3.675 20 0 CHADHO Cc1cc([C@H](C)N[C@@H]2CCCC[C@@H]2C[NH3+])c(C)s1 ZINC000089143848 330380796 /nfs/dbraw/zinc/38/07/96/330380796.db2.gz HXVRHTCTBVFLOE-NJZAAPMLSA-N 1 3 266.454 3.533 20 0 CHADHO CCC[NH+]1CCC(CN[C@@H](C)c2ccc(CC)o2)CC1 ZINC000122818972 330429011 /nfs/dbraw/zinc/42/90/11/330429011.db2.gz YJYHCVIHOCFSPZ-AWEZNQCLSA-N 1 3 278.440 3.615 20 0 CHADHO Cc1cc([C@@H](C)[NH2+]C2CCN(c3ccncc3)CC2)c(C)o1 ZINC000314913052 330466886 /nfs/dbraw/zinc/46/68/86/330466886.db2.gz IDZGESBIXUNDHX-CQSZACIVSA-N 1 3 299.418 3.611 20 0 CHADHO CC[C@@H]([NH2+]C1CCN(CC2CCCC2)CC1)C1CCC1 ZINC000449107331 330899480 /nfs/dbraw/zinc/89/94/80/330899480.db2.gz PHVYFRPCFIAVMB-GOSISDBHSA-N 1 3 278.484 3.809 20 0 CHADHO CC[C@@H]1C[C@H]1C[NH2+]C1CCN([C@H]2CCC[C@@H](C)C2)CC1 ZINC000449486086 330930026 /nfs/dbraw/zinc/93/00/26/330930026.db2.gz SPMUEKDIISPOPE-CBZIJGRNSA-N 1 3 278.484 3.665 20 0 CHADHO CCN(CC)C[C@H]1CCCC[C@H]1[NH2+]CC1CC(F)(F)C1 ZINC000450767746 330999034 /nfs/dbraw/zinc/99/90/34/330999034.db2.gz VUMSRGRCSZXRMO-HUUCEWRRSA-N 1 3 288.426 3.522 20 0 CHADHO C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)N1CC[C@H]1CCC[N@@H+]1C ZINC000451146911 331017466 /nfs/dbraw/zinc/01/74/66/331017466.db2.gz NJGWJOHXQILRAM-REWJHTLYSA-N 1 3 292.389 3.522 20 0 CHADHO C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)N1CC[C@H]1CCC[N@H+]1C ZINC000451146911 331017467 /nfs/dbraw/zinc/01/74/67/331017467.db2.gz NJGWJOHXQILRAM-REWJHTLYSA-N 1 3 292.389 3.522 20 0 CHADHO CCN(CC)CCC[NH2+][C@H]1CCCC[C@H]1CC(F)(F)F ZINC000451297352 331023674 /nfs/dbraw/zinc/02/36/74/331023674.db2.gz NTBCXWROQRTYLC-KBPBESRZSA-N 1 3 294.405 3.819 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1N[C@H]1CCCc2c(F)cccc21 ZINC000453239859 331105725 /nfs/dbraw/zinc/10/57/25/331105725.db2.gz TURVDSCWUMWGNG-OSLDLMBLSA-N 1 3 290.426 3.521 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1N[C@H]1CCCc2c(F)cccc21 ZINC000453239859 331105726 /nfs/dbraw/zinc/10/57/26/331105726.db2.gz TURVDSCWUMWGNG-OSLDLMBLSA-N 1 3 290.426 3.521 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC(C)(C)C2=CCCC2)CC1 ZINC000453423525 331130846 /nfs/dbraw/zinc/13/08/46/331130846.db2.gz NFEXLRUQMAADSF-UHFFFAOYSA-N 1 3 278.484 3.975 20 0 CHADHO CC(C)[NH+]1CCC(N(C)CCc2cccc(Cl)c2)CC1 ZINC000459320477 331276081 /nfs/dbraw/zinc/27/60/81/331276081.db2.gz YWNBPQZMMPEXCN-UHFFFAOYSA-N 1 3 294.870 3.687 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)[N@@H+]1CCC[C@H](N(C)C)CC1 ZINC000459418175 331280548 /nfs/dbraw/zinc/28/05/48/331280548.db2.gz FQONOWJDVXALEU-BEFAXECRSA-N 1 3 286.463 3.652 20 0 CHADHO C[C@H](c1ccc2c(c1)CCC2)[N@H+]1CCC[C@H](N(C)C)CC1 ZINC000459418175 331280549 /nfs/dbraw/zinc/28/05/49/331280549.db2.gz FQONOWJDVXALEU-BEFAXECRSA-N 1 3 286.463 3.652 20 0 CHADHO CC[C@@H]([NH2+]CCCN1CCCCC1)c1cccc(F)c1 ZINC000166427120 331307181 /nfs/dbraw/zinc/30/71/81/331307181.db2.gz GLEFNEZWDCICEK-QGZVFWFLSA-N 1 3 278.415 3.742 20 0 CHADHO CCCN(CCC)CCC[NH2+][C@H]1CCC[C@@H](C)C1 ZINC000462776489 331328462 /nfs/dbraw/zinc/32/84/62/331328462.db2.gz SNTAYEQQXFBNHD-CVEARBPZSA-N 1 3 254.462 3.667 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+][C@@H]1CCCCC12CCCC2 ZINC000463444238 331347684 /nfs/dbraw/zinc/34/76/84/331347684.db2.gz MEDCLFYVEXVJLX-HZPDHXFCSA-N 1 3 264.457 3.563 20 0 CHADHO C[C@H](c1cccc(Cl)c1)N1CCC(C[NH+](C)C)CC1 ZINC000480961630 331792921 /nfs/dbraw/zinc/79/29/21/331792921.db2.gz MFXGQKDCGRRVOX-CYBMUJFWSA-N 1 3 280.843 3.675 20 0 CHADHO CC(C)[C@@H](C)C[NH2+][C@@H](C)c1cccc(OCCN(C)C)c1 ZINC000484180767 331894253 /nfs/dbraw/zinc/89/42/53/331894253.db2.gz UOZNTCGFJCNGHL-HOTGVXAUSA-N 1 3 292.467 3.570 20 0 CHADHO CCC[C@H](C)[C@H](CC)[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000484466303 331898463 /nfs/dbraw/zinc/89/84/63/331898463.db2.gz JXCZSTYEQBCOCH-JJXSEGSLSA-N 1 3 254.462 3.664 20 0 CHADHO C[C@H](C[NH2+][C@H]1CS[C@H](C(C)(C)C)C1)CN1CCCCC1 ZINC000488413778 332005426 /nfs/dbraw/zinc/00/54/26/332005426.db2.gz ZVVYUAJUTLXOQR-OAGGEKHMSA-N 1 3 298.540 3.618 20 0 CHADHO C[C@H](CN[C@H]1CS[C@H](C(C)(C)C)C1)C[NH+]1CCCCC1 ZINC000488413778 332005427 /nfs/dbraw/zinc/00/54/27/332005427.db2.gz ZVVYUAJUTLXOQR-OAGGEKHMSA-N 1 3 298.540 3.618 20 0 CHADHO CC[C@@H]1C[C@H](C)CN1CCC[N@@H+]1C[C@@H](C)C[C@@H]1CC ZINC000489296637 332045907 /nfs/dbraw/zinc/04/59/07/332045907.db2.gz SKGPLVRTXLAOLG-LUKYLMHMSA-N 1 3 266.473 3.617 20 0 CHADHO CC[C@@H]1C[C@H](C)CN1CCC[N@H+]1C[C@@H](C)C[C@@H]1CC ZINC000489296637 332045908 /nfs/dbraw/zinc/04/59/08/332045908.db2.gz SKGPLVRTXLAOLG-LUKYLMHMSA-N 1 3 266.473 3.617 20 0 CHADHO CC[C@@H]1C[C@H](C)C[N@H+]1CCCN1C[C@@H](C)C[C@@H]1CC ZINC000489296637 332045909 /nfs/dbraw/zinc/04/59/09/332045909.db2.gz SKGPLVRTXLAOLG-LUKYLMHMSA-N 1 3 266.473 3.617 20 0 CHADHO CC[C@@H]1C[C@H](C)C[N@@H+]1CCCN1C[C@@H](C)C[C@@H]1CC ZINC000489296637 332045910 /nfs/dbraw/zinc/04/59/10/332045910.db2.gz SKGPLVRTXLAOLG-LUKYLMHMSA-N 1 3 266.473 3.617 20 0 CHADHO CC(C)c1ccc2c(c1)[C@H]([NH2+]CCCN(C)C)CCCO2 ZINC000489548704 332058954 /nfs/dbraw/zinc/05/89/54/332058954.db2.gz GEBQZXWMJRJVEV-QGZVFWFLSA-N 1 3 290.451 3.565 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H]2c3cc(C)ccc3C[C@H]2C)C1 ZINC000490172056 332083597 /nfs/dbraw/zinc/08/35/97/332083597.db2.gz JYJGEVBSOGESMN-MDZRGWNJSA-N 1 3 286.463 3.550 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H]2c3cc(C)ccc3C[C@H]2C)C1 ZINC000490172056 332083599 /nfs/dbraw/zinc/08/35/99/332083599.db2.gz JYJGEVBSOGESMN-MDZRGWNJSA-N 1 3 286.463 3.550 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2c3cc(C)ccc3C[C@H]2C)C1 ZINC000490172056 332083600 /nfs/dbraw/zinc/08/36/00/332083600.db2.gz JYJGEVBSOGESMN-MDZRGWNJSA-N 1 3 286.463 3.550 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCc1cccc(-c2ccccc2)c1 ZINC000575749198 335111845 /nfs/dbraw/zinc/11/18/45/335111845.db2.gz NIXZPZFJVHWBNH-CABCVRRESA-N 1 3 268.404 3.569 20 0 CHADHO C[C@H](CCc1ccco1)N[C@@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000251131177 334356967 /nfs/dbraw/zinc/35/69/67/334356967.db2.gz UFOUIJJIICIKQP-OWCLPIDISA-N 1 3 278.440 3.501 20 0 CHADHO CC(C)[C@H](C)C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000513226705 333009423 /nfs/dbraw/zinc/00/94/23/333009423.db2.gz LMIJIXUYXYDYCX-OAHLLOKOSA-N 1 3 266.473 3.665 20 0 CHADHO C/C(=C\c1ccc(Cl)cc1)CN[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000513525197 333024078 /nfs/dbraw/zinc/02/40/78/333024078.db2.gz JWUDVCSDMFTHDG-VWCPWKCOSA-N 1 3 292.854 3.816 20 0 CHADHO C/C(=C\c1ccc(Cl)cc1)CN[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000513525197 333024080 /nfs/dbraw/zinc/02/40/80/333024080.db2.gz JWUDVCSDMFTHDG-VWCPWKCOSA-N 1 3 292.854 3.816 20 0 CHADHO C[N@@H+]1CC[C@H](NCc2ccc3ccccc3c2)[C@@H]2CCC[C@@H]21 ZINC000513668373 333030953 /nfs/dbraw/zinc/03/09/53/333030953.db2.gz XNSADEMSFIQZFF-UFYCRDLUSA-N 1 3 294.442 3.802 20 0 CHADHO C[N@H+]1CC[C@H](NCc2ccc3ccccc3c2)[C@@H]2CCC[C@@H]21 ZINC000513668373 333030954 /nfs/dbraw/zinc/03/09/54/333030954.db2.gz XNSADEMSFIQZFF-UFYCRDLUSA-N 1 3 294.442 3.802 20 0 CHADHO CC(C)[C@@H]1C[C@H](N[C@H](C)CC[NH+](C)C)c2ccccc21 ZINC000516906723 333086076 /nfs/dbraw/zinc/08/60/76/333086076.db2.gz QEWYSCPVCVPZTI-JLSDUUJJSA-N 1 3 274.452 3.801 20 0 CHADHO CSc1ccc([C@H](C)NCc2ccc(C[NH3+])cc2)cc1 ZINC000517031740 333090327 /nfs/dbraw/zinc/09/03/27/333090327.db2.gz YLTUEPYEQFCEKL-ZDUSSCGKSA-N 1 3 286.444 3.718 20 0 CHADHO C[C@H]([NH2+]C1CCN(C2CCCC2)CC1)C1CCSCC1 ZINC000187279197 333169148 /nfs/dbraw/zinc/16/91/48/333169148.db2.gz RWAQWDOBLYTXBR-AWEZNQCLSA-N 1 3 296.524 3.515 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000222942795 333202627 /nfs/dbraw/zinc/20/26/27/333202627.db2.gz DKEDPEYPSYGBHD-IAOVAPTHSA-N 1 3 260.425 3.731 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@H](CC2CC2)c2ccccc2)C1 ZINC000575850826 335123600 /nfs/dbraw/zinc/12/36/00/335123600.db2.gz OUJIQYLUJKPCQI-PKOBYXMFSA-N 1 3 286.463 3.849 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@H](CC2CC2)c2ccccc2)C1 ZINC000575850826 335123601 /nfs/dbraw/zinc/12/36/01/335123601.db2.gz OUJIQYLUJKPCQI-PKOBYXMFSA-N 1 3 286.463 3.849 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](CC2CC2)c2ccccc2)C1 ZINC000575850826 335123602 /nfs/dbraw/zinc/12/36/02/335123602.db2.gz OUJIQYLUJKPCQI-PKOBYXMFSA-N 1 3 286.463 3.849 20 0 CHADHO CCc1ccc(CN[C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)s1 ZINC000225135042 333231494 /nfs/dbraw/zinc/23/14/94/333231494.db2.gz BHEXUCJLOHMOMP-IXDOHACOSA-N 1 3 292.492 3.711 20 0 CHADHO CCN(C[C@H]1CCC[NH2+]C1)[C@@H](C)c1cc2ccccc2o1 ZINC000226437124 333260851 /nfs/dbraw/zinc/26/08/51/333260851.db2.gz CBARAJXPEPIUGS-GJZGRUSLSA-N 1 3 286.419 3.815 20 0 CHADHO C[C@@H]1CC[C@H](N[C@@H]2C[C@@H]([NH3+])c3ccccc32)C[C@@H]1C ZINC000227541331 333285464 /nfs/dbraw/zinc/28/54/64/333285464.db2.gz NWTWGZOFAMPNCJ-DVKYCARXSA-N 1 3 258.409 3.546 20 0 CHADHO CN(CCc1ccc2ccccc2c1)C[C@@H]1CCC[N@H+](C)C1 ZINC000525002655 333394897 /nfs/dbraw/zinc/39/48/97/333394897.db2.gz AIXKTTLZXOHXJT-GOSISDBHSA-N 1 3 296.458 3.656 20 0 CHADHO CN(CCc1ccc2ccccc2c1)C[C@@H]1CCC[N@@H+](C)C1 ZINC000525002655 333394898 /nfs/dbraw/zinc/39/48/98/333394898.db2.gz AIXKTTLZXOHXJT-GOSISDBHSA-N 1 3 296.458 3.656 20 0 CHADHO Cc1cccc(CC[C@@H](C)[NH2+]C[C@@H](C)CN2CCCC2)c1 ZINC000062079226 333541927 /nfs/dbraw/zinc/54/19/27/333541927.db2.gz RPRQWPCJSFATSY-QZTJIDSGSA-N 1 3 288.479 3.638 20 0 CHADHO Cc1ccc(CN2CCC(CCC[NH+](C)C)CC2)cc1F ZINC000539849291 333698291 /nfs/dbraw/zinc/69/82/91/333698291.db2.gz DQKWHMZCSFUXIM-UHFFFAOYSA-N 1 3 292.442 3.688 20 0 CHADHO CC[C@@H]1CCC[C@H]([NH2+]C[C@@H](C)CN2CCCCC2)C1 ZINC000071119937 333844381 /nfs/dbraw/zinc/84/43/81/333844381.db2.gz CRDZSNLARXSBRT-ZACQAIPSSA-N 1 3 266.473 3.667 20 0 CHADHO CC[C@@H]1CCC[C@@H]([NH2+]C[C@@H](C)CN2CCCCC2)C1 ZINC000071119949 333844474 /nfs/dbraw/zinc/84/44/74/333844474.db2.gz CRDZSNLARXSBRT-BRWVUGGUSA-N 1 3 266.473 3.667 20 0 CHADHO C/C(=C\c1ccccc1)CN[C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000175009970 335171224 /nfs/dbraw/zinc/17/12/24/335171224.db2.gz HDMXZCGSHWDWFU-QDWFBIQASA-N 1 3 272.436 3.552 20 0 CHADHO C/C(=C\c1ccccc1)C[NH2+][C@@H]1CCC[C@H](N(C)C)C1 ZINC000175009970 335171225 /nfs/dbraw/zinc/17/12/25/335171225.db2.gz HDMXZCGSHWDWFU-QDWFBIQASA-N 1 3 272.436 3.552 20 0 CHADHO CC[C@H](C[NH2+]CCCN1CCCCC1)c1ccccc1 ZINC000135610898 334134465 /nfs/dbraw/zinc/13/44/65/334134465.db2.gz SIASWFSVQWUOLO-QGZVFWFLSA-N 1 3 274.452 3.646 20 0 CHADHO CCN1CC[C@H]([N@H+](C)Cc2ccc(Cl)s2)[C@@H](C)C1 ZINC000245417739 334191489 /nfs/dbraw/zinc/19/14/89/334191489.db2.gz GGCYYGRZRZAVAY-AAEUAGOBSA-N 1 3 286.872 3.564 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)Cc2ccc(Cl)s2)[C@@H](C)C1 ZINC000245417739 334191490 /nfs/dbraw/zinc/19/14/90/334191490.db2.gz GGCYYGRZRZAVAY-AAEUAGOBSA-N 1 3 286.872 3.564 20 0 CHADHO C1=C[C@H](N2CCC[C@@H]([NH+]3CCCC3)CC2)CCCCC1 ZINC000549464169 334194579 /nfs/dbraw/zinc/19/45/79/334194579.db2.gz LEAPTGPBWSVOGO-ZWKOTPCHSA-N 1 3 276.468 3.826 20 0 CHADHO C[C@@H]1C[C@@H](N[C@H]2CCC(C)(C)c3ccccc32)CC[N@@H+]1C ZINC000245913191 334223805 /nfs/dbraw/zinc/22/38/05/334223805.db2.gz DOHWLYQXHONYAW-VKJFTORMSA-N 1 3 286.463 3.871 20 0 CHADHO C[C@@H]1C[C@@H](N[C@H]2CCC(C)(C)c3ccccc32)CC[N@H+]1C ZINC000245913191 334223806 /nfs/dbraw/zinc/22/38/06/334223806.db2.gz DOHWLYQXHONYAW-VKJFTORMSA-N 1 3 286.463 3.871 20 0 CHADHO CC1=CC[C@H]([NH2+]CCCN(C)C2CCCCC2)CC1 ZINC000550884992 334231973 /nfs/dbraw/zinc/23/19/73/334231973.db2.gz APIHUBQBSXHWGQ-INIZCTEOSA-N 1 3 264.457 3.729 20 0 CHADHO COc1cccc([C@H](C)[N@H+](C)CC[C@H]2CCCCN2C)c1 ZINC000246471381 334259179 /nfs/dbraw/zinc/25/91/79/334259179.db2.gz GVYUFSDKAQNGDD-DOTOQJQBSA-N 1 3 290.451 3.562 20 0 CHADHO COc1cccc([C@H](C)[N@@H+](C)CC[C@H]2CCCCN2C)c1 ZINC000246471381 334259180 /nfs/dbraw/zinc/25/91/80/334259180.db2.gz GVYUFSDKAQNGDD-DOTOQJQBSA-N 1 3 290.451 3.562 20 0 CHADHO CC(C)[C@H]1CC[C@@H]1NCCC[NH+](C(C)C)C(C)C ZINC000552046537 334281118 /nfs/dbraw/zinc/28/11/18/334281118.db2.gz KEWFJFUNLRRMNY-CVEARBPZSA-N 1 3 254.462 3.520 20 0 CHADHO CC(C)[C@H]1CC[C@@H]1[NH2+]CCCN(C(C)C)C(C)C ZINC000552046537 334281119 /nfs/dbraw/zinc/28/11/19/334281119.db2.gz KEWFJFUNLRRMNY-CVEARBPZSA-N 1 3 254.462 3.520 20 0 CHADHO CC[NH+](CC)C[C@@H]1CCN([C@H]2CCCc3ccccc32)C1 ZINC000247521991 334284164 /nfs/dbraw/zinc/28/41/64/334284164.db2.gz NMNAUPQUMMLZGH-LPHOPBHVSA-N 1 3 286.463 3.728 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+]([C@H]2CCCc3ccccc32)C1 ZINC000247521991 334284166 /nfs/dbraw/zinc/28/41/66/334284166.db2.gz NMNAUPQUMMLZGH-LPHOPBHVSA-N 1 3 286.463 3.728 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+]([C@H]2CCCc3ccccc32)C1 ZINC000247521991 334284167 /nfs/dbraw/zinc/28/41/67/334284167.db2.gz NMNAUPQUMMLZGH-LPHOPBHVSA-N 1 3 286.463 3.728 20 0 CHADHO C[C@@H](NCCCC[N@@H+]1CCCC[C@H]1C)c1cccc(O)c1 ZINC000249511996 334335146 /nfs/dbraw/zinc/33/51/46/334335146.db2.gz IKAXWSXHDYYZTD-HZPDHXFCSA-N 1 3 290.451 3.697 20 0 CHADHO C[C@@H](NCCCC[N@H+]1CCCC[C@H]1C)c1cccc(O)c1 ZINC000249511996 334335147 /nfs/dbraw/zinc/33/51/47/334335147.db2.gz IKAXWSXHDYYZTD-HZPDHXFCSA-N 1 3 290.451 3.697 20 0 CHADHO Cc1ccccc1[C@@H](C)[NH2+]CCCN1CCCC[C@H]1C ZINC000251144481 334357197 /nfs/dbraw/zinc/35/71/97/334357197.db2.gz DETXMEJAXMRPJH-IAGOWNOFSA-N 1 3 274.452 3.910 20 0 CHADHO CC(C)[C@H](N[C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(F)cc1 ZINC000251798970 334369804 /nfs/dbraw/zinc/36/98/04/334369804.db2.gz GFLGAJHXMDNPEN-COXVUDFISA-N 1 3 278.415 3.595 20 0 CHADHO CC(C)[C@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(F)cc1 ZINC000251798970 334369806 /nfs/dbraw/zinc/36/98/06/334369806.db2.gz GFLGAJHXMDNPEN-COXVUDFISA-N 1 3 278.415 3.595 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](C)c2ccc3c(c2)CCCC3)C1 ZINC000252440348 334380087 /nfs/dbraw/zinc/38/00/87/334380087.db2.gz ZZFBGADWBLBXJW-CVEARBPZSA-N 1 3 286.463 3.558 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](C)c2ccc3c(c2)CCCC3)C1 ZINC000252440348 334380089 /nfs/dbraw/zinc/38/00/89/334380089.db2.gz ZZFBGADWBLBXJW-CVEARBPZSA-N 1 3 286.463 3.558 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](C)c2ccc3c(c2)CCCC3)C1 ZINC000252440348 334380090 /nfs/dbraw/zinc/38/00/90/334380090.db2.gz ZZFBGADWBLBXJW-CVEARBPZSA-N 1 3 286.463 3.558 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H]2CCCC[C@H]2c2ccccc2)C1 ZINC000252438603 334380134 /nfs/dbraw/zinc/38/01/34/334380134.db2.gz DPTKTCXLTPRJLI-NZSAHSFTSA-N 1 3 286.463 3.644 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H]2CCC(C)(C)c3ccccc32)C1 ZINC000252439538 334380214 /nfs/dbraw/zinc/38/02/14/334380214.db2.gz PYXDVDZFWHUHCQ-QAPCUYQASA-N 1 3 286.463 3.731 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H]2CCC(C)(C)c3ccccc32)C1 ZINC000252439538 334380216 /nfs/dbraw/zinc/38/02/16/334380216.db2.gz PYXDVDZFWHUHCQ-QAPCUYQASA-N 1 3 286.463 3.731 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H]2CCC(C)(C)c3ccccc32)C1 ZINC000252439538 334380218 /nfs/dbraw/zinc/38/02/18/334380218.db2.gz PYXDVDZFWHUHCQ-QAPCUYQASA-N 1 3 286.463 3.731 20 0 CHADHO C[C@H]1C[C@H](N[C@@H]2C[C@H]([NH3+])c3ccccc32)C[C@@H](C)C1 ZINC000252792039 334393338 /nfs/dbraw/zinc/39/33/38/334393338.db2.gz UXSFAGRFDOJJOF-KSWINOGPSA-N 1 3 258.409 3.546 20 0 CHADHO Cc1cccc2c1[C@@H](C)C[C@H]2NCc1ccc(C[NH3+])cc1 ZINC000565303374 334550997 /nfs/dbraw/zinc/55/09/97/334550997.db2.gz PHZKZFMQRIKSQC-KBXCAEBGSA-N 1 3 280.415 3.792 20 0 CHADHO CC[C@H]1CCC[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000157562333 334775743 /nfs/dbraw/zinc/77/57/43/334775743.db2.gz WBADZZXPZNHWHQ-YJBOKZPZSA-N 1 3 278.484 3.952 20 0 CHADHO C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000576536940 335216941 /nfs/dbraw/zinc/21/69/41/335216941.db2.gz JLQPOGAGWINSQL-LFZDHENXSA-N 1 3 298.474 3.675 20 0 CHADHO CC(C)Oc1ccc([C@@H](C)NCc2ccc(C[NH3+])cc2)cc1 ZINC000580552076 335278928 /nfs/dbraw/zinc/27/89/28/335278928.db2.gz NYWYLUFREYDTBQ-OAHLLOKOSA-N 1 3 298.430 3.783 20 0 CHADHO CC(C)[C@H]1C[C@@H](N[C@@H](C)[C@H]2CCC[NH2+]C2)c2ccccc21 ZINC000577274099 335333053 /nfs/dbraw/zinc/33/30/53/335333053.db2.gz BRWQXPMFISCLDO-ILRDRHFLSA-N 1 3 286.463 3.849 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+]CC1(c2ccccc2)CCCCC1 ZINC000577499440 335359986 /nfs/dbraw/zinc/35/99/86/335359986.db2.gz JSNZGHXRYNNNGR-HOTGVXAUSA-N 1 3 274.452 3.604 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCC1(c2ccccc2)CCCCC1 ZINC000577499440 335359987 /nfs/dbraw/zinc/35/99/87/335359987.db2.gz JSNZGHXRYNNNGR-HOTGVXAUSA-N 1 3 274.452 3.604 20 0 CHADHO CC[C@@H]([NH2+]C1CCN(CC2CCCC2)CC1)C(C)C ZINC000178159576 335419942 /nfs/dbraw/zinc/41/99/42/335419942.db2.gz UPNVTWAUMBQBBY-QGZVFWFLSA-N 1 3 266.473 3.665 20 0 CHADHO CC[C@@H]([NH2+]C1CCN(c2ccncc2)CC1)C1CCCC1 ZINC000382816842 336097639 /nfs/dbraw/zinc/09/76/39/336097639.db2.gz DPWGMHUTHCCOKL-GOSISDBHSA-N 1 3 287.451 3.609 20 0 CHADHO C[C@H](NCc1ccc(C[NH3+])cc1)c1ccc2c(c1)CCCC2 ZINC000581608391 336111682 /nfs/dbraw/zinc/11/16/82/336111682.db2.gz BMRORANDYSEUDE-HNNXBMFYSA-N 1 3 294.442 3.875 20 0 CHADHO CCCCN1CCC([NH2+][C@@H](C)c2ccsc2)CC1 ZINC000050343283 520578365 /nfs/dbraw/zinc/57/83/65/520578365.db2.gz IUVQFSZLNSBSDU-ZDUSSCGKSA-N 1 3 266.454 3.663 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N[C@H](C)c1ccc(Cl)cn1 ZINC000274906802 520637530 /nfs/dbraw/zinc/63/75/30/520637530.db2.gz MJAZQYYRKFAOIW-UONOGXRCSA-N 1 3 297.874 3.896 20 0 CHADHO CC[NH+](CC)Cc1ccc(CN[C@H](C)c2ccncc2)cc1 ZINC000120578656 520749452 /nfs/dbraw/zinc/74/94/52/520749452.db2.gz AJIKHNNEQRZJTQ-MRXNPFEDSA-N 1 3 297.446 3.774 20 0 CHADHO CCN(Cc1ccc2ccccc2c1)C[C@H]1CCC[NH2+]C1 ZINC000226436223 521336038 /nfs/dbraw/zinc/33/60/38/521336038.db2.gz UAHZWZLRFZCLHG-KRWDZBQOSA-N 1 3 282.431 3.661 20 0 CHADHO CC[N@@H+](Cc1ccc2ccccc2c1)C[C@H]1CCCNC1 ZINC000226436223 521336043 /nfs/dbraw/zinc/33/60/43/521336043.db2.gz UAHZWZLRFZCLHG-KRWDZBQOSA-N 1 3 282.431 3.661 20 0 CHADHO CC[N@H+](Cc1ccc2ccccc2c1)C[C@H]1CCCNC1 ZINC000226436223 521336050 /nfs/dbraw/zinc/33/60/50/521336050.db2.gz UAHZWZLRFZCLHG-KRWDZBQOSA-N 1 3 282.431 3.661 20 0 CHADHO CC[C@H]1CCCC[C@@H]1[NH2+]C1CCN(c2ccncc2)CC1 ZINC000037031394 523043433 /nfs/dbraw/zinc/04/34/33/523043433.db2.gz YJGGPEJQJPMQCQ-YJBOKZPZSA-N 1 3 287.451 3.609 20 0 CHADHO CC[C@@H](c1ccccc1)[N@@H+]1CCC[C@H](N(C)C)CC1 ZINC000277099012 523098599 /nfs/dbraw/zinc/09/85/99/523098599.db2.gz GIZWALAZHMFSLN-IRXDYDNUSA-N 1 3 260.425 3.554 20 0 CHADHO CC[C@@H](c1ccccc1)[N@H+]1CCC[C@H](N(C)C)CC1 ZINC000277099012 523098607 /nfs/dbraw/zinc/09/86/07/523098607.db2.gz GIZWALAZHMFSLN-IRXDYDNUSA-N 1 3 260.425 3.554 20 0 CHADHO CC[C@@H](c1ccccc1)N1CCC[C@H]([NH+](C)C)CC1 ZINC000277099012 523098614 /nfs/dbraw/zinc/09/86/14/523098614.db2.gz GIZWALAZHMFSLN-IRXDYDNUSA-N 1 3 260.425 3.554 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]CC2CCN(c3ccncc3)CC2)o1 ZINC000089215684 525726271 /nfs/dbraw/zinc/72/62/71/525726271.db2.gz BLVXVDHSFKAMJH-OAHLLOKOSA-N 1 3 299.418 3.550 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCCN(C(C)C)C2)s1 ZINC000125725393 525731363 /nfs/dbraw/zinc/73/13/63/525731363.db2.gz MAPPAFRONWLPDY-HUUCEWRRSA-N 1 3 280.481 3.828 20 0 CHADHO Cc1ccc([C@H](C)NCCCC[N@@H+]2CCC[C@H](C)C2)o1 ZINC000157953019 525918749 /nfs/dbraw/zinc/91/87/49/525918749.db2.gz FMYMWMCDGNEQMZ-HOCLYGCPSA-N 1 3 278.440 3.751 20 0 CHADHO Cc1ccc([C@H](C)NCCCC[N@H+]2CCC[C@H](C)C2)o1 ZINC000157953019 525918760 /nfs/dbraw/zinc/91/87/60/525918760.db2.gz FMYMWMCDGNEQMZ-HOCLYGCPSA-N 1 3 278.440 3.751 20 0 CHADHO c1c2ccccc2oc1C[NH2+]C1CCN(C2CCC2)CC1 ZINC000299311768 526403138 /nfs/dbraw/zinc/40/31/38/526403138.db2.gz FIKWZHKLIJTING-UHFFFAOYSA-N 1 3 284.403 3.539 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H]2CC(C)(C)C[C@H]2C)C1 ZINC000193130918 529014944 /nfs/dbraw/zinc/01/49/44/529014944.db2.gz LSBLBWSLDWCSGE-PMPSAXMXSA-N 1 3 266.473 3.521 20 0 CHADHO CCSc1cccc(CN2CCC(C[NH+](C)C)CC2)c1 ZINC000351994221 529250292 /nfs/dbraw/zinc/25/02/92/529250292.db2.gz FBJPBKMCMICENE-UHFFFAOYSA-N 1 3 292.492 3.572 20 0 CHADHO CC(C)(C)[C@H](N[C@H]1CCC[NH2+]CC1)c1ccc(F)cc1 ZINC000133708215 1125485341 /nfs/dbraw/zinc/48/53/41/1125485341.db2.gz WLLMIFQYWJMMSC-JKSUJKDBSA-N 1 3 278.415 3.645 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H](C)[C@@H]1C[C@H]1c1cccs1 ZINC000417295620 1120423735 /nfs/dbraw/zinc/42/37/35/1120423735.db2.gz FKNCBXRVULQKBA-SOUVJXGZSA-N 1 3 280.481 3.562 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)CCSC2CCCCC2)C[C@@H]1C ZINC000500093432 1120508410 /nfs/dbraw/zinc/50/84/10/1120508410.db2.gz SGQOYUCSZTYTOO-JKSUJKDBSA-N 1 3 298.540 3.857 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)CCSC2CCCCC2)C[C@@H]1C ZINC000500093432 1120508414 /nfs/dbraw/zinc/50/84/14/1120508414.db2.gz SGQOYUCSZTYTOO-JKSUJKDBSA-N 1 3 298.540 3.857 20 0 CHADHO CCCCCC1CCC([NH2+][C@H]2C[C@@](C)(N)C2)CC1 ZINC001246464731 1131512540 /nfs/dbraw/zinc/51/25/40/1131512540.db2.gz SYOXJTJVIAUYQP-STONLHKKSA-N 1 3 252.446 3.595 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@@H]2CCCC2(C)C)CC1(C)C ZINC001171624850 1132068144 /nfs/dbraw/zinc/06/81/44/1132068144.db2.gz ZVYMOOCWHPBCTN-CQSZACIVSA-N 1 3 266.473 3.806 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1csc(Cl)c1)C2 ZINC001172118242 1132132283 /nfs/dbraw/zinc/13/22/83/1132132283.db2.gz PTGWHNWEBYJBTM-XYYAHUGASA-N 1 3 284.856 3.506 20 0 CHADHO CCSC[C@@H](C)[NH2+]C1CCN(CC2CCCCC2)CC1 ZINC001173299477 1132446637 /nfs/dbraw/zinc/44/66/37/1132446637.db2.gz RTBRGUWBLUDJSU-OAHLLOKOSA-N 1 3 298.540 3.762 20 0 CHADHO CCSC[C@@H](C)NC1CC[NH+](CC2CCCCC2)CC1 ZINC001173299477 1132446640 /nfs/dbraw/zinc/44/66/40/1132446640.db2.gz RTBRGUWBLUDJSU-OAHLLOKOSA-N 1 3 298.540 3.762 20 0 CHADHO C[C@@H]([NH3+])[C@H]1CCCN(C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000262047625 1125751344 /nfs/dbraw/zinc/75/13/44/1125751344.db2.gz ZDMSFHSGDQSPDX-NFAWXSAZSA-N 1 3 280.843 3.503 20 0 CHADHO CC(C)[N@@H+](Cc1cccc(Cl)c1)C[C@H](N)CC(F)F ZINC000903884133 1130207319 /nfs/dbraw/zinc/20/73/19/1130207319.db2.gz SMPWNPSANSCQQE-CYBMUJFWSA-N 1 3 290.785 3.533 20 0 CHADHO CC(C)[N@H+](Cc1cccc(Cl)c1)C[C@H](N)CC(F)F ZINC000903884133 1130207323 /nfs/dbraw/zinc/20/73/23/1130207323.db2.gz SMPWNPSANSCQQE-CYBMUJFWSA-N 1 3 290.785 3.533 20 0 CHADHO CCCc1cccc(CN2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)c1 ZINC000482006572 1126738764 /nfs/dbraw/zinc/73/87/64/1126738764.db2.gz MFTLANPKNGFUEB-MOPGFXCFSA-N 1 3 286.463 3.555 20 0 CHADHO CCCc1cccc(CN2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c1 ZINC000482006572 1126738766 /nfs/dbraw/zinc/73/87/66/1126738766.db2.gz MFTLANPKNGFUEB-MOPGFXCFSA-N 1 3 286.463 3.555 20 0 CHADHO CC(C)[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000482353523 1126751931 /nfs/dbraw/zinc/75/19/31/1126751931.db2.gz QMUMSUFWNFFEKN-FGTMMUONSA-N 1 3 280.500 3.911 20 0 CHADHO Cc1cc([C@H](C)N[C@H]2CC[N@H+](C)[C@@H](C)C2)cc(C)c1F ZINC000483735165 1126799413 /nfs/dbraw/zinc/79/94/13/1126799413.db2.gz VNILHATXDHFHCC-DZKIICNBSA-N 1 3 278.415 3.576 20 0 CHADHO Cc1cc([C@H](C)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc(C)c1F ZINC000483735165 1126799416 /nfs/dbraw/zinc/79/94/16/1126799416.db2.gz VNILHATXDHFHCC-DZKIICNBSA-N 1 3 278.415 3.576 20 0 CHADHO Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H](N(C)C)C2)cc1C ZINC000484483618 1126821415 /nfs/dbraw/zinc/82/14/15/1126821415.db2.gz ADLAYILWHOBZSU-RYQLBKOJSA-N 1 3 274.452 3.827 20 0 CHADHO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H](N(C)C)C2)cc1C ZINC000484483617 1126820807 /nfs/dbraw/zinc/82/08/07/1126820807.db2.gz ADLAYILWHOBZSU-JQHSSLGASA-N 1 3 274.452 3.827 20 0 CHADHO C[C@@H]([NH2+][C@H](CCN(C)C)C(C)(C)C)c1ccc(Cl)nc1 ZINC000179127682 1126823948 /nfs/dbraw/zinc/82/39/48/1126823948.db2.gz AVTQNUMXYZSXLP-TZMCWYRMSA-N 1 3 297.874 3.752 20 0 CHADHO C[C@H](NC1CC(C[NH3+])C1)c1cc(F)c(Cl)cc1Cl ZINC000904367973 1126849643 /nfs/dbraw/zinc/84/96/43/1126849643.db2.gz LMOLQQZJPORTIM-UEJVZZJDSA-N 1 3 291.197 3.520 20 0 CHADHO Cc1ccc2cc(C[NH2+][C@H]3CCC[C@H](N(C)C)C3)ccc2n1 ZINC000189373324 1126931173 /nfs/dbraw/zinc/93/11/73/1126931173.db2.gz BSDJLENSWBAMGC-ROUUACIJSA-N 1 3 297.446 3.506 20 0 CHADHO C[NH+](C)Cc1cccc(CN[C@@H]2CCc3c2cccc3F)c1 ZINC000268766803 1127022826 /nfs/dbraw/zinc/02/28/26/1127022826.db2.gz QNKYPPCZFSYMRT-LJQANCHMSA-N 1 3 298.405 3.664 20 0 CHADHO C[C@@H]([NH2+]C1CCN(CC2CC2)CC1)c1cc2ccccc2o1 ZINC000268754887 1127022896 /nfs/dbraw/zinc/02/28/96/1127022896.db2.gz WRWVBCSHWOTJFJ-CQSZACIVSA-N 1 3 298.430 3.958 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1)[C@H]1CC1(C)C ZINC000487555990 1127034482 /nfs/dbraw/zinc/03/44/82/1127034482.db2.gz UGHZOXAMOCWCRO-KLZNWCGWSA-N 1 3 278.484 3.664 20 0 CHADHO C[C@@H](NCCCC[N@@H+]1CCCC[C@H]1C)c1ccc(F)cn1 ZINC000271288034 1127074318 /nfs/dbraw/zinc/07/43/18/1127074318.db2.gz DNPLEIMHASGEDU-HUUCEWRRSA-N 1 3 293.430 3.526 20 0 CHADHO C[C@@H](NCCCC[N@H+]1CCCC[C@H]1C)c1ccc(F)cn1 ZINC000271288034 1127074322 /nfs/dbraw/zinc/07/43/22/1127074322.db2.gz DNPLEIMHASGEDU-HUUCEWRRSA-N 1 3 293.430 3.526 20 0 CHADHO CCCC[C@H](C)[C@@H](C)[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000571960812 1127184050 /nfs/dbraw/zinc/18/40/50/1127184050.db2.gz OAQMJWGDTSFBHR-XHSDSOJGSA-N 1 3 254.462 3.521 20 0 CHADHO Cc1oc2ccccc2c1CN1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000354177505 1127297180 /nfs/dbraw/zinc/29/71/80/1127297180.db2.gz QLPBCEYRDLKPNE-IBGZPJMESA-N 1 3 298.430 3.659 20 0 CHADHO Cc1oc2ccccc2c1CN1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC000354177505 1127297182 /nfs/dbraw/zinc/29/71/82/1127297182.db2.gz QLPBCEYRDLKPNE-IBGZPJMESA-N 1 3 298.430 3.659 20 0 CHADHO CCc1cnccc1[C@@H](C)[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000359292221 1127456707 /nfs/dbraw/zinc/45/67/07/1127456707.db2.gz FOPXPGCAHVKHPB-CQSZACIVSA-N 1 3 289.467 3.558 20 0 CHADHO CC1(C)Cc2occc2[C@H]([NH2+]CCCN2CCCCC2)C1 ZINC000359619590 1127470076 /nfs/dbraw/zinc/47/00/76/1127470076.db2.gz KIQDPIHVRCNAFN-MRXNPFEDSA-N 1 3 290.451 3.759 20 0 CHADHO Cc1cccnc1[C@H](N[C@H]1C[C@@H]([NH3+])CC(C)(C)C1)C(C)C ZINC000925497810 1127488310 /nfs/dbraw/zinc/48/83/10/1127488310.db2.gz KESCINGYQRGVJT-OWCLPIDISA-N 1 3 289.467 3.583 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)c1ccc(F)cc1 ZINC000361967805 1127603294 /nfs/dbraw/zinc/60/32/94/1127603294.db2.gz MQSPIDFUJBYNIJ-ULQDDVLXSA-N 1 3 278.415 3.739 20 0 CHADHO CC[N@H+](C)Cc1cccc(CNCc2csc(C)c2)c1 ZINC000295328381 1127635024 /nfs/dbraw/zinc/63/50/24/1127635024.db2.gz ZJSFGFRZMPNLGE-UHFFFAOYSA-N 1 3 288.460 3.798 20 0 CHADHO CC[N@@H+](C)Cc1cccc(CNCc2csc(C)c2)c1 ZINC000295328381 1127635026 /nfs/dbraw/zinc/63/50/26/1127635026.db2.gz ZJSFGFRZMPNLGE-UHFFFAOYSA-N 1 3 288.460 3.798 20 0 CHADHO Cc1cc([C@H](C)[NH2+]C2CCN(CC(C)C)CC2)cs1 ZINC000295839182 1127654883 /nfs/dbraw/zinc/65/48/83/1127654883.db2.gz FNAAUUVZLJWKCP-AWEZNQCLSA-N 1 3 280.481 3.828 20 0 CHADHO C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1ccc2ccccc2n1 ZINC000295946670 1127658312 /nfs/dbraw/zinc/65/83/12/1127658312.db2.gz LVZXHHUHSMDZEH-HZTRTUMWSA-N 1 3 295.430 3.511 20 0 CHADHO C1[C@@H]2[C@H]1CCC[C@@H]2[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000374600625 1127905811 /nfs/dbraw/zinc/90/58/11/1127905811.db2.gz FHRMEBYORMFAOX-QGTPRVQTSA-N 1 3 276.468 3.562 20 0 CHADHO CCc1ccc(CN2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000539895813 1127952609 /nfs/dbraw/zinc/95/26/09/1127952609.db2.gz XNLIIBRCDHBQDC-ICSRJNTNSA-N 1 3 298.474 3.698 20 0 CHADHO CCc1ccc(CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000539895813 1127952612 /nfs/dbraw/zinc/95/26/12/1127952612.db2.gz XNLIIBRCDHBQDC-ICSRJNTNSA-N 1 3 298.474 3.698 20 0 CHADHO CC(C)CCC[C@H](C)[NH2+]CCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000540169137 1127965248 /nfs/dbraw/zinc/96/52/48/1127965248.db2.gz DAUKKPZHXBLKSI-RCCFBDPRSA-N 1 3 298.515 3.680 20 0 CHADHO Cc1cc(Cl)ccc1CN1CCC(CC[NH+](C)C)CC1 ZINC000468405495 1128006711 /nfs/dbraw/zinc/00/67/11/1128006711.db2.gz MYUGIALLCREYEY-UHFFFAOYSA-N 1 3 294.870 3.812 20 0 CHADHO CCN1CCC[C@H](C[NH2+]CCc2ccc(C(C)C)cc2)C1 ZINC000470185500 1128064612 /nfs/dbraw/zinc/06/46/12/1128064612.db2.gz XHFFYCHYDAMGHF-GOSISDBHSA-N 1 3 288.479 3.674 20 0 CHADHO C[C@@H](NCCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccns1 ZINC000924684159 1128110265 /nfs/dbraw/zinc/11/02/65/1128110265.db2.gz JFDHRDSOAKVNKG-QLFBSQMISA-N 1 3 295.496 3.552 20 0 CHADHO C[C@@H](NCCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccns1 ZINC000924684159 1128110269 /nfs/dbraw/zinc/11/02/69/1128110269.db2.gz JFDHRDSOAKVNKG-QLFBSQMISA-N 1 3 295.496 3.552 20 0 CHADHO c1ccc([C@H]2C[C@H]([NH2+][C@@H]3CCNC[C@H]3C3CCCC3)C2)cc1 ZINC000925604107 1128134329 /nfs/dbraw/zinc/13/43/29/1128134329.db2.gz HOCFQPMSIDEAIE-LWYYNNOASA-N 1 3 298.474 3.691 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3NCCC(C)(C)[NH3+] ZINC000925737756 1128139468 /nfs/dbraw/zinc/13/94/68/1128139468.db2.gz KTWOLXPGJXWKER-INIZCTEOSA-N 1 3 285.435 3.571 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1cc2ccccc2[nH]1 ZINC000926753296 1128192025 /nfs/dbraw/zinc/19/20/25/1128192025.db2.gz MYQPSRVJJCXGMF-CABCVRRESA-N 1 3 285.435 3.550 20 0 CHADHO [NH3+][C@@H]1CCCN(Cc2ccccc2-c2cccs2)CC1 ZINC001205110346 1128195954 /nfs/dbraw/zinc/19/59/54/1128195954.db2.gz SRTRFPHVOWPSOI-OAHLLOKOSA-N 1 3 286.444 3.728 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)C[N@@H+]2C[C@H](C)[C@H](CN)C2)cc1 ZINC001205131136 1128264727 /nfs/dbraw/zinc/26/47/27/1128264727.db2.gz RASJEDXCUZAZKJ-JTDSTZFVSA-N 1 3 288.479 3.515 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)C[N@H+]2C[C@H](C)[C@H](CN)C2)cc1 ZINC001205131136 1128264732 /nfs/dbraw/zinc/26/47/32/1128264732.db2.gz RASJEDXCUZAZKJ-JTDSTZFVSA-N 1 3 288.479 3.515 20 0 CHADHO CCCC[C@@H](CC)[NH+]1CCC(N2CCCCC2)CC1 ZINC001257419622 1128352728 /nfs/dbraw/zinc/35/27/28/1128352728.db2.gz YRBPDDPWXRMNRM-MRXNPFEDSA-N 1 3 266.473 3.906 20 0 CHADHO C[C@@H]1C[C@@H](N[C@H]2CCCc3c4ccccc4[nH]c32)CC[N@@H+]1C ZINC000316741942 1128335923 /nfs/dbraw/zinc/33/59/23/1128335923.db2.gz IARUVLWFJKZXKS-GLJUWKHASA-N 1 3 297.446 3.618 20 0 CHADHO C[C@@H]1C[C@@H](N[C@H]2CCCc3c4ccccc4[nH]c32)CC[N@H+]1C ZINC000316741942 1128335927 /nfs/dbraw/zinc/33/59/27/1128335927.db2.gz IARUVLWFJKZXKS-GLJUWKHASA-N 1 3 297.446 3.618 20 0 CHADHO CC(C)([NH2+]CCCN1CCCC1)c1ccc(Cl)cc1 ZINC000562839848 1128422682 /nfs/dbraw/zinc/42/26/82/1128422682.db2.gz ASUWCSRODXECPB-UHFFFAOYSA-N 1 3 280.843 3.651 20 0 CHADHO c1ccc([C@@H]2CCCC[C@@H]2[NH2+]CCCN2CCCC2)cc1 ZINC000037229532 1128424672 /nfs/dbraw/zinc/42/46/72/1128424672.db2.gz MNJOKIXBDMNIIM-OALUTQOASA-N 1 3 286.463 3.788 20 0 CHADHO c1ccc([C@H]2CCCCN2CC[C@H]2CCCC[NH2+]2)cc1 ZINC001205171639 1128433666 /nfs/dbraw/zinc/43/36/66/1128433666.db2.gz VDBQPVWKEUPYLU-QZTJIDSGSA-N 1 3 272.436 3.746 20 0 CHADHO CC(C)[C@H](NC[C@H](C)C[NH+]1CCCC1)c1ccccc1 ZINC000062078838 1128437410 /nfs/dbraw/zinc/43/74/10/1128437410.db2.gz NZARNNYHUSSJMF-WMZOPIPTSA-N 1 3 274.452 3.705 20 0 CHADHO CC(C)[C@H]([NH2+]C[C@H](C)CN1CCCC1)c1ccccc1 ZINC000062078838 1128437412 /nfs/dbraw/zinc/43/74/12/1128437412.db2.gz NZARNNYHUSSJMF-WMZOPIPTSA-N 1 3 274.452 3.705 20 0 CHADHO CCCc1ccc([C@@H](C)NC2CC[NH+](CC)CC2)cc1 ZINC000038097951 1128438151 /nfs/dbraw/zinc/43/81/51/1128438151.db2.gz AEOCSISXJDDASH-OAHLLOKOSA-N 1 3 274.452 3.774 20 0 CHADHO CC(C)Cc1cccc([C@H](C)NC[C@H]2CCC[N@H+](C)C2)c1 ZINC000563904460 1128484405 /nfs/dbraw/zinc/48/44/05/1128484405.db2.gz YYZPUCULLKLRSZ-FUHWJXTLSA-N 1 3 288.479 3.878 20 0 CHADHO CC(C)Cc1cccc([C@H](C)NC[C@H]2CCC[N@@H+](C)C2)c1 ZINC000563904460 1128484408 /nfs/dbraw/zinc/48/44/08/1128484408.db2.gz YYZPUCULLKLRSZ-FUHWJXTLSA-N 1 3 288.479 3.878 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCc1ccc(F)c(-c2cccs2)c1 ZINC000564084357 1128492929 /nfs/dbraw/zinc/49/29/29/1128492929.db2.gz JXAZRTWVXKETIK-NWDGAFQWSA-N 1 3 292.423 3.770 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[NH+]1CCC2(CN(C)C2)CC1 ZINC001257485190 1128503393 /nfs/dbraw/zinc/50/33/93/1128503393.db2.gz JIMUVXLSJUDYGZ-HOTGVXAUSA-N 1 3 266.473 3.619 20 0 CHADHO CC1CCN(CCC[NH2+][C@H]2CCc3cc(F)ccc32)CC1 ZINC000128589377 1128506012 /nfs/dbraw/zinc/50/60/12/1128506012.db2.gz NOCRBLMUNOMKLZ-SFHVURJKSA-N 1 3 290.426 3.525 20 0 CHADHO CC1=CC[C@H]([NH2+]C2CCN(CC3CCCC3)CC2)CC1 ZINC000567097623 1128558397 /nfs/dbraw/zinc/55/83/97/1128558397.db2.gz CXKSAILAMVENPZ-KRWDZBQOSA-N 1 3 276.468 3.729 20 0 CHADHO CCCN1CCC([NH2+]Cc2ccc(Cl)cc2C)CC1 ZINC000128769010 1128516458 /nfs/dbraw/zinc/51/64/58/1128516458.db2.gz YFZMLJNHIXVSOM-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO CC1=CC[C@@H]([NH2+]C2CCN(CC3CCCC3)CC2)CC1 ZINC000567097624 1128558528 /nfs/dbraw/zinc/55/85/28/1128558528.db2.gz CXKSAILAMVENPZ-QGZVFWFLSA-N 1 3 276.468 3.729 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H]2CCCC23CCCC3)C1 ZINC000556076212 1128544499 /nfs/dbraw/zinc/54/44/99/1128544499.db2.gz LIYRRDRCNBCCML-DLBZAZTESA-N 1 3 278.484 3.809 20 0 CHADHO C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(CC2(C)CCC2)C1 ZINC000556105404 1128547643 /nfs/dbraw/zinc/54/76/43/1128547643.db2.gz VDJDHWVMNDNXAQ-SJORKVTESA-N 1 3 278.484 3.763 20 0 CHADHO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(CC2(C)CCC2)C1 ZINC000556105404 1128547646 /nfs/dbraw/zinc/54/76/46/1128547646.db2.gz VDJDHWVMNDNXAQ-SJORKVTESA-N 1 3 278.484 3.763 20 0 CHADHO C1CCC(N2CCC([NH2+][C@H]3CC4CCC3CC4)CC2)CC1 ZINC000556202408 1128563569 /nfs/dbraw/zinc/56/35/69/1128563569.db2.gz NILXYPATUCPGNT-RJYAGPCLSA-N 1 3 290.495 3.952 20 0 CHADHO C[C@H]([NH2+][C@H]1CCNC2(CCC2)C1)C(C)(C)c1ccccc1 ZINC000643545862 1117791035 /nfs/dbraw/zinc/79/10/35/1117791035.db2.gz DKMVWXVTZRVRBX-RDJZCZTQSA-N 1 3 286.463 3.617 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CCNC2(CCC2)C1)C1CCCCCC1 ZINC000643547452 1117798064 /nfs/dbraw/zinc/79/80/64/1117798064.db2.gz FSQJKSPFZKHXTH-GDBMZVCRSA-N 1 3 264.457 3.610 20 0 CHADHO C[N@@H+]1CC[C@@H](NC2(c3ccccc3)CCC2)CC1(C)C ZINC000623386037 1117846512 /nfs/dbraw/zinc/84/65/12/1117846512.db2.gz IBMWWSAXCWXZTL-MRXNPFEDSA-N 1 3 272.436 3.528 20 0 CHADHO C[N@H+]1CC[C@@H](NC2(c3ccccc3)CCC2)CC1(C)C ZINC000623386037 1117846516 /nfs/dbraw/zinc/84/65/16/1117846516.db2.gz IBMWWSAXCWXZTL-MRXNPFEDSA-N 1 3 272.436 3.528 20 0 CHADHO C[C@@H]([NH3+])C[C@@H](C)NCc1ccc(-c2cccc(F)c2)s1 ZINC000579121825 1128738420 /nfs/dbraw/zinc/73/84/20/1128738420.db2.gz FQNNEAFJUBZGOK-VXGBXAGGSA-N 1 3 292.423 3.770 20 0 CHADHO C[N@@H+]1CC[C@@H](N[C@@H](CC2CC2)c2ccccc2)CC1(C)C ZINC000623431731 1117855236 /nfs/dbraw/zinc/85/52/36/1117855236.db2.gz OJMAKBIYVSJLLZ-MSOLQXFVSA-N 1 3 286.463 3.990 20 0 CHADHO C[N@H+]1CC[C@@H](N[C@@H](CC2CC2)c2ccccc2)CC1(C)C ZINC000623431731 1117855241 /nfs/dbraw/zinc/85/52/41/1117855241.db2.gz OJMAKBIYVSJLLZ-MSOLQXFVSA-N 1 3 286.463 3.990 20 0 CHADHO CN1CC[C@H]([NH2+]Cc2ccc(C(F)F)cc2)CC1(C)C ZINC000623493685 1117861956 /nfs/dbraw/zinc/86/19/56/1117861956.db2.gz OFQUDCKORXOVPK-AWEZNQCLSA-N 1 3 282.378 3.587 20 0 CHADHO CCCCc1ccc(CN2C[C@@H](C[NH3+])CC[C@@H]2C)s1 ZINC001206772191 1117872177 /nfs/dbraw/zinc/87/21/77/1117872177.db2.gz ZAOVVUXBIUSOFV-UONOGXRCSA-N 1 3 280.481 3.650 20 0 CHADHO CC(C)Oc1cccc([C@H](C)[NH2+]CC[C@H]2CCCN2C)c1 ZINC000179683909 1117909598 /nfs/dbraw/zinc/90/95/98/1117909598.db2.gz FZAVAMCPBADCGE-DOTOQJQBSA-N 1 3 290.451 3.609 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccc(F)cc1 ZINC000624120016 1117983605 /nfs/dbraw/zinc/98/36/05/1117983605.db2.gz POHXIQRBOILMPD-WMLDXEAASA-N 1 3 278.415 3.598 20 0 CHADHO CC[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccc(F)cc1 ZINC000624120015 1117984012 /nfs/dbraw/zinc/98/40/12/1117984012.db2.gz POHXIQRBOILMPD-RHSMWYFYSA-N 1 3 278.415 3.598 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccc(Cl)c(F)c1 ZINC000624122463 1117984532 /nfs/dbraw/zinc/98/45/32/1117984532.db2.gz RTCBCGDBDHGUEE-QWHCGFSZSA-N 1 3 298.833 3.862 20 0 CHADHO CC[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccc(C)cc1 ZINC000624119593 1117984923 /nfs/dbraw/zinc/98/49/23/1117984923.db2.gz FTGQBOJIUPGWLN-AEFFLSMTSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@H](NC[C@H]1CCCC[N@H+](C)C1)c1ccc(C)cc1 ZINC000624119593 1117984925 /nfs/dbraw/zinc/98/49/25/1117984925.db2.gz FTGQBOJIUPGWLN-AEFFLSMTSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@H](NC[C@H]1CCCC[N@@H+](C)C1)c1ccc(C)cc1 ZINC000624119593 1117984929 /nfs/dbraw/zinc/98/49/29/1117984929.db2.gz FTGQBOJIUPGWLN-AEFFLSMTSA-N 1 3 274.452 3.768 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccc(Cl)c(F)c1 ZINC000624122464 1117985025 /nfs/dbraw/zinc/98/50/25/1117985025.db2.gz RTCBCGDBDHGUEE-STQMWFEESA-N 1 3 298.833 3.862 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccc(C)cc1 ZINC000624119594 1117985082 /nfs/dbraw/zinc/98/50/82/1117985082.db2.gz FTGQBOJIUPGWLN-FUHWJXTLSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@@H](NC[C@@H]1CCCC[N@H+](C)C1)c1ccc(C)cc1 ZINC000624119594 1117985083 /nfs/dbraw/zinc/98/50/83/1117985083.db2.gz FTGQBOJIUPGWLN-FUHWJXTLSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@@H](NC[C@@H]1CCCC[N@@H+](C)C1)c1ccc(C)cc1 ZINC000624119594 1117985085 /nfs/dbraw/zinc/98/50/85/1117985085.db2.gz FTGQBOJIUPGWLN-FUHWJXTLSA-N 1 3 274.452 3.768 20 0 CHADHO Cc1cccc(CC[C@H](C)[NH2+]C[C@H]2CCCCN(C)C2)c1 ZINC000624120668 1117985269 /nfs/dbraw/zinc/98/52/69/1117985269.db2.gz DPHCEYKUJMPWOZ-PKOBYXMFSA-N 1 3 288.479 3.638 20 0 CHADHO CC[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccc(C)cc1 ZINC000624119596 1117986198 /nfs/dbraw/zinc/98/61/98/1117986198.db2.gz FTGQBOJIUPGWLN-WMZOPIPTSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@H](NC[C@@H]1CCCC[N@H+](C)C1)c1ccc(C)cc1 ZINC000624119596 1117986200 /nfs/dbraw/zinc/98/62/00/1117986200.db2.gz FTGQBOJIUPGWLN-WMZOPIPTSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@H](NC[C@@H]1CCCC[N@@H+](C)C1)c1ccc(C)cc1 ZINC000624119596 1117986204 /nfs/dbraw/zinc/98/62/04/1117986204.db2.gz FTGQBOJIUPGWLN-WMZOPIPTSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@H](NC[C@@H]1CCCC[N@H+](C)C1)c1cccs1 ZINC000624120259 1117986355 /nfs/dbraw/zinc/98/63/55/1117986355.db2.gz VACWZPVSPSLYFC-KBPBESRZSA-N 1 3 266.454 3.521 20 0 CHADHO CC[C@H](NC[C@@H]1CCCC[N@@H+](C)C1)c1cccs1 ZINC000624120259 1117986358 /nfs/dbraw/zinc/98/63/58/1117986358.db2.gz VACWZPVSPSLYFC-KBPBESRZSA-N 1 3 266.454 3.521 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCCN(C)C2)c2ccccc21 ZINC000624123332 1117986722 /nfs/dbraw/zinc/98/67/22/1117986722.db2.gz JYONPNPOVWKHCG-RVKKMQEKSA-N 1 3 272.436 3.556 20 0 CHADHO CC[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1cccc(F)c1 ZINC000624123738 1117987658 /nfs/dbraw/zinc/98/76/58/1117987658.db2.gz RVKLLIKBYSUEIZ-PBHICJAKSA-N 1 3 278.415 3.598 20 0 CHADHO Cc1ccc([C@@H](NCc2ccc(C[NH3+])cc2)C2CCC2)o1 ZINC000579474239 1128749280 /nfs/dbraw/zinc/74/92/80/1128749280.db2.gz MSCOTOAOYWKEES-SFHVURJKSA-N 1 3 284.403 3.678 20 0 CHADHO CC[C@@H](NC[C@@H]1CC[N@H+](CC)C1)c1cccc(Cl)c1 ZINC000037644052 1118033402 /nfs/dbraw/zinc/03/34/02/1118033402.db2.gz VMJWEHDTNXYKHC-XJKSGUPXSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@@H](NC[C@@H]1CC[N@@H+](CC)C1)c1cccc(Cl)c1 ZINC000037644052 1118033407 /nfs/dbraw/zinc/03/34/07/1118033407.db2.gz VMJWEHDTNXYKHC-XJKSGUPXSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H]1CCN(CC)C1)c1cccc(Cl)c1 ZINC000037644052 1118033412 /nfs/dbraw/zinc/03/34/12/1118033412.db2.gz VMJWEHDTNXYKHC-XJKSGUPXSA-N 1 3 280.843 3.723 20 0 CHADHO CC[NH+]1CCC(CCN[C@H](C)c2cccc(F)c2F)CC1 ZINC000183272824 1118042032 /nfs/dbraw/zinc/04/20/32/1118042032.db2.gz NJVFOZFSJWFXNW-CYBMUJFWSA-N 1 3 296.405 3.737 20 0 CHADHO Cc1ccc(CNC[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000076446097 1118072621 /nfs/dbraw/zinc/07/26/21/1118072621.db2.gz BUTFRVDTYXSJLB-FQEVSTJZSA-N 1 3 294.442 3.607 20 0 CHADHO Cc1ccc(CNC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000076446097 1118072625 /nfs/dbraw/zinc/07/26/25/1118072625.db2.gz BUTFRVDTYXSJLB-FQEVSTJZSA-N 1 3 294.442 3.607 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1)CN(C)C ZINC000380522665 1118072770 /nfs/dbraw/zinc/07/27/70/1118072770.db2.gz CGEJPEMNFFPTLK-NEPJUHHUSA-N 1 3 288.357 3.554 20 0 CHADHO C[NH+]1CCC([C@H]2CCN(Cc3ccsc3Cl)C2)CC1 ZINC000349149158 1118088526 /nfs/dbraw/zinc/08/85/26/1118088526.db2.gz LFQLLXCNQNKMMP-ZDUSSCGKSA-N 1 3 298.883 3.565 20 0 CHADHO Cc1ccccc1[C@H](C)[NH2+]CCCN1CCCC[C@H]1C ZINC000019913124 1118172642 /nfs/dbraw/zinc/17/26/42/1118172642.db2.gz DETXMEJAXMRPJH-SJORKVTESA-N 1 3 274.452 3.910 20 0 CHADHO [NH3+]CC[C@@H]1CN(c2ccnc(C3CC3)c2)c2ccccc21 ZINC001168548965 1118183193 /nfs/dbraw/zinc/18/31/93/1118183193.db2.gz QQMVJRIFINCWGK-CQSZACIVSA-N 1 3 279.387 3.543 20 0 CHADHO C[C@H](CC[NH2+][C@H]1CC(C)(C)C[C@H]1C)N1CCCCC1 ZINC001650935107 1118220172 /nfs/dbraw/zinc/22/01/72/1118220172.db2.gz AAABEPCGDZCIAR-OAGGEKHMSA-N 1 3 266.473 3.665 20 0 CHADHO CCCCCC[C@@H](C)[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000040622463 1118312029 /nfs/dbraw/zinc/31/20/29/1118312029.db2.gz MOVFOPUFFDOOGI-HZPDHXFCSA-N 1 3 254.462 3.665 20 0 CHADHO [NH3+][C@H]1CCC[C@H](NC2(c3ccc(Cl)cc3)CCC2)C1 ZINC000580095172 1118378448 /nfs/dbraw/zinc/37/84/48/1118378448.db2.gz KIFMCNMVSCFTJH-GJZGRUSLSA-N 1 3 278.827 3.579 20 0 CHADHO Cc1ccc2c(c1)CC[C@H]2[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000765783200 1118405269 /nfs/dbraw/zinc/40/52/69/1118405269.db2.gz KOTJZJFGDBDXTD-QFBILLFUSA-N 1 3 286.463 3.692 20 0 CHADHO CCCN1CCC([N@H+](C)C/C=C\c2ccc(F)cc2)CC1 ZINC000255612998 1118480857 /nfs/dbraw/zinc/48/08/57/1118480857.db2.gz LCSZDRQDTJEDNC-PLNGDYQASA-N 1 3 290.426 3.645 20 0 CHADHO CCCN1CCC([N@@H+](C)C/C=C\c2ccc(F)cc2)CC1 ZINC000255612998 1118480858 /nfs/dbraw/zinc/48/08/58/1118480858.db2.gz LCSZDRQDTJEDNC-PLNGDYQASA-N 1 3 290.426 3.645 20 0 CHADHO C[C@H]([NH2+]C1CC2(C1)CCCC2)[C@@H]1CCCN(C2CCC2)C1 ZINC000926119912 1118499251 /nfs/dbraw/zinc/49/92/51/1118499251.db2.gz SHPSEFMUZOCBNK-JKSUJKDBSA-N 1 3 290.495 3.952 20 0 CHADHO CC(C)C1CCC([NH2+]C[C@@H](C)CN2CCCCC2)CC1 ZINC000109920299 1118587744 /nfs/dbraw/zinc/58/77/44/1118587744.db2.gz NZMUFMIJLLCXRG-WWDZGPRUSA-N 1 3 280.500 3.913 20 0 CHADHO Clc1ccc(CN2CCC[C@H](C3CC[NH2+]CC3)C2)s1 ZINC000656786261 1118656766 /nfs/dbraw/zinc/65/67/66/1118656766.db2.gz QZIBQJZNIPLFNU-ZDUSSCGKSA-N 1 3 298.883 3.613 20 0 CHADHO C[C@@H]1C[C@@H](C)CN(CCC[NH2+]C2CCC(F)(F)CC2)C1 ZINC000647171141 1118658925 /nfs/dbraw/zinc/65/89/25/1118658925.db2.gz AWQCLWGMRGKHFS-ZIAGYGMSSA-N 1 3 288.426 3.522 20 0 CHADHO C[C@@H]1C[C@H](C)CN(CCC[NH2+]C2CCC(F)(F)CC2)C1 ZINC000647171140 1118659355 /nfs/dbraw/zinc/65/93/55/1118659355.db2.gz AWQCLWGMRGKHFS-OKILXGFUSA-N 1 3 288.426 3.522 20 0 CHADHO CCN(CC)CCC[NH2+][C@H](C)CCc1c(F)cccc1F ZINC000510724009 1118797002 /nfs/dbraw/zinc/79/70/02/1118797002.db2.gz UZZSRFGYUIFPSF-CQSZACIVSA-N 1 3 298.421 3.607 20 0 CHADHO CCC[NH2+][C@@H](C)c1ccc(OC)c(CN(CC)CC)c1 ZINC000043809726 1119048694 /nfs/dbraw/zinc/04/86/94/1119048694.db2.gz YTJPUNCNRTXPSF-AWEZNQCLSA-N 1 3 278.440 3.598 20 0 CHADHO CCC[C@@H](NC[C@H]1CC[N@H+](CCC)C1)c1ccccc1 ZINC000151094549 1119392839 /nfs/dbraw/zinc/39/28/39/1119392839.db2.gz NWRGRGQINNVIRD-SJLPKXTDSA-N 1 3 274.452 3.849 20 0 CHADHO CCC[C@@H](NC[C@H]1CC[N@@H+](CCC)C1)c1ccccc1 ZINC000151094549 1119392842 /nfs/dbraw/zinc/39/28/42/1119392842.db2.gz NWRGRGQINNVIRD-SJLPKXTDSA-N 1 3 274.452 3.849 20 0 CHADHO CCC[C@@H]([NH2+]C[C@H]1CCN(CCC)C1)c1ccccc1 ZINC000151094549 1119392845 /nfs/dbraw/zinc/39/28/45/1119392845.db2.gz NWRGRGQINNVIRD-SJLPKXTDSA-N 1 3 274.452 3.849 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H](C)c2cc(C)ccc2C)C1 ZINC000151106122 1119396065 /nfs/dbraw/zinc/39/60/65/1119396065.db2.gz PGGMEVOQMIJOOQ-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H](C)c2cc(C)ccc2C)C1 ZINC000151106122 1119396066 /nfs/dbraw/zinc/39/60/66/1119396066.db2.gz PGGMEVOQMIJOOQ-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO Cc1ccc2c(c1)[C@@H](NCc1ccc(C[NH3+])cc1F)[C@@H](C)C2 ZINC000650754436 1119411418 /nfs/dbraw/zinc/41/14/18/1119411418.db2.gz JAPLKQFEGKBLCS-DJJJIMSYSA-N 1 3 298.405 3.616 20 0 CHADHO C(C1CCCC1)N1CCC([NH2+][C@H]2CCCC23CC3)CC1 ZINC000657859139 1119539758 /nfs/dbraw/zinc/53/97/58/1119539758.db2.gz QAEDYKARMWCRJH-KRWDZBQOSA-N 1 3 276.468 3.563 20 0 CHADHO CCCN1CC[C@@H](C[NH2+]C[C@H](C)CCc2ccccc2)C1 ZINC001648920570 1119595570 /nfs/dbraw/zinc/59/55/70/1119595570.db2.gz CEUHVKKAUUULNS-MJGOQNOKSA-N 1 3 288.479 3.577 20 0 CHADHO Cc1cc([C@H](C)[NH2+]C2CCN(C(C)(C)C)CC2)cs1 ZINC000294223949 1119621562 /nfs/dbraw/zinc/62/15/62/1119621562.db2.gz NSDIJUIUGOHJFG-ZDUSSCGKSA-N 1 3 280.481 3.970 20 0 CHADHO CC[C@H]([NH2+]C1CCN([C@H]2CCC[C@H](C)C2)CC1)C1CC1 ZINC000658236083 1119712609 /nfs/dbraw/zinc/71/26/09/1119712609.db2.gz SXXVEJKXUGQVIB-WBAXXEDZSA-N 1 3 278.484 3.808 20 0 CHADHO Cc1cccc2c1CCC[C@H]2NC1CC[NH+](CC2CC2)CC1 ZINC000658340418 1119728083 /nfs/dbraw/zinc/72/80/83/1119728083.db2.gz YTOKNCLWWCBFRZ-HXUWFJFHSA-N 1 3 298.474 3.836 20 0 CHADHO COc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H](N(C)C)C2)c(C)c1 ZINC000414121601 1119906868 /nfs/dbraw/zinc/90/68/68/1119906868.db2.gz ZWYLPYZGQVRMQV-XHSDSOJGSA-N 1 3 290.451 3.527 20 0 CHADHO CCCCN1CCC([NH2+][C@@H](C)c2ccnc(Cl)c2)CC1 ZINC000164480615 1120034586 /nfs/dbraw/zinc/03/45/86/1120034586.db2.gz ODWNGIVEEZQERV-ZDUSSCGKSA-N 1 3 295.858 3.650 20 0 CHADHO Cc1ccc(CNCc2cccc(C[N@@H+](C)C(C)C)c2)cn1 ZINC000155609414 1120042444 /nfs/dbraw/zinc/04/24/44/1120042444.db2.gz SGWBBDZDBQEQTQ-UHFFFAOYSA-N 1 3 297.446 3.520 20 0 CHADHO Cc1ccc(CNCc2cccc(C[N@H+](C)C(C)C)c2)cn1 ZINC000155609414 1120042448 /nfs/dbraw/zinc/04/24/48/1120042448.db2.gz SGWBBDZDBQEQTQ-UHFFFAOYSA-N 1 3 297.446 3.520 20 0 CHADHO C[C@@H]([NH2+][C@@H](CN)C1CC1)c1cc2c(ccc3ccccc23)o1 ZINC000580301814 1120161777 /nfs/dbraw/zinc/16/17/77/1120161777.db2.gz NGHWEBONKDLTKB-PXAZEXFGSA-N 1 3 294.398 3.974 20 0 CHADHO CC(C)COc1ccc([C@@H](C)[NH2+]C[C@@H](C)CN(C)C)cc1 ZINC000314277393 1120182252 /nfs/dbraw/zinc/18/22/52/1120182252.db2.gz JKSIECTWKGDTRJ-HZPDHXFCSA-N 1 3 292.467 3.570 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@@H](C)[C@H]2CC3CCC2CC3)C1 ZINC000394428743 1120218673 /nfs/dbraw/zinc/21/86/73/1120218673.db2.gz AUOIFVURPWVKFV-JDIAZBHJSA-N 1 3 278.484 3.521 20 0 CHADHO CCC(CC)(CC)CN1CCC([NH2+]C(C)C)CC1 ZINC000542948747 1120274816 /nfs/dbraw/zinc/27/48/16/1120274816.db2.gz GMSCJDOOTSJUBI-UHFFFAOYSA-N 1 3 254.462 3.665 20 0 CHADHO C(CC1CCC1)CN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000659944338 1120299864 /nfs/dbraw/zinc/29/98/64/1120299864.db2.gz JGIVIBGQDKLFEQ-KRWDZBQOSA-N 1 3 264.457 3.517 20 0 CHADHO CCCN1CCC([N@H+](C)Cc2cccc(SC)c2)CC1 ZINC000659983491 1120322315 /nfs/dbraw/zinc/32/23/15/1120322315.db2.gz NWGDGZROORCKRH-UHFFFAOYSA-N 1 3 292.492 3.715 20 0 CHADHO CCCN1CCC([N@@H+](C)Cc2cccc(SC)c2)CC1 ZINC000659983491 1120322319 /nfs/dbraw/zinc/32/23/19/1120322319.db2.gz NWGDGZROORCKRH-UHFFFAOYSA-N 1 3 292.492 3.715 20 0 CHADHO C[C@@H](c1cccc2ccccc21)[N@@H+]1CC[C@](C)(CN)C1 ZINC000312432923 1120362860 /nfs/dbraw/zinc/36/28/60/1120362860.db2.gz AUOBJOZLZONBRQ-KBXCAEBGSA-N 1 3 268.404 3.572 20 0 CHADHO C[C@@H](c1cccc2ccccc21)[N@H+]1CC[C@](C)(CN)C1 ZINC000312432923 1120362861 /nfs/dbraw/zinc/36/28/61/1120362861.db2.gz AUOBJOZLZONBRQ-KBXCAEBGSA-N 1 3 268.404 3.572 20 0 CHADHO C(CC1CCC1)CN1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000660114220 1120381323 /nfs/dbraw/zinc/38/13/23/1120381323.db2.gz GIXUJUSZQUVWQX-FUHWJXTLSA-N 1 3 276.468 3.515 20 0 CHADHO C(CC1CCC1)CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000660114220 1120381329 /nfs/dbraw/zinc/38/13/29/1120381329.db2.gz GIXUJUSZQUVWQX-FUHWJXTLSA-N 1 3 276.468 3.515 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H]2CCCC23CCCCC3)C1 ZINC000313042172 1120381609 /nfs/dbraw/zinc/38/16/09/1120381609.db2.gz QNCIMRXVMPZCBT-IAGOWNOFSA-N 1 3 278.484 3.809 20 0 CHADHO CCC[C@@H]([NH2+]C[C@H]1CCN(C(C)C)C1)C1CCCC1 ZINC000313413512 1120396236 /nfs/dbraw/zinc/39/62/36/1120396236.db2.gz QQHKJHNNJSATNL-NVXWUHKLSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417310961 1120425889 /nfs/dbraw/zinc/42/58/89/1120425889.db2.gz LDGMHMFNHODAGX-UVPYHEFZSA-N 1 3 292.492 3.703 20 0 CHADHO CSCCCCCC[NH2+][C@H]1CCNC[C@H]1C1CCCC1 ZINC000925637737 1120502070 /nfs/dbraw/zinc/50/20/70/1120502070.db2.gz QVZHUDRTXOYSHP-IRXDYDNUSA-N 1 3 298.540 3.668 20 0 CHADHO CN(C)[C@H]1CCC[N@H+](CC[C@H]2CCc3ccccc32)CC1 ZINC000660416642 1120589795 /nfs/dbraw/zinc/58/97/95/1120589795.db2.gz VEYCAQBLNUBJAH-MSOLQXFVSA-N 1 3 286.463 3.523 20 0 CHADHO CN(C)[C@H]1CCC[N@@H+](CC[C@H]2CCc3ccccc32)CC1 ZINC000660416642 1120589800 /nfs/dbraw/zinc/58/98/00/1120589800.db2.gz VEYCAQBLNUBJAH-MSOLQXFVSA-N 1 3 286.463 3.523 20 0 CHADHO CC1=CC[C@@H](CC[N@@H+]2CC[C@@]3(C2)CCCCN3)C1(C)C ZINC001222421117 1120596207 /nfs/dbraw/zinc/59/62/07/1120596207.db2.gz IOLSTFLSWHAFFY-FUHWJXTLSA-N 1 3 276.468 3.587 20 0 CHADHO CC1=CC[C@@H](CC[N@H+]2CC[C@@]3(C2)CCCCN3)C1(C)C ZINC001222421117 1120596210 /nfs/dbraw/zinc/59/62/10/1120596210.db2.gz IOLSTFLSWHAFFY-FUHWJXTLSA-N 1 3 276.468 3.587 20 0 CHADHO CC1([NH+]2CCC2)CCC(NCc2cscc2Cl)CC1 ZINC000922846307 1120611561 /nfs/dbraw/zinc/61/15/61/1120611561.db2.gz BMURFYAHZBUOEA-UHFFFAOYSA-N 1 3 298.883 3.898 20 0 CHADHO CC[C@]1(C)CCC[C@@H]1[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000651705936 1120716891 /nfs/dbraw/zinc/71/68/91/1120716891.db2.gz NGARFHVRZSPZMU-IXDOHACOSA-N 1 3 266.473 3.665 20 0 CHADHO C1CNC[C@]2(C1)CCC[N@@H+](C1CCCCCCC1)C2 ZINC000228081412 1120764085 /nfs/dbraw/zinc/76/40/85/1120764085.db2.gz WWCHVYUQXPNNAZ-KRWDZBQOSA-N 1 3 264.457 3.565 20 0 CHADHO C1CNC[C@]2(C1)CCC[N@H+](C1CCCCCCC1)C2 ZINC000228081412 1120764088 /nfs/dbraw/zinc/76/40/88/1120764088.db2.gz WWCHVYUQXPNNAZ-KRWDZBQOSA-N 1 3 264.457 3.565 20 0 CHADHO CC[C@@H](C)[NH2+][C@@H](C)c1ccc(OC)c(CN(CC)CC)c1 ZINC000182193407 1128940821 /nfs/dbraw/zinc/94/08/21/1128940821.db2.gz GWMVFHLMYYBKJG-CABCVRRESA-N 1 3 292.467 3.986 20 0 CHADHO C[C@H](N)[C@@H]1CCC[N@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000662245809 1120910778 /nfs/dbraw/zinc/91/07/78/1120910778.db2.gz OZDIRMUXZNMJSC-QFHJOOASSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@H](N)[C@@H]1CCC[N@@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000662245809 1120910781 /nfs/dbraw/zinc/91/07/81/1120910781.db2.gz OZDIRMUXZNMJSC-QFHJOOASSA-N 1 3 286.463 3.630 20 0 CHADHO c1ccc2c(c1)CCC[C@H]2NCCC[NH+]1CCCCC1 ZINC000021020458 1120952514 /nfs/dbraw/zinc/95/25/14/1120952514.db2.gz LVHJQAWLVYLLJI-GOSISDBHSA-N 1 3 272.436 3.530 20 0 CHADHO C[C@@H]1Cc2ccccc2[C@@H]1NC[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663467306 1120981746 /nfs/dbraw/zinc/98/17/46/1120981746.db2.gz DTSHZNQNHRDYSR-OXFYSEKESA-N 1 3 298.474 3.632 20 0 CHADHO C[C@@H]1Cc2ccccc2[C@@H]1NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663467306 1120981749 /nfs/dbraw/zinc/98/17/49/1120981749.db2.gz DTSHZNQNHRDYSR-OXFYSEKESA-N 1 3 298.474 3.632 20 0 CHADHO C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663467306 1120981750 /nfs/dbraw/zinc/98/17/50/1120981750.db2.gz DTSHZNQNHRDYSR-OXFYSEKESA-N 1 3 298.474 3.632 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2NC[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663469086 1120982841 /nfs/dbraw/zinc/98/28/41/1120982841.db2.gz OEDLXFBKCQHKSW-PXNSSMCTSA-N 1 3 298.474 3.776 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000663469086 1120982843 /nfs/dbraw/zinc/98/28/43/1120982843.db2.gz OEDLXFBKCQHKSW-PXNSSMCTSA-N 1 3 298.474 3.776 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N1CCC[C@H]1c1nccs1 ZINC001167836457 1121038324 /nfs/dbraw/zinc/03/83/24/1121038324.db2.gz DTEDEJYDGJMQRG-CABCVRRESA-N 1 3 295.496 3.791 20 0 CHADHO Cc1oc2ccccc2c1CCN[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000344134125 1121099483 /nfs/dbraw/zinc/09/94/83/1121099483.db2.gz OUCLHONSGGSAJC-CVEARBPZSA-N 1 3 298.430 3.500 20 0 CHADHO Cc1oc2ccccc2c1CCN[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000344134125 1121099491 /nfs/dbraw/zinc/09/94/91/1121099491.db2.gz OUCLHONSGGSAJC-CVEARBPZSA-N 1 3 298.430 3.500 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCc3ccccc32)C1 ZINC000344199038 1121116765 /nfs/dbraw/zinc/11/67/65/1121116765.db2.gz LMGXSYIHJNAOJE-JFIYKMOQSA-N 1 3 272.436 3.526 20 0 CHADHO CCc1ccc([C@@H](N[C@H]2CCC[NH2+]CC2)C(C)C)cc1 ZINC000261596733 1121241235 /nfs/dbraw/zinc/24/12/35/1121241235.db2.gz PJZDLDIAAPQJPL-ROUUACIJSA-N 1 3 274.452 3.678 20 0 CHADHO CC(C)[NH+]1CCC(N[C@@H]2C[C@@H](C)c3ccccc32)CC1 ZINC000274223564 1121273149 /nfs/dbraw/zinc/27/31/49/1121273149.db2.gz OMQOOVNFFLAHNH-RDTXWAMCSA-N 1 3 272.436 3.697 20 0 CHADHO CC(C)CC[N@@H+]1CCC[C@@H]1CCN1CCC(C)CC1 ZINC001175350068 1121291730 /nfs/dbraw/zinc/29/17/30/1121291730.db2.gz HUWUDPNBFRTYGM-QGZVFWFLSA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)CC[N@H+]1CCC[C@@H]1CCN1CCC(C)CC1 ZINC001175350068 1121291734 /nfs/dbraw/zinc/29/17/34/1121291734.db2.gz HUWUDPNBFRTYGM-QGZVFWFLSA-N 1 3 266.473 3.619 20 0 CHADHO CCC[C@@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000675723158 1121347934 /nfs/dbraw/zinc/34/79/34/1121347934.db2.gz YBFDHVKCYRVSRD-CQSZACIVSA-N 1 3 252.446 3.562 20 0 CHADHO C[C@H](C[NH2+]C1CCN(C2CCCC2)CC1)C(C)(C)C ZINC000675884378 1121382344 /nfs/dbraw/zinc/38/23/44/1121382344.db2.gz UZDIZVOZMBRZCG-CQSZACIVSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@@H]1CCCCC[C@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000675906474 1121386812 /nfs/dbraw/zinc/38/68/12/1121386812.db2.gz WYJZHNIYXFCKCL-CRAIPNDOSA-N 1 3 278.484 3.952 20 0 CHADHO Cc1cc(C)c(CN(C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c(C)c1 ZINC000512541919 1121422566 /nfs/dbraw/zinc/42/25/66/1121422566.db2.gz JGRFLVZTVJSLPP-JWTNVVGKSA-N 1 3 286.463 3.669 20 0 CHADHO Cc1cc(C)c(CN(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(C)c1 ZINC000512541919 1121422568 /nfs/dbraw/zinc/42/25/68/1121422568.db2.gz JGRFLVZTVJSLPP-JWTNVVGKSA-N 1 3 286.463 3.669 20 0 CHADHO c1ccc2c(c1)cccc2CN1CCC[C@H]([C@@H]2CCC[NH2+]2)C1 ZINC000314763619 1121444757 /nfs/dbraw/zinc/44/47/57/1121444757.db2.gz RDKABHUUHFICEH-ICSRJNTNSA-N 1 3 294.442 3.804 20 0 CHADHO CC[NH+](CC)CCCN1C[C@@H](C)C[C@@H]1c1ccccc1 ZINC000513236993 1121676687 /nfs/dbraw/zinc/67/66/87/1121676687.db2.gz ROWLAOXHDTWBMC-FUHWJXTLSA-N 1 3 274.452 3.801 20 0 CHADHO CCN(CC)CCC[N@@H+]1C[C@@H](C)C[C@@H]1c1ccccc1 ZINC000513236993 1121676688 /nfs/dbraw/zinc/67/66/88/1121676688.db2.gz ROWLAOXHDTWBMC-FUHWJXTLSA-N 1 3 274.452 3.801 20 0 CHADHO CCN(CC)CCC[N@H+]1C[C@@H](C)C[C@@H]1c1ccccc1 ZINC000513236993 1121676691 /nfs/dbraw/zinc/67/66/91/1121676691.db2.gz ROWLAOXHDTWBMC-FUHWJXTLSA-N 1 3 274.452 3.801 20 0 CHADHO CCC1CCC([NH2+]CCCN2C[C@H](C)C[C@H](C)C2)CC1 ZINC001177295007 1121720956 /nfs/dbraw/zinc/72/09/56/1121720956.db2.gz WAGFALRNLAIJAH-OQSMONGASA-N 1 3 280.500 3.913 20 0 CHADHO C[C@H]1C[C@H]([NH2+]C[C@H]2CCCN(CC3CC3)C2)C[C@@H](C)C1 ZINC001179266723 1121865768 /nfs/dbraw/zinc/86/57/68/1121865768.db2.gz WRHQOZFDLLEYHY-ATLSCFEFSA-N 1 3 278.484 3.523 20 0 CHADHO CSc1ccccc1[C@@H](C)[NH2+]CC[C@H]1CCCCN1C ZINC000501502522 1121984447 /nfs/dbraw/zinc/98/44/47/1121984447.db2.gz JJTSHHVANFVMOA-HUUCEWRRSA-N 1 3 292.492 3.934 20 0 CHADHO C[C@@H](N)C[N@H+]([C@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000420322915 1121995547 /nfs/dbraw/zinc/99/55/47/1121995547.db2.gz SSPKKZMHEXPACE-ZIAGYGMSSA-N 1 3 268.404 3.712 20 0 CHADHO C[C@@H](N)C[N@@H+]([C@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000420322915 1121995550 /nfs/dbraw/zinc/99/55/50/1121995550.db2.gz SSPKKZMHEXPACE-ZIAGYGMSSA-N 1 3 268.404 3.712 20 0 CHADHO C[C@H](CC(C)(C)C)[NH2+]CC(C)(C)CN1CCCC1 ZINC001181426841 1122053598 /nfs/dbraw/zinc/05/35/98/1122053598.db2.gz FUQWCINNIVTPKY-CQSZACIVSA-N 1 3 254.462 3.523 20 0 CHADHO CCSCCCNC1CC[NH+]([C@H]2CCCC[C@@H]2C)CC1 ZINC000502346946 1122076630 /nfs/dbraw/zinc/07/66/30/1122076630.db2.gz RMZAHFCVERGYFX-RDJZCZTQSA-N 1 3 298.540 3.762 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+][C@@H]2CCC[C@H]3C[C@]32C)C1 ZINC000502413712 1122083528 /nfs/dbraw/zinc/08/35/28/1122083528.db2.gz IDTZMBWMTBSFGY-XMTFNYHQSA-N 1 3 278.484 3.523 20 0 CHADHO CC(C)CN1CCC([NH2+]Cc2cccc(C3CC3)c2)CC1 ZINC000421324555 1122093392 /nfs/dbraw/zinc/09/33/92/1122093392.db2.gz IQNZZZVEZNODRP-UHFFFAOYSA-N 1 3 286.463 3.774 20 0 CHADHO CC[C@H](CN1CCC(CC)([NH+](C)C)CC1)c1ccccc1 ZINC001183196725 1122210513 /nfs/dbraw/zinc/21/05/13/1122210513.db2.gz HOOMNDWOHOHZAC-QGZVFWFLSA-N 1 3 288.479 3.986 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CC[C@H](C)[C@@H](CN)C1 ZINC001205296218 1122274933 /nfs/dbraw/zinc/27/49/33/1122274933.db2.gz JGMBHJSSQWDJAZ-ULQDDVLXSA-N 1 3 266.473 3.676 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CC[C@H](C)[C@@H](CN)C1 ZINC001205296218 1122274935 /nfs/dbraw/zinc/27/49/35/1122274935.db2.gz JGMBHJSSQWDJAZ-ULQDDVLXSA-N 1 3 266.473 3.676 20 0 CHADHO CC[C@@H]1CCC[C@@H]([NH2+][C@@H](C)CCN(CC)CC)C1 ZINC001184417998 1122275673 /nfs/dbraw/zinc/27/56/73/1122275673.db2.gz JSXNDBVGUVCWED-ARFHVFGLSA-N 1 3 254.462 3.665 20 0 CHADHO CC[C@@H]([NH2+]CC[C@@H]1CCCCN1C)c1ccccc1OC ZINC000775077158 1122417886 /nfs/dbraw/zinc/41/78/86/1122417886.db2.gz KIRIHQRCAJANIJ-DOTOQJQBSA-N 1 3 290.451 3.610 20 0 CHADHO CC(C)[NH2+]C1CCN(CC2CCC(C(C)C)CC2)CC1 ZINC000515094120 1122476685 /nfs/dbraw/zinc/47/66/85/1122476685.db2.gz ZSTKSGCSHWEVMY-UHFFFAOYSA-N 1 3 280.500 3.911 20 0 CHADHO Cc1oc2ccccc2c1[C@H](C)NC[C@H]1CCC[N@H+](C)C1 ZINC000925009403 1122563271 /nfs/dbraw/zinc/56/32/71/1122563271.db2.gz HGOJCAPVDYQGDY-DZGCQCFKSA-N 1 3 286.419 3.734 20 0 CHADHO Cc1oc2ccccc2c1[C@H](C)NC[C@H]1CCC[N@@H+](C)C1 ZINC000925009403 1122563272 /nfs/dbraw/zinc/56/32/72/1122563272.db2.gz HGOJCAPVDYQGDY-DZGCQCFKSA-N 1 3 286.419 3.734 20 0 CHADHO CC(C)[C@@H](CC(F)(F)F)[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000437082145 1122610406 /nfs/dbraw/zinc/61/04/06/1122610406.db2.gz AYAXPIHPWPTDAQ-CYBMUJFWSA-N 1 3 294.405 3.816 20 0 CHADHO CC(C)[C@@H](CC(F)(F)F)NC1CC[NH+](C(C)(C)C)CC1 ZINC000437082145 1122610407 /nfs/dbraw/zinc/61/04/07/1122610407.db2.gz AYAXPIHPWPTDAQ-CYBMUJFWSA-N 1 3 294.405 3.816 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCC[C@H]1c1ccc(Cl)cc1)CN(C)C ZINC000425934387 1122662838 /nfs/dbraw/zinc/66/28/38/1122662838.db2.gz BPAURFKPEGPPRV-COXVUDFISA-N 1 3 294.870 3.763 20 0 CHADHO CCN(CC)CCC[N@@H+](CC)[C@@H]1CCCC[C@H]1C ZINC001193412575 1122690695 /nfs/dbraw/zinc/69/06/95/1122690695.db2.gz FOUQSSRCAPHSRU-HZPDHXFCSA-N 1 3 254.462 3.619 20 0 CHADHO CCN(CC)CCC[N@H+](CC)[C@@H]1CCCC[C@H]1C ZINC001193412575 1122690694 /nfs/dbraw/zinc/69/06/94/1122690694.db2.gz FOUQSSRCAPHSRU-HZPDHXFCSA-N 1 3 254.462 3.619 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H](C)c2cc3ccccc3[nH]2)C1 ZINC000775626768 1122829783 /nfs/dbraw/zinc/82/97/83/1122829783.db2.gz JNDOUINVPDDDOB-CVEARBPZSA-N 1 3 299.462 3.939 20 0 CHADHO CC(C)C([NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1)C(C)C ZINC001167967910 1122848418 /nfs/dbraw/zinc/84/84/18/1122848418.db2.gz KYYAUXSRCJFAIA-ALOPSCKCSA-N 1 3 278.484 3.662 20 0 CHADHO FC1(F)CCC[C@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C1 ZINC001167967928 1122848429 /nfs/dbraw/zinc/84/84/29/1122848429.db2.gz LLSLWZCMCIEILI-HNSVSWJLSA-N 1 3 298.421 3.559 20 0 CHADHO FC1(F)CCC[C@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)C1 ZINC001167967928 1122848433 /nfs/dbraw/zinc/84/84/33/1122848433.db2.gz LLSLWZCMCIEILI-HNSVSWJLSA-N 1 3 298.421 3.559 20 0 CHADHO Cc1cccc([C@@H](C)[N@@H+]2CCCN(c3ccncc3)CC2)c1 ZINC001195535353 1122876058 /nfs/dbraw/zinc/87/60/58/1122876058.db2.gz IPFHYFWNFQZUAK-QGZVFWFLSA-N 1 3 295.430 3.663 20 0 CHADHO Cc1cccc([C@@H](C)[N@H+]2CCCN(c3ccncc3)CC2)c1 ZINC001195535353 1122876060 /nfs/dbraw/zinc/87/60/60/1122876060.db2.gz IPFHYFWNFQZUAK-QGZVFWFLSA-N 1 3 295.430 3.663 20 0 CHADHO CC1(C)CCCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167975271 1122877643 /nfs/dbraw/zinc/87/76/43/1122877643.db2.gz NIJXIARYMWDTGG-HQSKLWIPSA-N 1 3 290.495 3.950 20 0 CHADHO C(C1CC1)N1[C@@H]2CC[C@H]1CC([NH2+][C@@H]1CCCC13CCC3)C2 ZINC001167981907 1122897328 /nfs/dbraw/zinc/89/73/28/1122897328.db2.gz OTCZFEGNTKVGGA-HQSKLWIPSA-N 1 3 288.479 3.704 20 0 CHADHO CCC[NH+](CCC)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167981846 1122897551 /nfs/dbraw/zinc/89/75/51/1122897551.db2.gz MYNNKWCZPVNPTM-SJPCQFCGSA-N 1 3 264.457 3.514 20 0 CHADHO CC/C=C\CCCCC[N@@H+]1CCC[C@H](CN)[C@H]1C ZINC001205901691 1123059937 /nfs/dbraw/zinc/05/99/37/1123059937.db2.gz FDVBPJFTJWYEEN-KSLSASGISA-N 1 3 252.446 3.572 20 0 CHADHO CC/C=C\CCCCC[N@H+]1CCC[C@H](CN)[C@H]1C ZINC001205901691 1123059940 /nfs/dbraw/zinc/05/99/40/1123059940.db2.gz FDVBPJFTJWYEEN-KSLSASGISA-N 1 3 252.446 3.572 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@@H+]1CC1CCCCC1 ZINC001201400018 1123092280 /nfs/dbraw/zinc/09/22/80/1123092280.db2.gz MNIAIELDJINRSR-ZWKOTPCHSA-N 1 3 278.484 3.906 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@H+]1CC1CCCCC1 ZINC001201400018 1123092283 /nfs/dbraw/zinc/09/22/83/1123092283.db2.gz MNIAIELDJINRSR-ZWKOTPCHSA-N 1 3 278.484 3.906 20 0 CHADHO C[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1ccc(-c2cccnc2)cc1 ZINC000520428945 1123098662 /nfs/dbraw/zinc/09/86/62/1123098662.db2.gz DUYFBSQTPLRVDO-JVPBZIDWSA-N 1 3 295.430 3.669 20 0 CHADHO CCC[C@H](C)C[N@@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001201550295 1123117903 /nfs/dbraw/zinc/11/79/03/1123117903.db2.gz IEXKBTYYXHEHEA-IRXDYDNUSA-N 1 3 266.473 3.763 20 0 CHADHO CCC[C@H](C)C[N@H+]1CCCC[C@H]1CCN1CCCC1 ZINC001201550295 1123117904 /nfs/dbraw/zinc/11/79/04/1123117904.db2.gz IEXKBTYYXHEHEA-IRXDYDNUSA-N 1 3 266.473 3.763 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@@H+]1CCc1ccccc1 ZINC001201606116 1123130714 /nfs/dbraw/zinc/13/07/14/1123130714.db2.gz JRKHLSUWQWVKPR-RBUKOAKNSA-N 1 3 286.463 3.568 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@H+]1CCc1ccccc1 ZINC001201606116 1123130715 /nfs/dbraw/zinc/13/07/15/1123130715.db2.gz JRKHLSUWQWVKPR-RBUKOAKNSA-N 1 3 286.463 3.568 20 0 CHADHO CCC(C)(C)CC[N@@H+]1CC[C@@H](CN2CCCCC2)C1 ZINC000441461596 1123134008 /nfs/dbraw/zinc/13/40/08/1123134008.db2.gz XEPUCKWHVOAGSZ-INIZCTEOSA-N 1 3 266.473 3.621 20 0 CHADHO CCC(C)(C)CC[N@H+]1CC[C@@H](CN2CCCCC2)C1 ZINC000441461596 1123134009 /nfs/dbraw/zinc/13/40/09/1123134009.db2.gz XEPUCKWHVOAGSZ-INIZCTEOSA-N 1 3 266.473 3.621 20 0 CHADHO CCCC1(CN[C@H]2C[C@@H]([NH3+])c3ccccc32)CCC1 ZINC000391796549 1123215280 /nfs/dbraw/zinc/21/52/80/1123215280.db2.gz DGLCEVJMXBFKGS-CVEARBPZSA-N 1 3 258.409 3.691 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC000536496461 1123233505 /nfs/dbraw/zinc/23/35/05/1123233505.db2.gz GZRZJOZVFBDJPR-SUMWQHHRSA-N 1 3 292.854 3.649 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC000536496461 1123233509 /nfs/dbraw/zinc/23/35/09/1123233509.db2.gz GZRZJOZVFBDJPR-SUMWQHHRSA-N 1 3 292.854 3.649 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC000536496461 1123233512 /nfs/dbraw/zinc/23/35/12/1123233512.db2.gz GZRZJOZVFBDJPR-SUMWQHHRSA-N 1 3 292.854 3.649 20 0 CHADHO CC(C)C[C@@H]([NH2+]CC1(N)CCCC1)c1cccs1 ZINC000665248361 1123262075 /nfs/dbraw/zinc/26/20/75/1123262075.db2.gz VQWAALFEIXQTOF-CYBMUJFWSA-N 1 3 266.454 3.696 20 0 CHADHO C[C@H](C[NH2+][C@H](C)C1CCC(F)(F)CC1)CN1CCCC1 ZINC000474033091 1123312769 /nfs/dbraw/zinc/31/27/69/1123312769.db2.gz KTHVNFHJHBLANH-ZIAGYGMSSA-N 1 3 288.426 3.522 20 0 CHADHO C[C@@H]1CCC[C@H]1C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000467442417 1123318910 /nfs/dbraw/zinc/31/89/10/1123318910.db2.gz FULAOZYQGASBBT-CVEARBPZSA-N 1 3 278.484 3.809 20 0 CHADHO Cc1c2ccccc2oc1[C@@H](C)NCC1=CC[N@H+](C)CC1 ZINC000271906001 1129115791 /nfs/dbraw/zinc/11/57/91/1129115791.db2.gz WQISDNZRFXBWIK-CQSZACIVSA-N 1 3 284.403 3.654 20 0 CHADHO Cc1c2ccccc2oc1[C@@H](C)NCC1=CC[N@@H+](C)CC1 ZINC000271906001 1129115792 /nfs/dbraw/zinc/11/57/92/1129115792.db2.gz WQISDNZRFXBWIK-CQSZACIVSA-N 1 3 284.403 3.654 20 0 CHADHO CCC[C@H](N[C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccsc1 ZINC000443086646 1123354723 /nfs/dbraw/zinc/35/47/23/1123354723.db2.gz NJUWAAKHODYPFQ-QEJZJMRPSA-N 1 3 266.454 3.662 20 0 CHADHO CCC[C@H](N[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccsc1 ZINC000443086646 1123354726 /nfs/dbraw/zinc/35/47/26/1123354726.db2.gz NJUWAAKHODYPFQ-QEJZJMRPSA-N 1 3 266.454 3.662 20 0 CHADHO C[NH+](C)CCCCNCc1oc2ccccc2c1Cl ZINC000631055051 1123412642 /nfs/dbraw/zinc/41/26/42/1123412642.db2.gz FPJKEINCGSMJJN-UHFFFAOYSA-N 1 3 280.799 3.518 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1C[N@@H+]1CC[C@H](CN(C)CC2CC2)C1 ZINC000443641867 1123456349 /nfs/dbraw/zinc/45/63/49/1123456349.db2.gz MRBLKZGEDCDJHB-QXAKKESOSA-N 1 3 290.495 3.643 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1C[N@H+]1CC[C@H](CN(C)CC2CC2)C1 ZINC000443641867 1123456351 /nfs/dbraw/zinc/45/63/51/1123456351.db2.gz MRBLKZGEDCDJHB-QXAKKESOSA-N 1 3 290.495 3.643 20 0 CHADHO c1ccc2c(c1)CC([NH2+]C1CCN(C3CCCCC3)CC1)C2 ZINC000157542251 1129129834 /nfs/dbraw/zinc/12/98/34/1129129834.db2.gz SJUICAPHNUWEDE-UHFFFAOYSA-N 1 3 298.474 3.541 20 0 CHADHO c1ccc2c(c1)CC(NC1CC[NH+](C3CCCCC3)CC1)C2 ZINC000157542251 1129129836 /nfs/dbraw/zinc/12/98/36/1129129836.db2.gz SJUICAPHNUWEDE-UHFFFAOYSA-N 1 3 298.474 3.541 20 0 CHADHO CCCCCCN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000119041709 1123827037 /nfs/dbraw/zinc/82/70/37/1123827037.db2.gz HHHOJFIWEIGBFJ-INIZCTEOSA-N 1 3 252.446 3.517 20 0 CHADHO CC[NH+]1CCC(N[C@H]2C[C@@H](C(C)C)c3ccccc32)CC1 ZINC000447521198 1124480223 /nfs/dbraw/zinc/48/02/23/1124480223.db2.gz VPSNXKOZRILUNH-OALUTQOASA-N 1 3 286.463 3.945 20 0 CHADHO CCN1CCC[C@H](C[NH2+]CC[C@H](C)c2ccccc2)C1 ZINC000447820968 1124526514 /nfs/dbraw/zinc/52/65/14/1124526514.db2.gz IUUAGFILIKDIEB-DLBZAZTESA-N 1 3 274.452 3.502 20 0 CHADHO CCN1CCC[C@@H](C[NH2+]CC[C@H](C)c2ccccc2)C1 ZINC000447820970 1124526969 /nfs/dbraw/zinc/52/69/69/1124526969.db2.gz IUUAGFILIKDIEB-IRXDYDNUSA-N 1 3 274.452 3.502 20 0 CHADHO CC(C)(C)N1CCC([NH2+]Cc2cccc3ccoc32)CC1 ZINC000449085714 1124643745 /nfs/dbraw/zinc/64/37/45/1124643745.db2.gz AHRUMBUJHIWDML-UHFFFAOYSA-N 1 3 286.419 3.785 20 0 CHADHO C[C@H](Cc1coc2ccccc12)N[C@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000449083014 1124646805 /nfs/dbraw/zinc/64/68/05/1124646805.db2.gz RREOHVGDDBOFFD-FHLIZLRMSA-N 1 3 298.430 3.580 20 0 CHADHO C[C@H](Cc1coc2ccccc12)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000449083014 1124646808 /nfs/dbraw/zinc/64/68/08/1124646808.db2.gz RREOHVGDDBOFFD-FHLIZLRMSA-N 1 3 298.430 3.580 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H](C)CC(C)(C)C)C1 ZINC000449129829 1124653316 /nfs/dbraw/zinc/65/33/16/1124653316.db2.gz DRVBQLVPOUGJNB-CABCVRRESA-N 1 3 254.462 3.521 20 0 CHADHO C[C@@H]1CC[C@@H](C)[C@@H]([NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000449187350 1124668521 /nfs/dbraw/zinc/66/85/21/1124668521.db2.gz QMDYEKUCJVEUJC-RKVPGOIHSA-N 1 3 278.484 3.808 20 0 CHADHO CC[C@H](N[C@H](C)c1cccc(C[NH+](C)C)c1)c1ccncc1 ZINC000820811130 1131301978 /nfs/dbraw/zinc/30/19/78/1131301978.db2.gz LHKOVTROXHGGQJ-BEFAXECRSA-N 1 3 297.446 3.945 20 0 CHADHO Cc1ccc(F)c(CC[NH2+]C2CCN(C(C)(C)C)CC2)c1 ZINC000449558436 1124800053 /nfs/dbraw/zinc/80/00/53/1124800053.db2.gz XNJYIBGADNEKAW-UHFFFAOYSA-N 1 3 292.442 3.529 20 0 CHADHO Cc1ccc(F)c(CCNC2CC[NH+](C(C)(C)C)CC2)c1 ZINC000449558436 1124800060 /nfs/dbraw/zinc/80/00/60/1124800060.db2.gz XNJYIBGADNEKAW-UHFFFAOYSA-N 1 3 292.442 3.529 20 0 CHADHO CCCCN(C)CCC[NH2+][C@@H](C)Cc1ccc(Cl)cc1 ZINC001168152488 1125273447 /nfs/dbraw/zinc/27/34/47/1125273447.db2.gz VOGGXGXMCGCETB-HNNXBMFYSA-N 1 3 296.886 3.983 20 0 CHADHO C[C@@H](CN)C[N@H+](Cc1ccccc1)C1CCC(C)CC1 ZINC001168204272 1125410908 /nfs/dbraw/zinc/41/09/08/1125410908.db2.gz HIXZHYFWOQPHBR-PQUAAJSLSA-N 1 3 274.452 3.662 20 0 CHADHO C[C@@H](CN)C[N@@H+](Cc1ccccc1)C1CCC(C)CC1 ZINC001168204272 1125410910 /nfs/dbraw/zinc/41/09/10/1125410910.db2.gz HIXZHYFWOQPHBR-PQUAAJSLSA-N 1 3 274.452 3.662 20 0 CHADHO CC(C)[N@@H+]1CCC[C@@H](CN[C@@H]2CCCc3ccccc32)C1 ZINC000125946972 1125451895 /nfs/dbraw/zinc/45/18/95/1125451895.db2.gz HDFZYCQBUDNCSC-QFBILLFUSA-N 1 3 286.463 3.774 20 0 CHADHO CC(C)[N@H+]1CCC[C@@H](CN[C@@H]2CCCc3ccccc32)C1 ZINC000125946972 1125451900 /nfs/dbraw/zinc/45/19/00/1125451900.db2.gz HDFZYCQBUDNCSC-QFBILLFUSA-N 1 3 286.463 3.774 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H]2CCCc3ccccc32)C1 ZINC000125946972 1125451901 /nfs/dbraw/zinc/45/19/01/1125451901.db2.gz HDFZYCQBUDNCSC-QFBILLFUSA-N 1 3 286.463 3.774 20 0 CHADHO CSC(C)(C)C[C@@H](C)[NH2+]C1CCN(C2CCCC2)CC1 ZINC001258331108 1129207640 /nfs/dbraw/zinc/20/76/40/1129207640.db2.gz IBLICAXDGCEDIM-CQSZACIVSA-N 1 3 298.540 3.903 20 0 CHADHO Cc1cc([C@H](C)N[C@@H]2CC[N@H+](C)[C@H](C)C2)cc(C)c1F ZINC000166406800 1129224116 /nfs/dbraw/zinc/22/41/16/1129224116.db2.gz VNILHATXDHFHCC-IJEWVQPXSA-N 1 3 278.415 3.576 20 0 CHADHO Cc1cc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc(C)c1F ZINC000166406800 1129224120 /nfs/dbraw/zinc/22/41/20/1129224120.db2.gz VNILHATXDHFHCC-IJEWVQPXSA-N 1 3 278.415 3.576 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2cccc3ncccc23)C[C@@H]1C ZINC000638111123 1129243381 /nfs/dbraw/zinc/24/33/81/1129243381.db2.gz RIYXVLOEGZHUDD-DOTOQJQBSA-N 1 3 297.446 3.539 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2cccc3ncccc23)C[C@@H]1C ZINC000638111123 1129243383 /nfs/dbraw/zinc/24/33/83/1129243383.db2.gz RIYXVLOEGZHUDD-DOTOQJQBSA-N 1 3 297.446 3.539 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NCCCCc2ccccc2)c2ccccc21 ZINC000643458341 1129442210 /nfs/dbraw/zinc/44/22/10/1129442210.db2.gz NTTUMECJVJFHQK-RTBURBONSA-N 1 3 280.415 3.744 20 0 CHADHO C[C@@H](N[C@H]1CC12CC[NH2+]CC2)c1cc(Cl)ccc1Cl ZINC000643534455 1129444416 /nfs/dbraw/zinc/44/44/16/1129444416.db2.gz VLNOXIWBUGCIGL-YGRLFVJLSA-N 1 3 299.245 3.786 20 0 CHADHO CC(C)(C)N1CCC([NH2+]Cc2ccccc2C2CC2)CC1 ZINC000094357730 1129444620 /nfs/dbraw/zinc/44/46/20/1129444620.db2.gz BPGIDZNBPQTCJY-UHFFFAOYSA-N 1 3 286.463 3.917 20 0 CHADHO Cc1ccc(C[C@@H]([NH2+][C@H]2CCNC3(CCC3)C2)C2CC2)cc1 ZINC000643548177 1129445440 /nfs/dbraw/zinc/44/54/40/1129445440.db2.gz NMPDKVKYYYRQGF-RBUKOAKNSA-N 1 3 298.474 3.580 20 0 CHADHO CN1CCC[C@@H]1CC[N@@H+]1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC000646117956 1129524167 /nfs/dbraw/zinc/52/41/67/1129524167.db2.gz BUEOROLNWVHFFY-RTBURBONSA-N 1 3 296.458 3.864 20 0 CHADHO CN1CCC[C@@H]1CC[N@H+]1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC000646117956 1129524168 /nfs/dbraw/zinc/52/41/68/1129524168.db2.gz BUEOROLNWVHFFY-RTBURBONSA-N 1 3 296.458 3.864 20 0 CHADHO CCc1oc2ccccc2c1CN1CC[C@H]([NH3+])[C@H](CC)C1 ZINC000647498937 1129580263 /nfs/dbraw/zinc/58/02/63/1129580263.db2.gz UINCCRUZXXXDIM-CJNGLKHVSA-N 1 3 286.419 3.554 20 0 CHADHO Clc1sccc1CN1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647543901 1129580651 /nfs/dbraw/zinc/58/06/51/1129580651.db2.gz UGKAQBPUNSYOGZ-CHWSQXEVSA-N 1 3 298.883 3.613 20 0 CHADHO CCCN(C[C@H]1CC[NH2+]C1)[C@@H](C)c1cc2ccccc2o1 ZINC000647882242 1129587303 /nfs/dbraw/zinc/58/73/03/1129587303.db2.gz ZVFNFTKSJZXHIE-GJZGRUSLSA-N 1 3 286.419 3.815 20 0 CHADHO CC1([NH3+])CCN(C2c3ccccc3-c3ccccc32)CC1 ZINC000647924258 1129588285 /nfs/dbraw/zinc/58/82/85/1129588285.db2.gz SBBVZUSZVLRDKL-UHFFFAOYSA-N 1 3 278.399 3.570 20 0 CHADHO C[C@@H](c1ccc(Cl)cc1)N1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000647970012 1129590562 /nfs/dbraw/zinc/59/05/62/1129590562.db2.gz RHIXHSKSKOHNSW-XJKSGUPXSA-N 1 3 292.854 3.723 20 0 CHADHO C[C@@H](N[C@H](c1ccco1)c1ccccc1)C1CC[NH+](C)CC1 ZINC000387341320 1129654375 /nfs/dbraw/zinc/65/43/75/1129654375.db2.gz WFWYTUXPFIHUOE-BEFAXECRSA-N 1 3 298.430 3.689 20 0 CHADHO CCOc1cccc([C@H](C)[NH2+][C@H]2CCC[C@@H](N(C)C)C2)c1 ZINC000766480740 1129670718 /nfs/dbraw/zinc/67/07/18/1129670718.db2.gz UUIDPMSUVPYUDZ-BHYGNILZSA-N 1 3 290.451 3.609 20 0 CHADHO CN1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1cc(Cl)cc(Cl)c1)C2 ZINC001169093815 1129696352 /nfs/dbraw/zinc/69/63/52/1129696352.db2.gz JGFMOLFAEZFDJP-QKDCVEJESA-N 1 3 299.245 3.708 20 0 CHADHO C[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)N2C)c1ccc(F)c(Cl)c1 ZINC001169099744 1129696931 /nfs/dbraw/zinc/69/69/31/1129696931.db2.gz UQVKJDSQSKMKND-RUZUBIRVSA-N 1 3 296.817 3.755 20 0 CHADHO CC(C)[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001169100726 1129697740 /nfs/dbraw/zinc/69/77/40/1129697740.db2.gz MAMULAUWASPGRH-MHORFTMASA-N 1 3 290.426 3.738 20 0 CHADHO CC(C)[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001169100726 1129697741 /nfs/dbraw/zinc/69/77/41/1129697741.db2.gz MAMULAUWASPGRH-MHORFTMASA-N 1 3 290.426 3.738 20 0 CHADHO CCCCc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)N3C)cc1 ZINC001169091697 1129699776 /nfs/dbraw/zinc/69/97/76/1129699776.db2.gz UQHBPQZFVUSCHI-REPLKXPHSA-N 1 3 286.463 3.744 20 0 CHADHO CN1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccc(Cl)c(Cl)c1)C2 ZINC001169092135 1129700435 /nfs/dbraw/zinc/70/04/35/1129700435.db2.gz YFCAZPAIZJDWAN-XYYAHUGASA-N 1 3 299.245 3.708 20 0 CHADHO CC[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(C)c(C)c1 ZINC001169107139 1129703251 /nfs/dbraw/zinc/70/32/51/1129703251.db2.gz DZFNYISYLPFCJE-AKHDSKFASA-N 1 3 286.463 3.969 20 0 CHADHO CC[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(C)c(C)c1 ZINC001169107139 1129703253 /nfs/dbraw/zinc/70/32/53/1129703253.db2.gz DZFNYISYLPFCJE-AKHDSKFASA-N 1 3 286.463 3.969 20 0 CHADHO CC[NH+]1CCC(N[C@H](CC(C)C)c2cccc(F)c2)CC1 ZINC001169230063 1129710673 /nfs/dbraw/zinc/71/06/73/1129710673.db2.gz MSYAIYXONUNJKU-GOSISDBHSA-N 1 3 292.442 3.987 20 0 CHADHO CCCC[C@@H]1C[C@H]([NH2+]C(CCC)CCC)CCN1 ZINC001246196464 1131392486 /nfs/dbraw/zinc/39/24/86/1131392486.db2.gz FYUMBHLYBXIYKI-HZPDHXFCSA-N 1 3 254.462 3.856 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCCC(C)(C)CC1)CN1CCCC1 ZINC000086908809 1129829434 /nfs/dbraw/zinc/82/94/34/1129829434.db2.gz AMTYPBMZGRBXBC-CVEARBPZSA-N 1 3 266.473 3.667 20 0 CHADHO CCCCCC1CCC([NH2+][C@H]2CCNC[C@@H]2C)CC1 ZINC001246211235 1131400823 /nfs/dbraw/zinc/40/08/23/1131400823.db2.gz QDHSTUFRWVWEFV-OTBWCIGPSA-N 1 3 266.473 3.713 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N1CCCC(F)(F)[C@@H](F)C1 ZINC001258908250 1129845887 /nfs/dbraw/zinc/84/58/87/1129845887.db2.gz UANVWSBSUSGFOG-KGLIPLIRSA-N 1 3 294.405 3.566 20 0 CHADHO C[C@@H]1CC[C@H]1[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000381983702 1129853794 /nfs/dbraw/zinc/85/37/94/1129853794.db2.gz NNJBOAXRXVCXEJ-BHIYHBOVSA-N 1 3 286.463 3.677 20 0 CHADHO C[C@@H](NCCCCCCC[NH+]1CCCC1)c1nccs1 ZINC000772449890 1130022983 /nfs/dbraw/zinc/02/29/83/1130022983.db2.gz YASKXIKLFNLAIX-OAHLLOKOSA-N 1 3 295.496 3.840 20 0 CHADHO CCC(CC)N1CCC([NH2+]C2CCC(F)(F)CC2)CC1 ZINC001254214090 1130229202 /nfs/dbraw/zinc/22/92/02/1130229202.db2.gz XZTDMUSUUHHNOJ-UHFFFAOYSA-N 1 3 288.426 3.807 20 0 CHADHO C[C@H]1CC[C@@H]([NH2+]C2CCN(CC3CCCCC3)CC2)C1 ZINC001170112324 1130263949 /nfs/dbraw/zinc/26/39/49/1130263949.db2.gz JBOXTHIIWFMBJV-MAUKXSAKSA-N 1 3 278.484 3.809 20 0 CHADHO c1ccc2c(c1)cccc2C[N@@H+]1CCCC12CCNCC2 ZINC001235141733 1130714586 /nfs/dbraw/zinc/71/45/86/1130714586.db2.gz XHVLIJLIKOGDJQ-UHFFFAOYSA-N 1 3 280.415 3.558 20 0 CHADHO c1ccc2c(c1)cccc2C[N@H+]1CCCC12CCNCC2 ZINC001235141733 1130714588 /nfs/dbraw/zinc/71/45/88/1130714588.db2.gz XHVLIJLIKOGDJQ-UHFFFAOYSA-N 1 3 280.415 3.558 20 0 CHADHO CC(C)(C)c1ccc(C[N@@H+]2CCCC23CCNCC3)cc1 ZINC001235139817 1130715031 /nfs/dbraw/zinc/71/50/31/1130715031.db2.gz DIXCNKSKRPKYGM-UHFFFAOYSA-N 1 3 286.463 3.702 20 0 CHADHO CC(C)(C)c1ccc(C[N@H+]2CCCC23CCNCC3)cc1 ZINC001235139817 1130715033 /nfs/dbraw/zinc/71/50/33/1130715033.db2.gz DIXCNKSKRPKYGM-UHFFFAOYSA-N 1 3 286.463 3.702 20 0 CHADHO Cc1c(C[N@@H+]2CC[C@H]3C[C@@]3(N)C2)cccc1-c1ccccc1 ZINC001235173648 1130717962 /nfs/dbraw/zinc/71/79/62/1130717962.db2.gz KZTWQIKGEVNXAB-AZUAARDMSA-N 1 3 292.426 3.585 20 0 CHADHO Cc1c(C[N@H+]2CC[C@H]3C[C@@]3(N)C2)cccc1-c1ccccc1 ZINC001235173648 1130717964 /nfs/dbraw/zinc/71/79/64/1130717964.db2.gz KZTWQIKGEVNXAB-AZUAARDMSA-N 1 3 292.426 3.585 20 0 CHADHO c1oc2ccccc2c1CN1CCCCC12CC[NH2+]CC2 ZINC001235189391 1130720875 /nfs/dbraw/zinc/72/08/75/1130720875.db2.gz KJJDDRXRVABBDN-UHFFFAOYSA-N 1 3 284.403 3.541 20 0 CHADHO c1oc2ccccc2c1C[N@@H+]1CCCCC12CCNCC2 ZINC001235189391 1130720878 /nfs/dbraw/zinc/72/08/78/1130720878.db2.gz KJJDDRXRVABBDN-UHFFFAOYSA-N 1 3 284.403 3.541 20 0 CHADHO c1oc2ccccc2c1C[N@H+]1CCCCC12CCNCC2 ZINC001235189391 1130720884 /nfs/dbraw/zinc/72/08/84/1130720884.db2.gz KJJDDRXRVABBDN-UHFFFAOYSA-N 1 3 284.403 3.541 20 0 CHADHO CCc1cccc(C)c1C[N@@H+]1CCCCC12CCNCC2 ZINC001235192107 1130722385 /nfs/dbraw/zinc/72/23/85/1130722385.db2.gz WRBQJBSQZDNTGU-UHFFFAOYSA-N 1 3 286.463 3.666 20 0 CHADHO CCc1cccc(C)c1C[N@H+]1CCCCC12CCNCC2 ZINC001235192107 1130722388 /nfs/dbraw/zinc/72/23/88/1130722388.db2.gz WRBQJBSQZDNTGU-UHFFFAOYSA-N 1 3 286.463 3.666 20 0 CHADHO CC/C=C\CCCN1CC[C@@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001235350219 1130736286 /nfs/dbraw/zinc/73/62/86/1130736286.db2.gz WUZMBQIBENPBAU-JGAFRWBPSA-N 1 3 298.474 3.812 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CC[C@]2(C1)CNCC[C@H]2F ZINC001235410508 1130740907 /nfs/dbraw/zinc/74/09/07/1130740907.db2.gz YILLZPCZUDEQSC-RCCFBDPRSA-N 1 3 296.474 3.783 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CC[C@]2(C1)CNCC[C@H]2F ZINC001235410508 1130740911 /nfs/dbraw/zinc/74/09/11/1130740911.db2.gz YILLZPCZUDEQSC-RCCFBDPRSA-N 1 3 296.474 3.783 20 0 CHADHO Clc1cc(CN2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)cs1 ZINC001235426749 1130742634 /nfs/dbraw/zinc/74/26/34/1130742634.db2.gz LCYSCFOWQQHUJU-KGLIPLIRSA-N 1 3 298.883 3.613 20 0 CHADHO CN(CCC[NH3+])Cc1ccccc1-c1ccccc1Cl ZINC001235435321 1130744303 /nfs/dbraw/zinc/74/43/03/1130744303.db2.gz JFDTYJLCGJKJQK-UHFFFAOYSA-N 1 3 288.822 3.788 20 0 CHADHO Cc1ccc(-c2ccc(CN3CCC[C@@H](C[NH3+])C3)cc2)cc1 ZINC001235675160 1130766188 /nfs/dbraw/zinc/76/61/88/1130766188.db2.gz JYUYGZXFAIMQRE-SFHVURJKSA-N 1 3 294.442 3.833 20 0 CHADHO Fc1cccc([C@@H]2CCCN2Cc2ccc3c(c2)C[NH2+]C3)c1 ZINC001235715916 1130771517 /nfs/dbraw/zinc/77/15/17/1130771517.db2.gz XUEZJPIPJTVBJF-IBGZPJMESA-N 1 3 296.389 3.766 20 0 CHADHO CCCCCCc1csc(CN2CC[C@H](C[NH3+])C2)c1 ZINC001235751395 1130776457 /nfs/dbraw/zinc/77/64/57/1130776457.db2.gz XWOAETFVYKPIRL-OAHLLOKOSA-N 1 3 280.481 3.652 20 0 CHADHO Cc1cc(Oc2ccccc2)ccc1CN1CC[C@@H](C[NH3+])C1 ZINC001235750656 1130777484 /nfs/dbraw/zinc/77/74/84/1130777484.db2.gz REKVHTTZIMEMMD-INIZCTEOSA-N 1 3 296.414 3.568 20 0 CHADHO CC[N@H+](CC1(c2ccccc2)CCCC1)C1CCNCC1 ZINC001235759987 1130777497 /nfs/dbraw/zinc/77/74/97/1130777497.db2.gz LMLKNYSNYXSPPI-UHFFFAOYSA-N 1 3 286.463 3.572 20 0 CHADHO CC[N@@H+](CC1(c2ccccc2)CCCC1)C1CCNCC1 ZINC001235759987 1130777500 /nfs/dbraw/zinc/77/75/00/1130777500.db2.gz LMLKNYSNYXSPPI-UHFFFAOYSA-N 1 3 286.463 3.572 20 0 CHADHO CN(Cc1cccc2c3ccccc3oc21)C[C@H]1CC[NH2+]C1 ZINC001235841434 1130786997 /nfs/dbraw/zinc/78/69/97/1130786997.db2.gz FUNFWGRGEZDREZ-AWEZNQCLSA-N 1 3 294.398 3.627 20 0 CHADHO Cc1ccccc1-c1ccccc1CN(C)C[C@@H]1CC[NH2+]C1 ZINC001235842166 1130787786 /nfs/dbraw/zinc/78/77/86/1130787786.db2.gz MFBVTKKUCJPGOP-QGZVFWFLSA-N 1 3 294.442 3.703 20 0 CHADHO Cc1csc2sc(CN3CCC[C@H]3CC[NH3+])c(C)c12 ZINC001235925879 1130805637 /nfs/dbraw/zinc/80/56/37/1130805637.db2.gz QLVDPWVZQDERCS-LBPRGKRZSA-N 1 3 294.489 3.893 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)C[N@@H+]2CCC[C@H]2CCN)cc1 ZINC001235925603 1130805671 /nfs/dbraw/zinc/80/56/71/1130805671.db2.gz XALPTXCISMRJLL-APWZRJJASA-N 1 3 288.479 3.802 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCC[C@H]2CCN)cc1 ZINC001235925603 1130805678 /nfs/dbraw/zinc/80/56/78/1130805678.db2.gz XALPTXCISMRJLL-APWZRJJASA-N 1 3 288.479 3.802 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+](C)C[C@@H]1CCCNC1 ZINC001235951960 1130814521 /nfs/dbraw/zinc/81/45/21/1130814521.db2.gz WKLDPZZMYCQVHB-DLBZAZTESA-N 1 3 266.473 3.690 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+](C)C[C@@H]1CCCNC1 ZINC001235951960 1130814525 /nfs/dbraw/zinc/81/45/25/1130814525.db2.gz WKLDPZZMYCQVHB-DLBZAZTESA-N 1 3 266.473 3.690 20 0 CHADHO Cc1c(Cl)ccc(CN2CC3(C2)CCC[NH2+]CC3)c1C ZINC001236007632 1130832414 /nfs/dbraw/zinc/83/24/14/1130832414.db2.gz XYZTWZZNNLSPEM-UHFFFAOYSA-N 1 3 292.854 3.532 20 0 CHADHO CC(C)=CCCC1=CC[C@H](CN2C[C@@H](C)[C@@H]([NH3+])C2)CC1 ZINC001236094104 1130857292 /nfs/dbraw/zinc/85/72/92/1130857292.db2.gz NSZMWWQBSUMOJK-NJAFHUGGSA-N 1 3 276.468 3.738 20 0 CHADHO [NH3+]CCCCCCN1CCC[C@H]1c1c(F)cccc1F ZINC001236189285 1130881009 /nfs/dbraw/zinc/88/10/09/1130881009.db2.gz KRSAQUYJQAEJDK-HNNXBMFYSA-N 1 3 282.378 3.621 20 0 CHADHO CCCN(Cc1ccc(Cl)c(CC)c1)C1CC[NH2+]CC1 ZINC001236185163 1130881945 /nfs/dbraw/zinc/88/19/45/1130881945.db2.gz YSLWJDFKOUAUHU-UHFFFAOYSA-N 1 3 294.870 3.866 20 0 CHADHO CCC[N@H+](Cc1ccc(Cl)c(CC)c1)C1CCNCC1 ZINC001236185163 1130881950 /nfs/dbraw/zinc/88/19/50/1130881950.db2.gz YSLWJDFKOUAUHU-UHFFFAOYSA-N 1 3 294.870 3.866 20 0 CHADHO CCC[N@@H+](Cc1ccc(Cl)c(CC)c1)C1CCNCC1 ZINC001236185163 1130881953 /nfs/dbraw/zinc/88/19/53/1130881953.db2.gz YSLWJDFKOUAUHU-UHFFFAOYSA-N 1 3 294.870 3.866 20 0 CHADHO C[N@H+](Cc1cccc2sccc21)[C@@H]1CCCC[C@H]1N ZINC001236214546 1130891296 /nfs/dbraw/zinc/89/12/96/1130891296.db2.gz FSPQWLVATJOUPH-HUUCEWRRSA-N 1 3 274.433 3.603 20 0 CHADHO C[N@@H+](Cc1cccc2sccc21)[C@@H]1CCCC[C@H]1N ZINC001236214546 1130891299 /nfs/dbraw/zinc/89/12/99/1130891299.db2.gz FSPQWLVATJOUPH-HUUCEWRRSA-N 1 3 274.433 3.603 20 0 CHADHO C1=CC[C@@H](C[N@@H+](C[C@@H]2CCCNC2)C2CCCC2)CC1 ZINC001236371702 1130922118 /nfs/dbraw/zinc/92/21/18/1130922118.db2.gz MEZFNZYRMSBYRR-IAGOWNOFSA-N 1 3 276.468 3.587 20 0 CHADHO C1=CC[C@@H](C[N@H+](C[C@@H]2CCCNC2)C2CCCC2)CC1 ZINC001236371702 1130922120 /nfs/dbraw/zinc/92/21/20/1130922120.db2.gz MEZFNZYRMSBYRR-IAGOWNOFSA-N 1 3 276.468 3.587 20 0 CHADHO Cc1cccc(C[N@H+](C[C@H]2CCCNC2)C2CCCC2)c1 ZINC001236372169 1130922451 /nfs/dbraw/zinc/92/24/51/1130922451.db2.gz BBRFOUXGUOLXMV-SFHVURJKSA-N 1 3 286.463 3.739 20 0 CHADHO Cc1cccc(C[N@@H+](C[C@H]2CCCNC2)C2CCCC2)c1 ZINC001236372169 1130922456 /nfs/dbraw/zinc/92/24/56/1130922456.db2.gz BBRFOUXGUOLXMV-SFHVURJKSA-N 1 3 286.463 3.739 20 0 CHADHO Cc1cc(CN(C[C@@H]2CCC[NH2+]C2)C2CCCC2)cs1 ZINC001236376778 1130923681 /nfs/dbraw/zinc/92/36/81/1130923681.db2.gz VKAKZBDNXOWDSM-OAHLLOKOSA-N 1 3 292.492 3.801 20 0 CHADHO CCN(Cc1sc2ccccc2c1C)C[C@@H]1CC[NH2+]C1 ZINC001236409836 1130931839 /nfs/dbraw/zinc/93/18/39/1130931839.db2.gz XMSIPORPSQHNBV-CQSZACIVSA-N 1 3 288.460 3.641 20 0 CHADHO C[C@@H]1[C@H](N)CCC[N@@H+]1Cc1ccccc1-c1ccccc1 ZINC001236422469 1130937373 /nfs/dbraw/zinc/93/73/73/1130937373.db2.gz WOIPWIVIHYAPOF-DNVCBOLYSA-N 1 3 280.415 3.665 20 0 CHADHO C[C@@H]1[C@H](N)CCC[N@H+]1Cc1ccccc1-c1ccccc1 ZINC001236422469 1130937376 /nfs/dbraw/zinc/93/73/76/1130937376.db2.gz WOIPWIVIHYAPOF-DNVCBOLYSA-N 1 3 280.415 3.665 20 0 CHADHO Cc1cc(C)cc([C@@H]2CCCN2CC[C@@H]2CCCC[NH2+]2)c1 ZINC001236428893 1130939955 /nfs/dbraw/zinc/93/99/55/1130939955.db2.gz QCPKVTFUDZXOAK-OALUTQOASA-N 1 3 286.463 3.973 20 0 CHADHO c1ccc(CN(CC[C@@H]2CCCC[NH2+]2)C2CCC2)cc1 ZINC001236439936 1130942470 /nfs/dbraw/zinc/94/24/70/1130942470.db2.gz CHHGUQVEGDHYPF-KRWDZBQOSA-N 1 3 272.436 3.573 20 0 CHADHO CCCCCN(Cc1cc(F)ccc1C)C1CC[NH2+]CC1 ZINC001236509185 1130959649 /nfs/dbraw/zinc/95/96/49/1130959649.db2.gz JCHDYKXXAIQLCJ-UHFFFAOYSA-N 1 3 292.442 3.878 20 0 CHADHO CC[C@H](C)C[N@H+](Cc1ccc(F)cc1C)C1CCNCC1 ZINC001236518060 1130961589 /nfs/dbraw/zinc/96/15/89/1130961589.db2.gz OTTIGCXKAVFUKF-AWEZNQCLSA-N 1 3 292.442 3.734 20 0 CHADHO CC[C@H](C)C[N@@H+](Cc1ccc(F)cc1C)C1CCNCC1 ZINC001236518060 1130961594 /nfs/dbraw/zinc/96/15/94/1130961594.db2.gz OTTIGCXKAVFUKF-AWEZNQCLSA-N 1 3 292.442 3.734 20 0 CHADHO C[C@@]1(C[NH3+])CCN(Cc2cccc(-c3ccc(F)cc3)c2)C1 ZINC001236603685 1130981491 /nfs/dbraw/zinc/98/14/91/1130981491.db2.gz CIZCTZWLVXIBLF-IBGZPJMESA-N 1 3 298.405 3.663 20 0 CHADHO CCC(CC)[N@H+](Cc1occc1[S-])[C@H]1CC[C@H]([NH3+])CC1 ZINC001236799034 1131008044 /nfs/dbraw/zinc/00/80/44/1131008044.db2.gz PYIXQFURPIZXDM-MQMHXKEQSA-N 1 3 296.480 3.829 20 0 CHADHO CCC(CC)[N@@H+](Cc1occc1[S-])[C@H]1CC[C@H]([NH3+])CC1 ZINC001236799034 1131008049 /nfs/dbraw/zinc/00/80/49/1131008049.db2.gz PYIXQFURPIZXDM-MQMHXKEQSA-N 1 3 296.480 3.829 20 0 CHADHO C[C@@H](Cc1ccc(C(C)(C)C)cc1)CN1C[C@@H]([NH3+])C[C@H]1C ZINC001237204030 1131071374 /nfs/dbraw/zinc/07/13/74/1131071374.db2.gz PPUDILABHQPAHS-DAYGRLMNSA-N 1 3 288.479 3.584 20 0 CHADHO Cc1sccc1CN(C)Cc1ccc(C[NH+](C)C)cc1 ZINC000816610637 1131116555 /nfs/dbraw/zinc/11/65/55/1131116555.db2.gz RZJWQKSLXIHEGY-UHFFFAOYSA-N 1 3 288.460 3.750 20 0 CHADHO CN1CCCC[C@H]1CC[N@H+](C)[C@@H]1CCc2c1cccc2F ZINC001116195863 1131133369 /nfs/dbraw/zinc/13/33/69/1131133369.db2.gz QMWXUAPYRHUJPX-KBXCAEBGSA-N 1 3 290.426 3.619 20 0 CHADHO CN1CCCC[C@H]1CC[N@@H+](C)[C@@H]1CCc2c1cccc2F ZINC001116195863 1131133371 /nfs/dbraw/zinc/13/33/71/1131133371.db2.gz QMWXUAPYRHUJPX-KBXCAEBGSA-N 1 3 290.426 3.619 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+]3CCC(C)(C)C3)cc21 ZINC001237877787 1131147151 /nfs/dbraw/zinc/14/71/51/1131147151.db2.gz CSMRCPZVBGKOOZ-UHFFFAOYSA-N 1 3 284.447 3.920 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+]3CCC(C)(C)C3)cc21 ZINC001237877787 1131147153 /nfs/dbraw/zinc/14/71/53/1131147153.db2.gz CSMRCPZVBGKOOZ-UHFFFAOYSA-N 1 3 284.447 3.920 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+](C)C3CC(C)C3)cc21 ZINC001237881190 1131147303 /nfs/dbraw/zinc/14/73/03/1131147303.db2.gz NKWMDZMPSKQRHK-UHFFFAOYSA-N 1 3 284.447 3.918 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+](C)C3CC(C)C3)cc21 ZINC001237881190 1131147305 /nfs/dbraw/zinc/14/73/05/1131147305.db2.gz NKWMDZMPSKQRHK-UHFFFAOYSA-N 1 3 284.447 3.918 20 0 CHADHO CC[N@H+](Cc1ccc2c(c1)C(C(C)C)=NCC2)C1CC1 ZINC001237881460 1131148289 /nfs/dbraw/zinc/14/82/89/1131148289.db2.gz SHCWMEKEFCOVPV-UHFFFAOYSA-N 1 3 270.420 3.672 20 0 CHADHO CC[N@@H+](Cc1ccc2c(c1)C(C(C)C)=NCC2)C1CC1 ZINC001237881460 1131148292 /nfs/dbraw/zinc/14/82/92/1131148292.db2.gz SHCWMEKEFCOVPV-UHFFFAOYSA-N 1 3 270.420 3.672 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]C1CCCCCCC1 ZINC000817893989 1131186985 /nfs/dbraw/zinc/18/69/85/1131186985.db2.gz VSTZMLWTOZQLJZ-CYBMUJFWSA-N 1 3 275.440 3.612 20 0 CHADHO Cc1ccc([C@@H](NCc2ccc(CC[NH3+])cc2)C2CCC2)o1 ZINC000817947293 1131189327 /nfs/dbraw/zinc/18/93/27/1131189327.db2.gz BLOFSBAKMLZMNX-IBGZPJMESA-N 1 3 298.430 3.720 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@H](C)Cc2ccccc2Cl)C1 ZINC001117639458 1131190249 /nfs/dbraw/zinc/19/02/49/1131190249.db2.gz HTGVJGDJBWJOCD-CABCVRRESA-N 1 3 294.870 3.591 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCNC2(CCC2)C1)C1CCCCC1 ZINC000817987172 1131195618 /nfs/dbraw/zinc/19/56/18/1131195618.db2.gz XIFLMYSOMGVFGA-HOTGVXAUSA-N 1 3 264.457 3.610 20 0 CHADHO C[NH2+][C@H](C)CCN[C@@H](c1cccs1)C1CCCC1 ZINC001118121863 1131211604 /nfs/dbraw/zinc/21/16/04/1131211604.db2.gz KCMURVMZGJTQPY-IUODEOHRSA-N 1 3 266.454 3.567 20 0 CHADHO C(CC1CCCCCCC1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246235440 1131422260 /nfs/dbraw/zinc/42/22/60/1131422260.db2.gz GRLDJUJSXULNHR-BCDXTJNWSA-N 1 3 278.484 4.000 20 0 CHADHO C[C@@H](CC1CCCCC1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246316792 1131465445 /nfs/dbraw/zinc/46/54/45/1131465445.db2.gz UFSLLKFQVROVQW-QMCVQRASSA-N 1 3 264.457 3.608 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246332461 1131473623 /nfs/dbraw/zinc/47/36/23/1131473623.db2.gz MEVQNONUQLUQKQ-SMLCLMEVSA-N 1 3 266.473 3.710 20 0 CHADHO CC[C@@H](C)C1CCC([NH2+]C2C[C@@H](C)N[C@H](C)C2)CC1 ZINC001246340554 1131478978 /nfs/dbraw/zinc/47/89/78/1131478978.db2.gz VCMITRHWFDVUPE-AUVVZJRPSA-N 1 3 266.473 3.710 20 0 CHADHO CC(C)(CCN)[NH2+]C1CCC2(CCCCC2)CC1 ZINC001246361570 1131486869 /nfs/dbraw/zinc/48/68/69/1131486869.db2.gz INQCJHUBJVRCRL-UHFFFAOYSA-N 1 3 252.446 3.597 20 0 CHADHO C[C@H]1C[C@H]([NH2+]C2(CC3CCC3)CCNCC2)C[C@@H](C)C1 ZINC001246444731 1131502267 /nfs/dbraw/zinc/50/22/67/1131502267.db2.gz BFIUUWBNRWBKMW-QLPKVWCKSA-N 1 3 278.484 3.713 20 0 CHADHO CCC[C@@]1(CN[C@H](C)C[C@H](C)CC(C)C)CC[NH2+]1 ZINC001246454168 1131503584 /nfs/dbraw/zinc/50/35/84/1131503584.db2.gz ABHRLNGPZQLRTJ-OAGGEKHMSA-N 1 3 254.462 3.569 20 0 CHADHO CCCCCC[C@H](CC)[NH2+][C@H](C(C)C)C1CNC1 ZINC001246519217 1131545488 /nfs/dbraw/zinc/54/54/88/1131545488.db2.gz QYTFGLMZJQLENO-JKSUJKDBSA-N 1 3 254.462 3.569 20 0 CHADHO C[C@@H](CSc1ccc(F)cc1)N1CCC[C@@](C)([NH3+])CC1 ZINC001246550776 1131607228 /nfs/dbraw/zinc/60/72/28/1131607228.db2.gz JPRVPTHSRYTFIU-XJKSGUPXSA-N 1 3 296.455 3.510 20 0 CHADHO CCCCCC[C@H](CC)[N@@H+]1CCC[C@H](CN)[C@@H]1C ZINC001246559391 1131621271 /nfs/dbraw/zinc/62/12/71/1131621271.db2.gz ANKJRNYOQYSXHF-XHSDSOJGSA-N 1 3 254.462 3.795 20 0 CHADHO CCCCCC[C@H](CC)[N@H+]1CCC[C@H](CN)[C@@H]1C ZINC001246559391 1131621273 /nfs/dbraw/zinc/62/12/73/1131621273.db2.gz ANKJRNYOQYSXHF-XHSDSOJGSA-N 1 3 254.462 3.795 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@@H+]2CCC[C@H](C)[C@@H](C)C2)CCN1 ZINC001246577081 1131667067 /nfs/dbraw/zinc/66/70/67/1131667067.db2.gz VEKADWLTWPZCNZ-MWDXBVQZSA-N 1 3 266.473 3.665 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@H](C)[C@@H](C)C2)CCN1 ZINC001246577081 1131667068 /nfs/dbraw/zinc/66/70/68/1131667068.db2.gz VEKADWLTWPZCNZ-MWDXBVQZSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)(C)C1CCC([N@@H+]2CCCC23CCNCC3)CC1 ZINC001246652508 1131777715 /nfs/dbraw/zinc/77/77/15/1131777715.db2.gz HPFZKBZGDVLRTK-UHFFFAOYSA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)(C)C1CCC([N@H+]2CCCC23CCNCC3)CC1 ZINC001246652508 1131777723 /nfs/dbraw/zinc/77/77/23/1131777723.db2.gz HPFZKBZGDVLRTK-UHFFFAOYSA-N 1 3 278.484 3.809 20 0 CHADHO C[N@H+](CC1CCCCC1)[C@H]1CCN[C@@H](C(C)(C)C)C1 ZINC001246847279 1131788792 /nfs/dbraw/zinc/78/87/92/1131788792.db2.gz RTQHYWRZLVJFLT-JKSUJKDBSA-N 1 3 266.473 3.665 20 0 CHADHO C[N@@H+](CC1CCCCC1)[C@H]1CCN[C@@H](C(C)(C)C)C1 ZINC001246847279 1131788796 /nfs/dbraw/zinc/78/87/96/1131788796.db2.gz RTQHYWRZLVJFLT-JKSUJKDBSA-N 1 3 266.473 3.665 20 0 CHADHO Cc1nc([C@@H](C)NC2CCC(C)([NH+](C)C)CC2)c(C)s1 ZINC000715581400 1131985657 /nfs/dbraw/zinc/98/56/57/1131985657.db2.gz SBDDYCUKGQFGHE-OLQXHTCTSA-N 1 3 295.496 3.673 20 0 CHADHO C1=C(C[NH2+][C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)CCC1 ZINC000716639561 1132028823 /nfs/dbraw/zinc/02/88/23/1132028823.db2.gz TZWBSRLMPSBRIL-ZCNNSNEGSA-N 1 3 296.458 3.739 20 0 CHADHO C[C@@H]([NH2+]C1CC(C)(C)N(C)C(C)(C)C1)c1ccccc1 ZINC001171619874 1132064846 /nfs/dbraw/zinc/06/48/46/1132064846.db2.gz UATUNPBXTPSZHC-CQSZACIVSA-N 1 3 274.452 3.989 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1Cc3cccc(Cl)c3C1)C2 ZINC001172127971 1132127334 /nfs/dbraw/zinc/12/73/34/1132127334.db2.gz MKSSUFKQJVUMFJ-QDMKHBRRSA-N 1 3 290.838 3.671 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1Cc3cccc(Cl)c3C1)C2 ZINC001172127971 1132127336 /nfs/dbraw/zinc/12/73/36/1132127336.db2.gz MKSSUFKQJVUMFJ-QDMKHBRRSA-N 1 3 290.838 3.671 20 0 CHADHO Cc1ccc([C@H](C)N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1F ZINC001172111838 1132134307 /nfs/dbraw/zinc/13/43/07/1132134307.db2.gz WUIQQAHVDAWJOL-QSPRXWTASA-N 1 3 290.426 3.800 20 0 CHADHO Cc1ccc([C@H](C)N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1F ZINC001172111838 1132134312 /nfs/dbraw/zinc/13/43/12/1132134312.db2.gz WUIQQAHVDAWJOL-QSPRXWTASA-N 1 3 290.426 3.800 20 0 CHADHO CC(C)c1ccccc1CNC1CC[NH+](C2CC2)CC1 ZINC000839029578 1132169193 /nfs/dbraw/zinc/16/91/93/1132169193.db2.gz HCLRJKMESGKSCU-UHFFFAOYSA-N 1 3 272.436 3.526 20 0 CHADHO CC[C@H](C)OCC[C@H](C)[NH2+]C1CCN(C2CCCC2)CC1 ZINC001172343744 1132178216 /nfs/dbraw/zinc/17/82/16/1132178216.db2.gz RKCLJFXNPNJLNX-HOTGVXAUSA-N 1 3 296.499 3.577 20 0 CHADHO CC[C@H](CC(C)C)[NH+]1CCC(C)(N2CCCC2)CC1 ZINC001172405146 1132197384 /nfs/dbraw/zinc/19/73/84/1132197384.db2.gz SQKAEZFHHZIDDS-MRXNPFEDSA-N 1 3 266.473 3.761 20 0 CHADHO c1c2cnccc2[nH]c1C[N@@H+]1CC[C@H](Cc2ccccc2)C1 ZINC001232013893 1132411622 /nfs/dbraw/zinc/41/16/22/1132411622.db2.gz HQQNNUWPLHIIIO-MRXNPFEDSA-N 1 3 291.398 3.628 20 0 CHADHO c1c2cnccc2[nH]c1C[N@H+]1CC[C@H](Cc2ccccc2)C1 ZINC001232013893 1132411627 /nfs/dbraw/zinc/41/16/27/1132411627.db2.gz HQQNNUWPLHIIIO-MRXNPFEDSA-N 1 3 291.398 3.628 20 0 CHADHO C[C@H]1CCCC[N@H+](Cc2cc(F)cc(CN(C)C)c2)C1 ZINC001232143885 1132428317 /nfs/dbraw/zinc/42/83/17/1132428317.db2.gz DJYOXTGIFLMSTE-AWEZNQCLSA-N 1 3 278.415 3.509 20 0 CHADHO C[C@H]1CCCC[N@@H+](Cc2cc(F)cc(CN(C)C)c2)C1 ZINC001232143885 1132428322 /nfs/dbraw/zinc/42/83/22/1132428322.db2.gz DJYOXTGIFLMSTE-AWEZNQCLSA-N 1 3 278.415 3.509 20 0 CHADHO CC[C@H]1CC[C@H]([NH2+]C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001173269314 1132433790 /nfs/dbraw/zinc/43/37/90/1132433790.db2.gz VLXXAQATXVSOLS-KBPBESRZSA-N 1 3 266.473 3.806 20 0 CHADHO CC[C@@H]1CC[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC001173271664 1132436548 /nfs/dbraw/zinc/43/65/48/1132436548.db2.gz HONVTVWWCXQGQW-NVXWUHKLSA-N 1 3 278.484 3.952 20 0 CHADHO CC[C@@H]1CC[C@@H]([NH2+]C2CCN(C[C@@H]3CC=CCC3)CC2)C1 ZINC001173275162 1132438921 /nfs/dbraw/zinc/43/89/21/1132438921.db2.gz LMQAUAPBHWUGLH-ZHALLVOQSA-N 1 3 290.495 3.975 20 0 CHADHO CCSC[C@H](C)[NH2+]C1CCN(CC2CCCCC2)CC1 ZINC001173299476 1132446572 /nfs/dbraw/zinc/44/65/72/1132446572.db2.gz RTBRGUWBLUDJSU-HNNXBMFYSA-N 1 3 298.540 3.762 20 0 CHADHO CCSC[C@H](C)NC1CC[NH+](CC2CCCCC2)CC1 ZINC001173299476 1132446573 /nfs/dbraw/zinc/44/65/73/1132446573.db2.gz RTBRGUWBLUDJSU-HNNXBMFYSA-N 1 3 298.540 3.762 20 0 CHADHO CC[C@@H]1CC[C@@H](N2CCC(C)([NH+]3CCCC3)CC2)C1 ZINC001173281662 1132455055 /nfs/dbraw/zinc/45/50/55/1132455055.db2.gz ATQPGSNQCHZYNM-HZPDHXFCSA-N 1 3 264.457 3.515 20 0 CHADHO c1cc2c(c(Nc3ccnc(C4CCC4)c3)c1)CC[NH2+]C2 ZINC001159363960 1132832449 /nfs/dbraw/zinc/83/24/49/1132832449.db2.gz FXKYVYVOPITGGR-UHFFFAOYSA-N 1 3 279.387 3.738 20 0 CHADHO Cc1cnccc1Nc1ccccc1C[NH+]1CCCCC1 ZINC001174539995 1132900238 /nfs/dbraw/zinc/90/02/38/1132900238.db2.gz RKEXWFJSSZVMCB-UHFFFAOYSA-N 1 3 281.403 3.541 20 0 CHADHO CC(C)(C)c1cc(Nc2ccccc2CC[NH3+])ccn1 ZINC001159997993 1132933627 /nfs/dbraw/zinc/93/36/27/1132933627.db2.gz RBSPGRNWOKUKKE-UHFFFAOYSA-N 1 3 269.392 3.624 20 0 CHADHO CN1CC2(C1)CC[NH+](Cc1ccc(C(C)(C)C)cc1)CC2 ZINC001204398544 1133256347 /nfs/dbraw/zinc/25/63/47/1133256347.db2.gz IBJBPFRAEJJKJX-UHFFFAOYSA-N 1 3 286.463 3.512 20 0 CHADHO C[NH+]1CCC2(CN(Cc3ccc(C(C)(C)C)cc3)C2)CC1 ZINC001204399987 1133442332 /nfs/dbraw/zinc/44/23/32/1133442332.db2.gz YJOYJUHECDNAAR-UHFFFAOYSA-N 1 3 286.463 3.512 20 0 CHADHO NC[C@H]1CCCC[N@@H+]1Cc1cccc(-c2ccc(F)cc2)c1 ZINC001204925221 1133501233 /nfs/dbraw/zinc/50/12/33/1133501233.db2.gz NNUBKGAROYVASU-LJQANCHMSA-N 1 3 298.405 3.806 20 0 CHADHO NC[C@H]1CCCC[N@H+]1Cc1cccc(-c2ccc(F)cc2)c1 ZINC001204925221 1133501237 /nfs/dbraw/zinc/50/12/37/1133501237.db2.gz NNUBKGAROYVASU-LJQANCHMSA-N 1 3 298.405 3.806 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)C[N@@H+]2CCC[C@H](N)CC2)cc1 ZINC001205093894 1133527588 /nfs/dbraw/zinc/52/75/88/1133527588.db2.gz HMVDFYCDBRKKCC-APWZRJJASA-N 1 3 288.479 3.802 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCC[C@H](N)CC2)cc1 ZINC001205093894 1133527593 /nfs/dbraw/zinc/52/75/93/1133527593.db2.gz HMVDFYCDBRKKCC-APWZRJJASA-N 1 3 288.479 3.802 20 0 CHADHO CN1CCC2(CCC[N@@H+]2C[C@@]2(C)C[C@@H]2c2ccccc2)CC1 ZINC001205411850 1133574597 /nfs/dbraw/zinc/57/45/97/1133574597.db2.gz QJDGDCYUANAHJF-RTBURBONSA-N 1 3 298.474 3.740 20 0 CHADHO CN1CCC2(CCC[N@H+]2C[C@@]2(C)C[C@@H]2c2ccccc2)CC1 ZINC001205411850 1133574602 /nfs/dbraw/zinc/57/46/02/1133574602.db2.gz QJDGDCYUANAHJF-RTBURBONSA-N 1 3 298.474 3.740 20 0 CHADHO CC[C@H](C)[C@@H](CNC(C)(C)CC[NH+]1CCCCCC1)OC ZINC001205470622 1133579962 /nfs/dbraw/zinc/57/99/62/1133579962.db2.gz AYVKASDWAGAVSL-DLBZAZTESA-N 1 3 298.515 3.682 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@@H+]1CCC[C@@H](CN)[C@H]1C ZINC001205902992 1133628549 /nfs/dbraw/zinc/62/85/49/1133628549.db2.gz MHQRCIYDFDGVNN-BBWFWOEESA-N 1 3 298.515 3.667 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@H+]1CCC[C@@H](CN)[C@H]1C ZINC001205902992 1133628552 /nfs/dbraw/zinc/62/85/52/1133628552.db2.gz MHQRCIYDFDGVNN-BBWFWOEESA-N 1 3 298.515 3.667 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CCC[C@@H](CN)[C@H]1C ZINC001205902589 1133628980 /nfs/dbraw/zinc/62/89/80/1133628980.db2.gz KSIXHALIWPXQDF-UIZHIOIMSA-N 1 3 266.473 3.962 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CCC[C@@H](CN)[C@H]1C ZINC001205902589 1133628984 /nfs/dbraw/zinc/62/89/84/1133628984.db2.gz KSIXHALIWPXQDF-UIZHIOIMSA-N 1 3 266.473 3.962 20 0 CHADHO C[C@]1(C[NH3+])CCCCN(Cc2ccc(C(F)F)cc2)C1 ZINC001206554567 1133717274 /nfs/dbraw/zinc/71/72/74/1133717274.db2.gz FNVFQSHIHNMCIL-MRXNPFEDSA-N 1 3 282.378 3.575 20 0 CHADHO Cc1c2ccccc2[nH]c1CN(C(C)C)[C@H]1CCC[NH2+]CC1 ZINC001206591651 1133724209 /nfs/dbraw/zinc/72/42/09/1133724209.db2.gz URWOMQBCWFZACM-INIZCTEOSA-N 1 3 299.462 3.829 20 0 CHADHO Cc1ccc(C[N@@H+]2CCCC[C@@H](CN)C2)c2ccccc12 ZINC001206616062 1133728196 /nfs/dbraw/zinc/72/81/96/1133728196.db2.gz NBLREORSZCOOJZ-INIZCTEOSA-N 1 3 282.431 3.709 20 0 CHADHO Cc1ccc(C[N@H+]2CCCC[C@@H](CN)C2)c2ccccc12 ZINC001206616062 1133728200 /nfs/dbraw/zinc/72/82/00/1133728200.db2.gz NBLREORSZCOOJZ-INIZCTEOSA-N 1 3 282.431 3.709 20 0 CHADHO CN(C)CC(C)(C)C[N@@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC001207282874 1133787941 /nfs/dbraw/zinc/78/79/41/1133787941.db2.gz QHHRFEHKTWLBKH-HNNXBMFYSA-N 1 3 294.870 3.717 20 0 CHADHO CN(C)CC(C)(C)C[N@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC001207282874 1133787946 /nfs/dbraw/zinc/78/79/46/1133787946.db2.gz QHHRFEHKTWLBKH-HNNXBMFYSA-N 1 3 294.870 3.717 20 0 CHADHO CCN(CC)CC[C@@H](C)[NH2+][C@@H](C)CC1CCCC1 ZINC001207858539 1133854308 /nfs/dbraw/zinc/85/43/08/1133854308.db2.gz UDPAKOOZYURBOH-CABCVRRESA-N 1 3 254.462 3.665 20 0 CHADHO CC1=C[C@H](C)[C@H](C[NH+]2CCC(N(C)C3CC3)CC2)CC1 ZINC001208181396 1133900355 /nfs/dbraw/zinc/90/03/55/1133900355.db2.gz MBOPKHIVPSUOPX-HOTGVXAUSA-N 1 3 276.468 3.537 20 0 CHADHO CC1(CN2CCC([NH+]3CCC(F)CC3)CC2)CCCCC1 ZINC001208899609 1133960639 /nfs/dbraw/zinc/96/06/39/1133960639.db2.gz NQKSQZAXPFIXBJ-UHFFFAOYSA-N 1 3 296.474 3.855 20 0 CHADHO CCCN(CCC[NH+](C)C)Cc1c[nH]c2ccc(C)cc12 ZINC001209499458 1134031008 /nfs/dbraw/zinc/03/10/08/1134031008.db2.gz MCAWDWCRUYXINF-UHFFFAOYSA-N 1 3 287.451 3.640 20 0 CHADHO C[C@@H]1CC[N@H+](Cc2ccccc2-c2ccccc2)CCN1 ZINC001210496124 1134228970 /nfs/dbraw/zinc/22/89/70/1134228970.db2.gz DNMQBLZKUMYDIM-MRXNPFEDSA-N 1 3 280.415 3.537 20 0 CHADHO C[C@@H]1CC[N@@H+](Cc2ccccc2-c2ccccc2)CCN1 ZINC001210496124 1134228976 /nfs/dbraw/zinc/22/89/76/1134228976.db2.gz DNMQBLZKUMYDIM-MRXNPFEDSA-N 1 3 280.415 3.537 20 0 CHADHO C[NH2+]Cc1cccc(Nc2ccnc(C(C)(C)C)c2)c1 ZINC001211137614 1134379525 /nfs/dbraw/zinc/37/95/25/1134379525.db2.gz GVGLLLWUBBJYHI-UHFFFAOYSA-N 1 3 269.392 3.842 20 0 CHADHO C(CC1CCCCC1)C[N@@H+]1CCC[C@@]12CCCNC2 ZINC001222231097 1135209775 /nfs/dbraw/zinc/20/97/75/1135209775.db2.gz JAYXHEXXQAYGQB-QGZVFWFLSA-N 1 3 264.457 3.565 20 0 CHADHO C(CC1CCCCC1)C[N@H+]1CCC[C@@]12CCCNC2 ZINC001222231097 1135209779 /nfs/dbraw/zinc/20/97/79/1135209779.db2.gz JAYXHEXXQAYGQB-QGZVFWFLSA-N 1 3 264.457 3.565 20 0 CHADHO Cc1ccc2ccccc2c1C[N@@H+]1CCC[C@]12CCCNC2 ZINC001222247337 1135214305 /nfs/dbraw/zinc/21/43/05/1135214305.db2.gz DBZPMVUUPRTLQF-FQEVSTJZSA-N 1 3 294.442 3.866 20 0 CHADHO Cc1ccc2ccccc2c1C[N@H+]1CCC[C@]12CCCNC2 ZINC001222247337 1135214308 /nfs/dbraw/zinc/21/43/08/1135214308.db2.gz DBZPMVUUPRTLQF-FQEVSTJZSA-N 1 3 294.442 3.866 20 0 CHADHO C(C[NH2+]C1CCCCC1)CN1CCCC2(CCCC2)C1 ZINC001222400915 1135236831 /nfs/dbraw/zinc/23/68/31/1135236831.db2.gz NJVOFXIHMGKDOL-UHFFFAOYSA-N 1 3 278.484 3.955 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@@H+]1CC[C@]2(C1)CCCCN2 ZINC001222421724 1135239817 /nfs/dbraw/zinc/23/98/17/1135239817.db2.gz OYTLDTBPVZUVCA-SJORKVTESA-N 1 3 264.457 3.587 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@H+]1CC[C@]2(C1)CCCCN2 ZINC001222421724 1135239821 /nfs/dbraw/zinc/23/98/21/1135239821.db2.gz OYTLDTBPVZUVCA-SJORKVTESA-N 1 3 264.457 3.587 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@@H+]1CC[C@@]2(C1)CCCCN2 ZINC001222421721 1135239645 /nfs/dbraw/zinc/23/96/45/1135239645.db2.gz OYTLDTBPVZUVCA-IAGOWNOFSA-N 1 3 264.457 3.587 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@H+]1CC[C@@]2(C1)CCCCN2 ZINC001222421721 1135239650 /nfs/dbraw/zinc/23/96/50/1135239650.db2.gz OYTLDTBPVZUVCA-IAGOWNOFSA-N 1 3 264.457 3.587 20 0 CHADHO c1cc(-c2cccc(CN3CC[C@H]4C[NH2+]CC[C@H]43)c2)cs1 ZINC001222620069 1135256050 /nfs/dbraw/zinc/25/60/50/1135256050.db2.gz FJYTXZRSCQDPGR-FUHWJXTLSA-N 1 3 298.455 3.599 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@H](C)Cc1ccc(Cl)cc1 ZINC000223025715 260259289 /nfs/dbraw/zinc/25/92/89/260259289.db2.gz FWXZUNJTZIEPPI-CQSZACIVSA-N 1 3 282.859 3.591 20 0 CHADHO CC(C)[N@@H+](C)CCCN[C@H](C)Cc1ccc(Cl)cc1 ZINC000223025715 260259290 /nfs/dbraw/zinc/25/92/90/260259290.db2.gz FWXZUNJTZIEPPI-CQSZACIVSA-N 1 3 282.859 3.591 20 0 CHADHO CC(C)[N@H+](C)CCCN[C@H](C)Cc1ccc(Cl)cc1 ZINC000223025715 260259291 /nfs/dbraw/zinc/25/92/91/260259291.db2.gz FWXZUNJTZIEPPI-CQSZACIVSA-N 1 3 282.859 3.591 20 0 CHADHO CSc1ccc(CN2CCC(CC[NH+](C)C)CC2)s1 ZINC000574245624 335003735 /nfs/dbraw/zinc/00/37/35/335003735.db2.gz BGCXNJVMEXCXFZ-UHFFFAOYSA-N 1 3 298.521 3.634 20 0 CHADHO CCCC[C@H](C)[C@H](C)[NH2+]C[C@H]1CCN(CCC)C1 ZINC000574601029 335032543 /nfs/dbraw/zinc/03/25/43/335032543.db2.gz QIKFRSWDGWUANX-HRCADAONSA-N 1 3 254.462 3.523 20 0 CHADHO C[C@@H]([NH2+]CC(C)(C)CN(C)C)c1ccc(F)c(Cl)c1 ZINC000020078414 262227371 /nfs/dbraw/zinc/22/73/71/262227371.db2.gz VCRJGXBISLDSKF-LLVKDONJSA-N 1 3 286.822 3.718 20 0 CHADHO c1ccc2c(c1)SCC[C@H]2[NH2+]CCCN1CCCCC1 ZINC000020128813 171015896 /nfs/dbraw/zinc/01/58/96/171015896.db2.gz CAPXGPFIZITGTB-MRXNPFEDSA-N 1 3 290.476 3.689 20 0 CHADHO Cc1cc([C@@H](C)[NH2+]CCCN2CCCC2)c(C)s1 ZINC000020129214 171017224 /nfs/dbraw/zinc/01/72/24/171017224.db2.gz FEPFWDCUDLPOCO-CYBMUJFWSA-N 1 3 266.454 3.501 20 0 CHADHO CC(C)CC[C@@H](C)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000020143417 171029270 /nfs/dbraw/zinc/02/92/70/171029270.db2.gz CTICZSAMXXNHHZ-CYBMUJFWSA-N 1 3 254.462 3.710 20 0 CHADHO CCC[NH+]1CCC(N[C@H](CC)c2ccccc2)CC1 ZINC000020189642 171055974 /nfs/dbraw/zinc/05/59/74/171055974.db2.gz ZDQGQMAKOFLCRA-QGZVFWFLSA-N 1 3 260.425 3.602 20 0 CHADHO Cc1cc(C)c(C[NH2+]CCCN2CCCCC2)c(C)c1 ZINC000021509096 171309259 /nfs/dbraw/zinc/30/92/59/171309259.db2.gz BYQMZLNUYVITPU-UHFFFAOYSA-N 1 3 274.452 3.577 20 0 CHADHO Cc1cc(N2CCC[C@@H]([NH+]3CCCC3)C2)c2ccccc2n1 ZINC000301236990 227485291 /nfs/dbraw/zinc/48/52/91/227485291.db2.gz IDUVXMQNINBFSD-MRXNPFEDSA-N 1 3 295.430 3.608 20 0 CHADHO CCc1ccc([C@H](CC)NC[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000037648978 260115474 /nfs/dbraw/zinc/11/54/74/260115474.db2.gz VWTAWAUVHPHEBN-LPHOPBHVSA-N 1 3 286.463 3.774 20 0 CHADHO CCc1ccc([C@H](CC)NC[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000037648978 260115476 /nfs/dbraw/zinc/11/54/76/260115476.db2.gz VWTAWAUVHPHEBN-LPHOPBHVSA-N 1 3 286.463 3.774 20 0 CHADHO C[C@H]([NH2+]CC(C)(C)CN(C)C)c1cnc2ccsc2c1 ZINC000068690355 260145637 /nfs/dbraw/zinc/14/56/37/260145637.db2.gz VBOKLUBXQIBWII-LBPRGKRZSA-N 1 3 291.464 3.535 20 0 CHADHO C[C@@H]1CCC[C@@H](C[NH2+]C2CCN(C(C)(C)C)CC2)C1 ZINC000089608411 260190020 /nfs/dbraw/zinc/19/00/20/260190020.db2.gz SQIDHMBLBXWCFR-HUUCEWRRSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@H](Cc1ccc(Cl)cc1)[NH2+]C[C@H](C)CN1CCCC1 ZINC000223033934 260260492 /nfs/dbraw/zinc/26/04/92/260260492.db2.gz AYTRKHLKUKLMEQ-LSDHHAIUSA-N 1 3 294.870 3.593 20 0 CHADHO N[C@H]1CCC[C@@H]([NH2+]C2CCC(c3ccccc3)CC2)C1 ZINC000093211222 260273206 /nfs/dbraw/zinc/27/32/06/260273206.db2.gz LENXAQPDWIYRHD-JYSRZZCRSA-N 1 3 272.436 3.572 20 0 CHADHO C[C@H](NCCCC[N@@H+]1CCCC[C@H]1C)c1cncc(F)c1 ZINC000157886803 261154497 /nfs/dbraw/zinc/15/44/97/261154497.db2.gz WFVXOXYNENSBMV-CABCVRRESA-N 1 3 293.430 3.526 20 0 CHADHO C[C@H](NCCCC[N@H+]1CCCC[C@H]1C)c1cncc(F)c1 ZINC000157886803 261154500 /nfs/dbraw/zinc/15/45/00/261154500.db2.gz WFVXOXYNENSBMV-CABCVRRESA-N 1 3 293.430 3.526 20 0 CHADHO C[C@H](NCCCC[N@@H+]1CCCC[C@@H]1C)c1ccco1 ZINC000157891070 261154606 /nfs/dbraw/zinc/15/46/06/261154606.db2.gz ULWIRZDMIORSBA-GJZGRUSLSA-N 1 3 264.413 3.585 20 0 CHADHO C[C@H](NCCCC[N@H+]1CCCC[C@@H]1C)c1ccco1 ZINC000157891070 261154608 /nfs/dbraw/zinc/15/46/08/261154608.db2.gz ULWIRZDMIORSBA-GJZGRUSLSA-N 1 3 264.413 3.585 20 0 CHADHO CCC[NH+]1CCC(N[C@H](C)c2ccc(C)cc2C)CC1 ZINC000020189825 262233330 /nfs/dbraw/zinc/23/33/30/262233330.db2.gz BHRIJWQTYOATDV-MRXNPFEDSA-N 1 3 274.452 3.828 20 0 CHADHO CC[NH2+]CC1CCN(Cc2ccc(-c3ccccc3)o2)CC1 ZINC000414661183 263023700 /nfs/dbraw/zinc/02/37/00/263023700.db2.gz OFUHOHFPMCPADJ-UHFFFAOYSA-N 1 3 298.430 3.768 20 0 CHADHO CC(C)[C@H]([NH3+])CN[C@@H]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000414805976 263051687 /nfs/dbraw/zinc/05/16/87/263051687.db2.gz ZAJBFMFBWCTOKX-ARFHVFGLSA-N 1 3 280.843 3.549 20 0 CHADHO NC[C@H]1CCC[C@H]1[NH2+]C1CCC(c2ccc(F)cc2)CC1 ZINC000414812591 263053367 /nfs/dbraw/zinc/05/33/67/263053367.db2.gz XMTZEOYXNWATKR-XPJGSDBHSA-N 1 3 290.426 3.569 20 0 CHADHO C[C@H](C[NH3+])CNCc1ccc(-c2ccccc2Cl)s1 ZINC000414879603 263094839 /nfs/dbraw/zinc/09/48/39/263094839.db2.gz PYYHEGGDQAWUHO-LLVKDONJSA-N 1 3 294.851 3.753 20 0 CHADHO C[C@H](CC(C)(C)c1ccccc1)[NH2+]C[C@]1(C)CCCNC1 ZINC000414906060 263112958 /nfs/dbraw/zinc/11/29/58/263112958.db2.gz LYFVHWNHYHCROA-VQIMIIECSA-N 1 3 288.479 3.722 20 0 CHADHO Fc1ccc(C2CCC([NH2+][C@@H]3CCCNCC3)CC2)cc1 ZINC000414907969 263114476 /nfs/dbraw/zinc/11/44/76/263114476.db2.gz CHQLIOKJBBNCKK-IIIMJFFVSA-N 1 3 290.426 3.584 20 0 CHADHO N[C@@H]1CCC[C@@H]([NH2+]CC2CCC(c3ccccc3)CC2)C1 ZINC000414919389 263124106 /nfs/dbraw/zinc/12/41/06/263124106.db2.gz UROYYNVHCMRBAK-JDGDGYACSA-N 1 3 286.463 3.820 20 0 CHADHO CC1([NH2+]Cc2cc(-c3ccccc3)cs2)CCNCC1 ZINC000414941854 263150200 /nfs/dbraw/zinc/15/02/00/263150200.db2.gz MDHMWKIQVMNLEQ-UHFFFAOYSA-N 1 3 286.444 3.647 20 0 CHADHO C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3)s2)CCN1 ZINC000414941508 263150264 /nfs/dbraw/zinc/15/02/64/263150264.db2.gz CVPWTGOJVCGTFB-DZGCQCFKSA-N 1 3 286.444 3.645 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H]1CCCC[C@@H](c2ccccc2)C1 ZINC000414943706 263153087 /nfs/dbraw/zinc/15/30/87/263153087.db2.gz OIFSPUNKPCEEIC-OWYHZJEWSA-N 1 3 286.463 3.691 20 0 CHADHO C[C@@H]1C[C@H]([NH2+]CC2CCC(c3ccccc3)CC2)CCN1 ZINC000414947896 263155971 /nfs/dbraw/zinc/15/59/71/263155971.db2.gz LKBRHIMYGVBTMV-JVGQSUMCSA-N 1 3 286.463 3.691 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H]1CCC[C@H]1c1ccccc1Cl ZINC000414948126 263155986 /nfs/dbraw/zinc/15/59/86/263155986.db2.gz XQXOOYUTORPPCO-QCPWZWHMSA-N 1 3 292.854 3.564 20 0 CHADHO CC(C)C[C@H](C[NH2+][C@@H]1CCN[C@@H](C)C1)c1ccccc1 ZINC000414952954 263158085 /nfs/dbraw/zinc/15/80/85/263158085.db2.gz RGUKBQRRVGODDP-CGTJXYLNSA-N 1 3 274.452 3.546 20 0 CHADHO CC(C)C[C@H](CN[C@@H]1CC[NH2+][C@@H](C)C1)c1ccccc1 ZINC000414952954 263158086 /nfs/dbraw/zinc/15/80/86/263158086.db2.gz RGUKBQRRVGODDP-CGTJXYLNSA-N 1 3 274.452 3.546 20 0 CHADHO Cc1ccccc1-c1cccc(C[NH2+][C@@H]2CCN[C@@H](C)C2)c1 ZINC000414952897 263158293 /nfs/dbraw/zinc/15/82/93/263158293.db2.gz REHCRGSQSPKAQC-QFBILLFUSA-N 1 3 294.442 3.892 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H](c3ccccc3)C2)CCN1 ZINC000414954992 263158947 /nfs/dbraw/zinc/15/89/47/263158947.db2.gz TVSQVEVOUXFXFN-NXWXRZEISA-N 1 3 286.463 3.833 20 0 CHADHO Clc1cccc(CNCCC[C@H]2CCC[NH2+]2)c1Cl ZINC000414973952 263175287 /nfs/dbraw/zinc/17/52/87/263175287.db2.gz NEGZUPPWULYROK-LBPRGKRZSA-N 1 3 287.234 3.615 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](CNCc2ccc(Cl)cc2Cl)C1 ZINC000414992505 263188850 /nfs/dbraw/zinc/18/88/50/263188850.db2.gz KORQASDGHBJVRG-GXFFZTMASA-N 1 3 287.234 3.601 20 0 CHADHO CCC[C@@H](C)C[NH2+]C[C@@H]1CNCC[C@@H]1c1ccc(F)cc1 ZINC000415010453 263245756 /nfs/dbraw/zinc/24/57/56/263245756.db2.gz UWGULFXSWFIFHP-UWWQBHOKSA-N 1 3 292.442 3.545 20 0 CHADHO COc1ccc(C)cc1CN[C@H](CCC[NH3+])c1ccccc1 ZINC000415049570 263255601 /nfs/dbraw/zinc/25/56/01/263255601.db2.gz HVHDUNIEQRLOJD-GOSISDBHSA-N 1 3 298.430 3.573 20 0 CHADHO C[C@H](CCCC[NH3+])NCc1c(Cl)oc2ccccc21 ZINC000415016445 263255645 /nfs/dbraw/zinc/25/56/45/263255645.db2.gz PRIJFCYMDXOWGX-LLVKDONJSA-N 1 3 280.799 3.693 20 0 CHADHO C[C@@H](CCC[NH3+])NCc1cc(C(F)(F)F)ccc1Cl ZINC000415023214 263256420 /nfs/dbraw/zinc/25/64/20/263256420.db2.gz MLEWXWAFLWKQPL-VIFPVBQESA-N 1 3 294.748 3.576 20 0 CHADHO [NH3+]CCC[C@@H](NCc1cccc(Cl)c1)c1ccccc1 ZINC000415047111 263257958 /nfs/dbraw/zinc/25/79/58/263257958.db2.gz DUALPBSMWXEWIM-QGZVFWFLSA-N 1 3 288.822 3.910 20 0 CHADHO Clc1ccc([C@@H]2CCC[C@H]2[NH2+]CCCNC2CC2)cc1 ZINC000415064640 263259603 /nfs/dbraw/zinc/25/96/03/263259603.db2.gz DFSDOSIQBHRNAF-DLBZAZTESA-N 1 3 292.854 3.708 20 0 CHADHO c1ccc(C[C@@H]2CCCC[C@H]2[NH2+][C@@H]2CCCNCC2)cc1 ZINC000415072785 263262791 /nfs/dbraw/zinc/26/27/91/263262791.db2.gz ABNUNEMCOOWFNE-IPMKNSEASA-N 1 3 286.463 3.520 20 0 CHADHO c1ccc([C@@H]2C[C@H](N[C@@H]3CCc4ccccc43)CC[NH2+]2)cc1 ZINC000415109511 263272949 /nfs/dbraw/zinc/27/29/49/263272949.db2.gz PQHVBZCXLMQLOD-RLLQIKCJSA-N 1 3 292.426 3.757 20 0 CHADHO c1ccc([C@@H]2C[C@@H](N[C@@H]3CCc4ccccc43)CC[NH2+]2)cc1 ZINC000415109513 263273158 /nfs/dbraw/zinc/27/31/58/263273158.db2.gz PQHVBZCXLMQLOD-SXLOBPIMSA-N 1 3 292.426 3.757 20 0 CHADHO CS[C@H]1CC[C@H]1NCc1cccc(C[N@H+](C)C(C)C)c1 ZINC000425361222 264147430 /nfs/dbraw/zinc/14/74/30/264147430.db2.gz UAJZOOUSUSRAGK-SJORKVTESA-N 1 3 292.492 3.510 20 0 CHADHO CS[C@H]1CC[C@H]1NCc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000425361222 264147431 /nfs/dbraw/zinc/14/74/31/264147431.db2.gz UAJZOOUSUSRAGK-SJORKVTESA-N 1 3 292.492 3.510 20 0 CHADHO CS[C@H]1CC[C@@H]1NCc1ccccc1C[N@H+](C)C(C)C ZINC000425365383 264210839 /nfs/dbraw/zinc/21/08/39/264210839.db2.gz YDHGACBZNLSCMM-IRXDYDNUSA-N 1 3 292.492 3.510 20 0 CHADHO CS[C@H]1CC[C@@H]1NCc1ccccc1C[N@@H+](C)C(C)C ZINC000425365383 264210841 /nfs/dbraw/zinc/21/08/41/264210841.db2.gz YDHGACBZNLSCMM-IRXDYDNUSA-N 1 3 292.492 3.510 20 0 CHADHO CS[C@@H]1CC[C@H]1NCc1ccccc1C[N@H+](C)C(C)C ZINC000425365382 264211468 /nfs/dbraw/zinc/21/14/68/264211468.db2.gz YDHGACBZNLSCMM-IAGOWNOFSA-N 1 3 292.492 3.510 20 0 CHADHO CS[C@@H]1CC[C@H]1NCc1ccccc1C[N@@H+](C)C(C)C ZINC000425365382 264211470 /nfs/dbraw/zinc/21/14/70/264211470.db2.gz YDHGACBZNLSCMM-IAGOWNOFSA-N 1 3 292.492 3.510 20 0 CHADHO C[C@H](N[C@H]1CCCC[C@H]1C[NH3+])c1ccc(Cl)s1 ZINC000251500384 264278734 /nfs/dbraw/zinc/27/87/34/264278734.db2.gz FTHRTAIJYPNNSH-DCAQKATOSA-N 1 3 272.845 3.570 20 0 CHADHO CC(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCN3CCC[C@@H]3C2)CC1 ZINC000157438600 264362479 /nfs/dbraw/zinc/36/24/79/264362479.db2.gz FWDOFLLNBOUGFO-XMTFNYHQSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@H](CCc1ccco1)N[C@@H](C)C[C@@H]1CCCCC[NH2+]1 ZINC000093513423 265186592 /nfs/dbraw/zinc/18/65/92/265186592.db2.gz UFOUIJJIICIKQP-PMPSAXMXSA-N 1 3 278.440 3.501 20 0 CHADHO C[C@H](CC[N@@H+]1CCC[C@H]2CN(C)CC[C@H]21)c1ccccc1 ZINC000519129547 265328258 /nfs/dbraw/zinc/32/82/58/265328258.db2.gz BEAUVYDUYNOUIN-NZSAHSFTSA-N 1 3 286.463 3.596 20 0 CHADHO C[C@H](CC[N@H+]1CCC[C@H]2CN(C)CC[C@H]21)c1ccccc1 ZINC000519129547 265328260 /nfs/dbraw/zinc/32/82/60/265328260.db2.gz BEAUVYDUYNOUIN-NZSAHSFTSA-N 1 3 286.463 3.596 20 0 CHADHO C[N@@H+]1CCCC[C@@H]1CCN1CCC[C@@H]1c1cccs1 ZINC000356853076 266191539 /nfs/dbraw/zinc/19/15/39/266191539.db2.gz NSTPVJFXHFBDBV-HUUCEWRRSA-N 1 3 278.465 3.759 20 0 CHADHO C[N@H+]1CCCC[C@@H]1CCN1CCC[C@@H]1c1cccs1 ZINC000356853076 266191540 /nfs/dbraw/zinc/19/15/40/266191540.db2.gz NSTPVJFXHFBDBV-HUUCEWRRSA-N 1 3 278.465 3.759 20 0 CHADHO Cc1ccccc1C[C@H]([NH2+][C@H]1CCN2CCC[C@H]2C1)C1CC1 ZINC000370534160 267327147 /nfs/dbraw/zinc/32/71/47/267327147.db2.gz RFULLVQBNROCHS-UFYCRDLUSA-N 1 3 298.474 3.533 20 0 CHADHO Cc1ccccc1C[C@H](N[C@H]1CC[N@@H+]2CCC[C@H]2C1)C1CC1 ZINC000370534160 267327151 /nfs/dbraw/zinc/32/71/51/267327151.db2.gz RFULLVQBNROCHS-UFYCRDLUSA-N 1 3 298.474 3.533 20 0 CHADHO Cc1ccccc1C[C@H](N[C@H]1CC[N@H+]2CCC[C@H]2C1)C1CC1 ZINC000370534160 267327153 /nfs/dbraw/zinc/32/71/53/267327153.db2.gz RFULLVQBNROCHS-UFYCRDLUSA-N 1 3 298.474 3.533 20 0 CHADHO C[C@H](C[C@H]1CCCCC[NH2+]1)NC[C@H]1CCCCC1(F)F ZINC000390598683 327881291 /nfs/dbraw/zinc/88/12/91/327881291.db2.gz UBYCTOZYOIAHBP-RBSFLKMASA-N 1 3 288.426 3.712 20 0 CHADHO Cc1ccc2c(c1)[C@H](NCc1ccc(C[NH3+])cc1)CCC2 ZINC000563155063 327931696 /nfs/dbraw/zinc/93/16/96/327931696.db2.gz ZNUDWIIAPJBSHB-LJQANCHMSA-N 1 3 280.415 3.621 20 0 CHADHO CC(C)Cc1ccc([C@H](C)[NH2+][C@@H]2CCNC[C@@H]2C)cc1 ZINC000261683797 328006111 /nfs/dbraw/zinc/00/61/11/328006111.db2.gz GZCPOIBJENGWCQ-RLFYNMQTSA-N 1 3 274.452 3.534 20 0 CHADHO CN1CCC[C@H]1CC[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000534019866 328033022 /nfs/dbraw/zinc/03/30/22/328033022.db2.gz LTGOTTGCWSGMFB-WMLDXEAASA-N 1 3 292.854 3.961 20 0 CHADHO CN1CCC[C@H]1CC[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000534019866 328033023 /nfs/dbraw/zinc/03/30/23/328033023.db2.gz LTGOTTGCWSGMFB-WMLDXEAASA-N 1 3 292.854 3.961 20 0 CHADHO CN1CCC[C@@H]1CC[N@H+](C)Cc1cccc2ccccc21 ZINC000534017947 328033082 /nfs/dbraw/zinc/03/30/82/328033082.db2.gz HZIZFPYMCHTJCV-GOSISDBHSA-N 1 3 282.431 3.756 20 0 CHADHO CN1CCC[C@@H]1CC[N@@H+](C)Cc1cccc2ccccc21 ZINC000534017947 328033083 /nfs/dbraw/zinc/03/30/83/328033083.db2.gz HZIZFPYMCHTJCV-GOSISDBHSA-N 1 3 282.431 3.756 20 0 CHADHO CCCN1CC[C@@H](C[NH2+]CCC2CCCCCC2)C1 ZINC000571329047 328107649 /nfs/dbraw/zinc/10/76/49/328107649.db2.gz YAWXTJMGWYACJG-KRWDZBQOSA-N 1 3 266.473 3.668 20 0 CHADHO CCN(Cc1c(C)oc2ccccc21)[C@H]1CCC[NH2+]CC1 ZINC000414720221 328216892 /nfs/dbraw/zinc/21/68/92/328216892.db2.gz XSOSUJLDPJSVGT-HNNXBMFYSA-N 1 3 286.419 3.705 20 0 CHADHO [NH3+]C[C@H]1CCCC[C@H]1NCc1csc2ccccc12 ZINC000414791116 328226411 /nfs/dbraw/zinc/22/64/11/328226411.db2.gz AYCRQXHQDXISAU-IUODEOHRSA-N 1 3 274.433 3.508 20 0 CHADHO CC1=C[C@H](C)C[C@@H](C[NH2+]C2CCN(CC(C)C)CC2)C1 ZINC000575030805 328230130 /nfs/dbraw/zinc/23/01/30/328230130.db2.gz XSSKJFLNXIOILY-DOTOQJQBSA-N 1 3 278.484 3.689 20 0 CHADHO CC1=C[C@@H](C)C[C@H](C[NH2+]C2CCN(CC(C)C)CC2)C1 ZINC000575030808 328230167 /nfs/dbraw/zinc/23/01/67/328230167.db2.gz XSSKJFLNXIOILY-WBVHZDCISA-N 1 3 278.484 3.689 20 0 CHADHO CCC([NH3+])(CC)CN[C@H]1CCC[C@H]1c1ccc(C)cc1 ZINC000414802882 328231491 /nfs/dbraw/zinc/23/14/91/328231491.db2.gz BYINDHPFDSKCMY-IRXDYDNUSA-N 1 3 274.452 3.738 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](CNCc2cc(Cl)ccc2Cl)C1 ZINC000414998965 328292369 /nfs/dbraw/zinc/29/23/69/328292369.db2.gz RFKYXFFTXJKCFR-GXFFZTMASA-N 1 3 287.234 3.601 20 0 CHADHO CC(C)C[C@@H]([NH3+])CN[C@@H](C)CC(C)(C)c1ccccc1 ZINC000415080331 328302440 /nfs/dbraw/zinc/30/24/40/328302440.db2.gz IXLMMKMAISTDQN-DOTOQJQBSA-N 1 3 276.468 3.706 20 0 CHADHO C[C@@H](c1cccc(Cl)c1)[N@H+](C)CC[C@@H]1CCCN1C ZINC000534757885 328360344 /nfs/dbraw/zinc/36/03/44/328360344.db2.gz DQUHVGOGBBLCPR-BBRMVZONSA-N 1 3 280.843 3.817 20 0 CHADHO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)CC[C@@H]1CCCN1C ZINC000534757885 328360346 /nfs/dbraw/zinc/36/03/46/328360346.db2.gz DQUHVGOGBBLCPR-BBRMVZONSA-N 1 3 280.843 3.817 20 0 CHADHO CC(C)c1ccc([C@@H](C)N[C@H](C)CC[NH+](C)C)cc1 ZINC000049553481 328371561 /nfs/dbraw/zinc/37/15/61/328371561.db2.gz NWPKQORRRYSYKB-HUUCEWRRSA-N 1 3 262.441 3.801 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCc3c2cccc3Cl)C1 ZINC000531995140 328387680 /nfs/dbraw/zinc/38/76/80/328387680.db2.gz APZTVSYVVXSZQS-OGHNNQOOSA-N 1 3 292.854 3.790 20 0 CHADHO CC(C)c1ccc([C@H](C)N2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)cc1 ZINC000261721551 327035028 /nfs/dbraw/zinc/03/50/28/327035028.db2.gz KGSXJCNNIYCPGI-MGHWNKPDSA-N 1 3 272.436 3.540 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]Cc2cc3ccccc3s2)C1 ZINC000558418680 327092860 /nfs/dbraw/zinc/09/28/60/327092860.db2.gz DMWQNQXPJQTTLT-CQSZACIVSA-N 1 3 288.460 3.721 20 0 CHADHO CCSCC[C@@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000152787970 327122350 /nfs/dbraw/zinc/12/23/50/327122350.db2.gz LARFWDNCXOPIFZ-OAHLLOKOSA-N 1 3 298.540 3.905 20 0 CHADHO C[C@H](c1ccc(C(F)(F)F)cc1)N(C)CC(C)(C)C[NH3+] ZINC000093872949 327145745 /nfs/dbraw/zinc/14/57/45/327145745.db2.gz LOGWMIUDRHCOTL-LLVKDONJSA-N 1 3 288.357 3.683 20 0 CHADHO C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)CC(C)(C)CN ZINC000093872949 327145747 /nfs/dbraw/zinc/14/57/47/327145747.db2.gz LOGWMIUDRHCOTL-LLVKDONJSA-N 1 3 288.357 3.683 20 0 CHADHO C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)CC(C)(C)CN ZINC000093872949 327145748 /nfs/dbraw/zinc/14/57/48/327145748.db2.gz LOGWMIUDRHCOTL-LLVKDONJSA-N 1 3 288.357 3.683 20 0 CHADHO CC(C)C[C@@H](C)C[NH2+]C[C@@H]1CCCN(CC(C)C)C1 ZINC000584258737 327202635 /nfs/dbraw/zinc/20/26/35/327202635.db2.gz FUMCIRSWFPGIAX-SJORKVTESA-N 1 3 268.489 3.626 20 0 CHADHO C[C@@H]1CCC[C@H](N2CCC([NH2+][C@@H]3CCC3(C)C)CC2)C1 ZINC000554377872 327216834 /nfs/dbraw/zinc/21/68/34/327216834.db2.gz VQLGNIIXIFBRLE-HYVNUMGLSA-N 1 3 278.484 3.808 20 0 CHADHO Cc1ccc2nccc(N[C@H]3CCC[C@@H]([NH+](C)C)C3)c2c1 ZINC000302162794 328831284 /nfs/dbraw/zinc/83/12/84/328831284.db2.gz QBURYVNGKZQTPZ-LSDHHAIUSA-N 1 3 283.419 3.828 20 0 CHADHO CSC1(CNC2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)CC1 ZINC000193818493 329063144 /nfs/dbraw/zinc/06/31/44/329063144.db2.gz UYZQXAIIANLGCI-ZBFHGGJFSA-N 1 3 296.524 3.515 20 0 CHADHO CSC1(C[NH2+]C2CCN([C@H]3CCC[C@@H](C)C3)CC2)CC1 ZINC000193818493 329063146 /nfs/dbraw/zinc/06/31/46/329063146.db2.gz UYZQXAIIANLGCI-ZBFHGGJFSA-N 1 3 296.524 3.515 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN(CC[C@@H](C)c2ccccc2)C1 ZINC000194021914 329064878 /nfs/dbraw/zinc/06/48/78/329064878.db2.gz LGAADYDXDSBSLC-QZTJIDSGSA-N 1 3 288.479 3.844 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN(CC[C@@H](C)c2ccccc2)C1 ZINC000194021914 329064876 /nfs/dbraw/zinc/06/48/76/329064876.db2.gz LGAADYDXDSBSLC-QZTJIDSGSA-N 1 3 288.479 3.844 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+](CC[C@@H](C)c2ccccc2)C1 ZINC000194021914 329064879 /nfs/dbraw/zinc/06/48/79/329064879.db2.gz LGAADYDXDSBSLC-QZTJIDSGSA-N 1 3 288.479 3.844 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+](CC[C@@H](C)c2ccccc2)C1 ZINC000194021914 329064881 /nfs/dbraw/zinc/06/48/81/329064881.db2.gz LGAADYDXDSBSLC-QZTJIDSGSA-N 1 3 288.479 3.844 20 0 CHADHO CCC[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000582779594 329185175 /nfs/dbraw/zinc/18/51/75/329185175.db2.gz ZKVXHKGEOWJBLL-RKVPGOIHSA-N 1 3 289.467 3.858 20 0 CHADHO CCC[C@@H]([NH2+]CC1(CN(C)C)CCCC1)c1ccccn1 ZINC000183952904 329255323 /nfs/dbraw/zinc/25/53/23/329255323.db2.gz SGROWWQHACOLDX-MRXNPFEDSA-N 1 3 289.467 3.634 20 0 CHADHO CC[NH2+]CCCN[C@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000583198214 329360238 /nfs/dbraw/zinc/36/02/38/329360238.db2.gz SVFKRLFRJKDSDA-ZBFHGGJFSA-N 1 3 280.843 3.565 20 0 CHADHO CCNCCC[NH2+][C@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000583198214 329360239 /nfs/dbraw/zinc/36/02/39/329360239.db2.gz SVFKRLFRJKDSDA-ZBFHGGJFSA-N 1 3 280.843 3.565 20 0 CHADHO Clc1ccc([C@@H](NC[C@H]2CC[NH2+]C2)C2CCCC2)cc1 ZINC000420406853 329764236 /nfs/dbraw/zinc/76/42/36/329764236.db2.gz OCICXRYFYIDPQV-GUYCJALGSA-N 1 3 292.854 3.770 20 0 CHADHO c1cc(CN2CCCC[C@@H]2[C@H]2CC[NH2+]C2)cc(C2CC2)c1 ZINC000422550836 330149007 /nfs/dbraw/zinc/14/90/07/330149007.db2.gz BZTDUNDNWPOYME-RBUKOAKNSA-N 1 3 284.447 3.528 20 0 CHADHO Cc1ccc(CN[C@H]2CC[NH2+][C@H](c3ccccc3)C2)c(C)c1 ZINC000422691772 330150724 /nfs/dbraw/zinc/15/07/24/330150724.db2.gz IYGRTDMZVMSHFD-PMACEKPBSA-N 1 3 294.442 3.886 20 0 CHADHO c1ccc2cc(CN[C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)ccc2c1 ZINC000422706523 330151102 /nfs/dbraw/zinc/15/11/02/330151102.db2.gz UPCICSIYTGYEHE-VAMGGRTRSA-N 1 3 294.442 3.850 20 0 CHADHO CC[C@H](CN[C@@H]1C[C@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000422710958 330151349 /nfs/dbraw/zinc/15/13/49/330151349.db2.gz GNNUPHJZSCMJTA-MDASCCDHSA-N 1 3 280.415 3.915 20 0 CHADHO CCSc1ccc([C@H](C)N[C@H](C)C[C@H](C)[NH3+])cc1 ZINC000422720890 330152038 /nfs/dbraw/zinc/15/20/38/330152038.db2.gz UBYQFERLZWCMGG-XQQFMLRXSA-N 1 3 266.454 3.575 20 0 CHADHO C[C@@H](N[C@@H](C)CCC[NH3+])c1cc(F)c(Cl)cc1Cl ZINC000422728024 330152372 /nfs/dbraw/zinc/15/23/72/330152372.db2.gz IPWYEFLIZMLBSL-DTWKUNHWSA-N 1 3 293.213 3.911 20 0 CHADHO C[C@@H](N[C@H]1CCC[NH2+]CC1)c1ccc2ccccc2c1 ZINC000422746645 330153020 /nfs/dbraw/zinc/15/30/20/330153020.db2.gz NZXLYESHWBGTIB-KDOFPFPSSA-N 1 3 268.404 3.633 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](c1ccc(Cl)cc1)C1CC1 ZINC000422757628 330153516 /nfs/dbraw/zinc/15/35/16/330153516.db2.gz HWAOMKAEOGQESN-ZIBATOQPSA-N 1 3 266.816 3.507 20 0 CHADHO Cc1ccc([C@H](C)CN[C@@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000422756276 330153678 /nfs/dbraw/zinc/15/36/78/330153678.db2.gz GSTPSQQHCKQJCC-MDASCCDHSA-N 1 3 280.415 3.833 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@H](Cc1ccccc1)c1ccccc1 ZINC000422768250 330154192 /nfs/dbraw/zinc/15/41/92/330154192.db2.gz RVWUEJXOOJXINE-TXPKVOOTSA-N 1 3 282.431 3.686 20 0 CHADHO C[C@H](N[C@@H](C)[C@@H]1CCC[NH2+]C1)c1cccc2ccccc21 ZINC000422769030 330154204 /nfs/dbraw/zinc/15/42/04/330154204.db2.gz UHKDRIYIZCVQJV-YQQAZPJKSA-N 1 3 282.431 3.879 20 0 CHADHO C[C@H]([NH2+][C@@H](C)[C@@H]1CCCNC1)c1cccc2ccccc21 ZINC000422769030 330154206 /nfs/dbraw/zinc/15/42/06/330154206.db2.gz UHKDRIYIZCVQJV-YQQAZPJKSA-N 1 3 282.431 3.879 20 0 CHADHO Cc1ccc([C@H](C)CN[C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000422766841 330154400 /nfs/dbraw/zinc/15/44/00/330154400.db2.gz QIGIIYADWWVGEE-XGXHKWSGSA-N 1 3 286.463 3.609 20 0 CHADHO Cc1cccc([C@H](C)CN[C@@H]2C[C@H]([NH3+])c3ccccc32)c1 ZINC000422778822 330154545 /nfs/dbraw/zinc/15/45/45/330154545.db2.gz HUVHBDIIIAZSPY-MDASCCDHSA-N 1 3 280.415 3.833 20 0 CHADHO Cc1cccc([C@@H](C)C[NH2+][C@H](C)c2ccc(CN)nc2C)c1 ZINC000422792041 330155164 /nfs/dbraw/zinc/15/51/64/330155164.db2.gz WSBCXYSKWFKIJM-LSDHHAIUSA-N 1 3 297.446 3.611 20 0 CHADHO Cc1cc(C)cc(CCN[C@H]2C[C@@H]([NH3+])c3ccccc32)c1 ZINC000422794259 330155491 /nfs/dbraw/zinc/15/54/91/330155491.db2.gz YYHIGYQZHSRSSD-MOPGFXCFSA-N 1 3 280.415 3.580 20 0 CHADHO C[C@H]1CCNCC[C@H]1[NH2+]C1CCC(c2ccccc2)CC1 ZINC000422801253 330155515 /nfs/dbraw/zinc/15/55/15/330155515.db2.gz BOBKAKIKHPNCLC-GWFLUQINSA-N 1 3 286.463 3.691 20 0 CHADHO CC(C)[C@H](C[NH2+][C@@H]1CCCC[C@@H]1CN)c1ccccc1 ZINC000422808747 330155929 /nfs/dbraw/zinc/15/59/29/330155929.db2.gz LLKLJEOFLFFMFB-FGTMMUONSA-N 1 3 274.452 3.533 20 0 CHADHO CCS[C@@H]1CCC[C@H](N[C@@H]2C[C@H]([NH3+])c3ccccc32)C1 ZINC000422818403 330156125 /nfs/dbraw/zinc/15/61/25/330156125.db2.gz KHUMKGCWUFGTCM-UWWPHRKUSA-N 1 3 290.476 3.785 20 0 CHADHO CC[C@H](N[C@H](C)C[C@@H](C)[NH3+])c1ccc(Cl)cc1 ZINC000422824832 330156568 /nfs/dbraw/zinc/15/65/68/330156568.db2.gz OPQOMZZRUYBRDD-GYSYKLTISA-N 1 3 254.805 3.507 20 0 CHADHO C[C@H]1CCNCC[C@H]1[NH2+]CC(C)(C)c1cccc(Cl)c1 ZINC000422822153 330156687 /nfs/dbraw/zinc/15/66/87/330156687.db2.gz JHANSNCQWRHQGE-XJKSGUPXSA-N 1 3 294.870 3.595 20 0 CHADHO C[C@H](Cc1ccc(Cl)cc1Cl)N[C@@H](C)C[C@H](C)[NH3+] ZINC000422864868 330158128 /nfs/dbraw/zinc/15/81/28/330158128.db2.gz WPHWWYONDHPRPY-GARJFASQSA-N 1 3 289.250 3.640 20 0 CHADHO C[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@@H](C)C[C@H](C)N ZINC000422864868 330158129 /nfs/dbraw/zinc/15/81/29/330158129.db2.gz WPHWWYONDHPRPY-GARJFASQSA-N 1 3 289.250 3.640 20 0 CHADHO COc1ccc(-c2ccc(CN[C@@H](C)C[C@H](C)[NH3+])cc2)cc1 ZINC000422917558 330160342 /nfs/dbraw/zinc/16/03/42/330160342.db2.gz GHTHFJSKEILJHF-GJZGRUSLSA-N 1 3 298.430 3.578 20 0 CHADHO CCC(CC)(CC)C[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000422926772 330160893 /nfs/dbraw/zinc/16/08/93/330160893.db2.gz DYTOMBIGIZGKOR-CYBMUJFWSA-N 1 3 277.456 3.716 20 0 CHADHO [NH3+][C@H]1CCCCC[C@@H]1NCCc1csc2ccccc12 ZINC000422931942 330161273 /nfs/dbraw/zinc/16/12/73/330161273.db2.gz DFEXPWTUFFBRGH-HOTGVXAUSA-N 1 3 288.460 3.693 20 0 CHADHO CCCc1ccc([C@H](N[C@H](C)C2C[NH2+]C2)C(C)C)cc1 ZINC000422937205 330161493 /nfs/dbraw/zinc/16/14/93/330161493.db2.gz NZBPYUDPMWPWPM-RDTXWAMCSA-N 1 3 274.452 3.534 20 0 CHADHO CCCc1ccc([C@H]([NH2+][C@H](C)C2CNC2)C(C)C)cc1 ZINC000422937205 330161494 /nfs/dbraw/zinc/16/14/94/330161494.db2.gz NZBPYUDPMWPWPM-RDTXWAMCSA-N 1 3 274.452 3.534 20 0 CHADHO CC1(C)CC[C@H](N[C@@H]2CCC[NH2+]CC2)c2ccccc21 ZINC000422943123 330161668 /nfs/dbraw/zinc/16/16/68/330161668.db2.gz KEHMYEACOWTSET-PBHICJAKSA-N 1 3 272.436 3.531 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCC1(Sc2ccccc2)CCCC1 ZINC000422901382 330162157 /nfs/dbraw/zinc/16/21/57/330162157.db2.gz BXHBQMUVSINCHU-CABCVRRESA-N 1 3 292.492 3.807 20 0 CHADHO C[C@@H](N)C[C@H](C)[NH2+]CC1(Sc2ccccc2)CCCC1 ZINC000422901382 330162158 /nfs/dbraw/zinc/16/21/58/330162158.db2.gz BXHBQMUVSINCHU-CABCVRRESA-N 1 3 292.492 3.807 20 0 CHADHO C[C@H](CCC[NH3+])N[C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000422961779 330164270 /nfs/dbraw/zinc/16/42/70/330164270.db2.gz ZYCOLRGGUIETAO-OLZOCXBDSA-N 1 3 289.448 3.588 20 0 CHADHO C[C@@H]1CC[C@H](N[C@@H]2CC[NH2+]CC[C@@H]2C)c2ccccc21 ZINC000423004507 330164817 /nfs/dbraw/zinc/16/48/17/330164817.db2.gz PGXHPVSSODKTCW-NONVJHHQSA-N 1 3 272.436 3.603 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@H]1NCC1(c2ccccc2Cl)CC1 ZINC000423021359 330165653 /nfs/dbraw/zinc/16/56/53/330165653.db2.gz FAZXAYGPXFSQNA-HZPDHXFCSA-N 1 3 292.854 3.621 20 0 CHADHO CCC1(C[NH2+][C@@H](C)c2ccc(CN)nc2C)CCCCC1 ZINC000423038650 330166500 /nfs/dbraw/zinc/16/65/00/330166500.db2.gz OVYRAXLABXAWIY-AWEZNQCLSA-N 1 3 289.467 3.860 20 0 CHADHO C[C@@H](N[C@@H](C)C[C@H](C)[NH3+])c1cc2ccccc2s1 ZINC000423058672 330167762 /nfs/dbraw/zinc/16/77/62/330167762.db2.gz KBXPILSWCUZMOS-SDDRHHMPSA-N 1 3 262.422 3.678 20 0 CHADHO CC(C)c1cccc(CN[C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)c1 ZINC000423056981 330167771 /nfs/dbraw/zinc/16/77/71/330167771.db2.gz YPEMSHDHBSKSRX-CEXWTWQISA-N 1 3 286.463 3.820 20 0 CHADHO NC[C@@H]1CCC[C@H]1[NH2+]C1CCC2(CCCCC2)CC1 ZINC000423066510 330168292 /nfs/dbraw/zinc/16/82/92/330168292.db2.gz DXLOJGFJAFRUDQ-GOEBONIOSA-N 1 3 264.457 3.597 20 0 CHADHO NC[C@H]1CCC[C@H]1[NH2+]C1CCC2(CCCCC2)CC1 ZINC000423066509 330168362 /nfs/dbraw/zinc/16/83/62/330168362.db2.gz DXLOJGFJAFRUDQ-GDBMZVCRSA-N 1 3 264.457 3.597 20 0 CHADHO c1cc(C2CC2)ccc1CN[C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000423072777 330168629 /nfs/dbraw/zinc/16/86/29/330168629.db2.gz JUZJHQCWKIJSAB-GBESFXJTSA-N 1 3 284.447 3.574 20 0 CHADHO CC1(c2ccccc2)CC(N[C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)C1 ZINC000423102169 330170205 /nfs/dbraw/zinc/17/02/05/330170205.db2.gz OEFXCLGWBSTMJX-YJGITHLRSA-N 1 3 298.474 3.617 20 0 CHADHO C[C@H]1CCNCC[C@@H]1[NH2+][C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423103713 330170574 /nfs/dbraw/zinc/17/05/74/330170574.db2.gz XXJBAOGUNAWYPG-CSFVBSKPSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@H]1CC[NH2+]CC[C@@H]1N[C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423103713 330170575 /nfs/dbraw/zinc/17/05/75/330170575.db2.gz XXJBAOGUNAWYPG-CSFVBSKPSA-N 1 3 292.854 3.564 20 0 CHADHO [NH3+][C@H]1C[C@@H](NCC2CC(c3ccccc3)C2)c2ccccc21 ZINC000423107180 330170653 /nfs/dbraw/zinc/17/06/53/330170653.db2.gz DQFDCCOOXNPNHH-FDDYUBGGSA-N 1 3 292.426 3.915 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NC[C@@H]2CCCC(F)(F)C2)c2ccccc21 ZINC000423114575 330170859 /nfs/dbraw/zinc/17/08/59/330170859.db2.gz LSGZYLUUPKQDNE-KCPJHIHWSA-N 1 3 280.362 3.546 20 0 CHADHO C=Cc1ccc(CCN[C@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000423141623 330172376 /nfs/dbraw/zinc/17/23/76/330172376.db2.gz QYDOMHBVJDFSLG-MOPGFXCFSA-N 1 3 278.399 3.607 20 0 CHADHO N[C@H]1C[C@H]([NH2+]C2(Cc3ccc(F)cc3)CC2)c2ccccc21 ZINC000423150727 330172810 /nfs/dbraw/zinc/17/28/10/330172810.db2.gz CCPZBVQLDBKFHB-ROUUACIJSA-N 1 3 296.389 3.635 20 0 CHADHO CC(C)=CCC[C@@H](C)[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000423152172 330173069 /nfs/dbraw/zinc/17/30/69/330173069.db2.gz DSWVYVAQRWPAKQ-ZIAGYGMSSA-N 1 3 275.440 3.634 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@@H]1C[C@@H](C)C[C@H](c2ccccc2)C1 ZINC000423174191 330174738 /nfs/dbraw/zinc/17/47/38/330174738.db2.gz BOJKKOKHFOCZFC-FTAMUGHTSA-N 1 3 274.452 3.674 20 0 CHADHO CCC[C@@H](NCCC[NH3+])c1ccc(Cl)c(Cl)c1 ZINC000423175099 330174788 /nfs/dbraw/zinc/17/47/88/330174788.db2.gz CXXNDPMEJFBHBX-CYBMUJFWSA-N 1 3 275.223 3.773 20 0 CHADHO C[C@H](NCC1([NH3+])CCCCC1)C(C)(C)c1ccccc1 ZINC000423177818 330175244 /nfs/dbraw/zinc/17/52/44/330175244.db2.gz JQAKSHUPSMRNRK-HNNXBMFYSA-N 1 3 274.452 3.604 20 0 CHADHO Clc1ccc([C@H](CC2CC2)NC[C@@H]2CCC[NH2+]C2)cc1 ZINC000423205612 330176985 /nfs/dbraw/zinc/17/69/85/330176985.db2.gz FEUJEEPQEKUUCF-PBHICJAKSA-N 1 3 292.854 3.770 20 0 CHADHO c1ccc([C@@H](NC[C@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC000423210042 330177745 /nfs/dbraw/zinc/17/77/45/330177745.db2.gz JMCOXPDMVFPEIC-MAUKXSAKSA-N 1 3 272.436 3.507 20 0 CHADHO c1ccc([C@@H]([NH2+]C[C@H]2CCCNC2)C2CCCC2)cc1 ZINC000423210042 330177748 /nfs/dbraw/zinc/17/77/48/330177748.db2.gz JMCOXPDMVFPEIC-MAUKXSAKSA-N 1 3 272.436 3.507 20 0 CHADHO C[C@@H](N[C@@H](C)c1cc2c(s1)CCCC2)[C@H]1CCC[NH2+]C1 ZINC000423212630 330177949 /nfs/dbraw/zinc/17/79/49/330177949.db2.gz ISTMZNPDKRJUAD-IPYPFGDCSA-N 1 3 292.492 3.666 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)c1cc2c(s1)CCCC2)[C@H]1CCCNC1 ZINC000423212630 330177950 /nfs/dbraw/zinc/17/79/50/330177950.db2.gz ISTMZNPDKRJUAD-IPYPFGDCSA-N 1 3 292.492 3.666 20 0 CHADHO Cc1cc(C)c([C@H](C)N[C@H](C)[C@H]2CCC[NH2+]C2)cc1C ZINC000423210884 330178014 /nfs/dbraw/zinc/17/80/14/330178014.db2.gz GOWDQHODINRQSM-IKGGRYGDSA-N 1 3 274.452 3.651 20 0 CHADHO Cc1cc(C)c([C@H](C)[NH2+][C@H](C)[C@H]2CCCNC2)cc1C ZINC000423210884 330178016 /nfs/dbraw/zinc/17/80/16/330178016.db2.gz GOWDQHODINRQSM-IKGGRYGDSA-N 1 3 274.452 3.651 20 0 CHADHO CCCC[C@H](NC[C@H]1CCC[NH2+]C1)c1ccccc1 ZINC000423215355 330178265 /nfs/dbraw/zinc/17/82/65/330178265.db2.gz QMEUYMNGWHZYAC-RDJZCZTQSA-N 1 3 260.425 3.507 20 0 CHADHO CCCC[C@H]([NH2+]C[C@H]1CCCNC1)c1ccccc1 ZINC000423215355 330178266 /nfs/dbraw/zinc/17/82/66/330178266.db2.gz QMEUYMNGWHZYAC-RDJZCZTQSA-N 1 3 260.425 3.507 20 0 CHADHO Cc1ccsc1[C@H](Cc1ccccc1)NCC[C@H](C)[NH3+] ZINC000423223569 330180140 /nfs/dbraw/zinc/18/01/40/330180140.db2.gz GPKCVWXSYIPBTM-HOCLYGCPSA-N 1 3 288.460 3.667 20 0 CHADHO C[C@H]([NH3+])CCN[C@H]1CCCc2c3ccccc3sc21 ZINC000423228244 330180270 /nfs/dbraw/zinc/18/02/70/330180270.db2.gz YWYWASGKLSDDBM-FZMZJTMJSA-N 1 3 274.433 3.606 20 0 CHADHO CC[C@H](NCC[C@H](C)[NH3+])c1ccc2cc(OC)ccc2c1 ZINC000423232781 330180921 /nfs/dbraw/zinc/18/09/21/330180921.db2.gz NGAKJZDUUNOPIW-UGSOOPFHSA-N 1 3 286.419 3.626 20 0 CHADHO CC(C)Sc1ccc([C@@H](C)[NH2+]C[C@H](N)C(C)C)cc1 ZINC000423264511 330184127 /nfs/dbraw/zinc/18/41/27/330184127.db2.gz CCUYOZMTEWARBQ-CJNGLKHVSA-N 1 3 280.481 3.821 20 0 CHADHO CC[C@@H](N[C@@H](C[NH3+])C1CCCCC1)c1cccs1 ZINC000423267853 330184295 /nfs/dbraw/zinc/18/42/95/330184295.db2.gz UBXHKLQQBWASQG-KGLIPLIRSA-N 1 3 266.454 3.696 20 0 CHADHO CC(C)[C@H]([NH3+])CN[C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000423278291 330185436 /nfs/dbraw/zinc/18/54/36/330185436.db2.gz QMWLRWCERZGDBR-FVQBIDKESA-N 1 3 280.843 3.549 20 0 CHADHO NC[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCCc2c3ccccc3[nH]c21 ZINC000423282462 330185666 /nfs/dbraw/zinc/18/56/66/330185666.db2.gz VCLHDKWGIXRAJJ-FDQGKXFDSA-N 1 3 297.446 3.652 20 0 CHADHO [NH3+]C[C@@H]1CCCC[C@H]1N[C@@H]1CCCc2c3ccccc3[nH]c21 ZINC000423282462 330185667 /nfs/dbraw/zinc/18/56/67/330185667.db2.gz VCLHDKWGIXRAJJ-FDQGKXFDSA-N 1 3 297.446 3.652 20 0 CHADHO C[C@H](N[C@H]1CCCC[C@@H]1C[NH3+])c1ccc(F)c(Cl)c1 ZINC000423281988 330185819 /nfs/dbraw/zinc/18/58/19/330185819.db2.gz VQMQTKNROHZYPG-NVBFEUDRSA-N 1 3 284.806 3.647 20 0 CHADHO C[C@@H]([NH2+]CC(C)(C)N)c1ccc(-c2ccccc2F)s1 ZINC000423287472 330185995 /nfs/dbraw/zinc/18/59/95/330185995.db2.gz MNBRWUUAYVAPCY-LLVKDONJSA-N 1 3 292.423 3.942 20 0 CHADHO CC(C)(N)C[NH2+][C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423288464 330186410 /nfs/dbraw/zinc/18/64/10/330186410.db2.gz SFJSRCZZBZJFJB-AWEZNQCLSA-N 1 3 266.816 3.508 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@H]2c3ccccc3C[C@H]2C)cc1 ZINC000423289885 330186520 /nfs/dbraw/zinc/18/65/20/330186520.db2.gz BWGSVFWXVDWCGK-BIENJYKASA-N 1 3 280.415 3.729 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2cccc(F)c2)cc1 ZINC000423289879 330186589 /nfs/dbraw/zinc/18/65/89/330186589.db2.gz BVYBNEXTLIRYHK-STQMWFEESA-N 1 3 272.367 3.696 20 0 CHADHO Cc1cccc2c1CC[C@H]2NCc1ccc([C@H](C)[NH3+])cc1 ZINC000423290103 330186664 /nfs/dbraw/zinc/18/66/64/330186664.db2.gz CKGHPSOATYRGDY-IFXJQAMLSA-N 1 3 280.415 3.792 20 0 CHADHO Cc1ccc([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)s1 ZINC000423290527 330186803 /nfs/dbraw/zinc/18/68/03/330186803.db2.gz DINJSDCUVPLYOA-QWHCGFSZSA-N 1 3 274.433 3.927 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H](c2cccnc2)C2CCC2)cc1 ZINC000423292892 330187757 /nfs/dbraw/zinc/18/77/57/330187757.db2.gz OVUROUXQXHHLLH-IFXJQAMLSA-N 1 3 295.430 3.732 20 0 CHADHO COc1cccc([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000423292773 330187768 /nfs/dbraw/zinc/18/77/68/330187768.db2.gz OJFFOAAZTVYKFG-UONOGXRCSA-N 1 3 284.403 3.566 20 0 CHADHO CC[C@H](NC[C@@H](C)C[NH3+])c1ccc(Cl)c(Cl)c1 ZINC000423300891 330189016 /nfs/dbraw/zinc/18/90/16/330189016.db2.gz SJZFLKZXFBVBAQ-ZANVPECISA-N 1 3 275.223 3.629 20 0 CHADHO NC1(C[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)CCC1 ZINC000423315517 330189812 /nfs/dbraw/zinc/18/98/12/330189812.db2.gz AVMFFPWPNNIDAC-AWEZNQCLSA-N 1 3 299.245 3.916 20 0 CHADHO NC1(C[NH2+][C@@H](Cc2ccccc2F)c2ccccc2)CCC1 ZINC000423317672 330189976 /nfs/dbraw/zinc/18/99/76/330189976.db2.gz CWPQTMCZQRUJJE-SFHVURJKSA-N 1 3 298.405 3.581 20 0 CHADHO CCC[C@H]([NH2+]CC1(N)CCC1)c1ccc(Cl)cc1 ZINC000423324100 330190582 /nfs/dbraw/zinc/19/05/82/330190582.db2.gz KFSPAHXIEDTJBF-AWEZNQCLSA-N 1 3 266.816 3.652 20 0 CHADHO N[C@@H](C[NH2+][C@H](c1ccc(Cl)cc1)C1CCC1)C1CC1 ZINC000423333187 330191603 /nfs/dbraw/zinc/19/16/03/330191603.db2.gz VNLLJGSAIWVCAM-HOTGVXAUSA-N 1 3 278.827 3.508 20 0 CHADHO C[C@@H](NCC1=CC[NH2+]CC1)c1ccc(Cl)cc1Cl ZINC000423333208 330191606 /nfs/dbraw/zinc/19/16/06/330191606.db2.gz DXJRSPIHDQUSPF-SNVBAGLBSA-N 1 3 285.218 3.564 20 0 CHADHO C[C@H](NC[C@@]1(C)CCC[NH2+]C1)c1cc2c(s1)CCCC2 ZINC000423345331 330192262 /nfs/dbraw/zinc/19/22/62/330192262.db2.gz YTNMXPUZANEJAW-GUYCJALGSA-N 1 3 292.492 3.667 20 0 CHADHO C[C@H]([NH2+]C[C@@]1(C)CCCNC1)c1cc2c(s1)CCCC2 ZINC000423345331 330192265 /nfs/dbraw/zinc/19/22/65/330192265.db2.gz YTNMXPUZANEJAW-GUYCJALGSA-N 1 3 292.492 3.667 20 0 CHADHO C[C@H](NC[C@]1(C)CCC[NH2+]C1)c1cc2ccccc2s1 ZINC000423351350 330192752 /nfs/dbraw/zinc/19/27/52/330192752.db2.gz YWPTVKPJFNEULI-SUMWQHHRSA-N 1 3 288.460 3.942 20 0 CHADHO C[C@H]([NH2+]C[C@]1(C)CCCNC1)c1cc2ccccc2s1 ZINC000423351350 330192753 /nfs/dbraw/zinc/19/27/53/330192753.db2.gz YWPTVKPJFNEULI-SUMWQHHRSA-N 1 3 288.460 3.942 20 0 CHADHO C[C@@H]1CC[C@@H](NC[C@@]2(C)CCC[NH2+]C2)c2sccc21 ZINC000423350150 330192787 /nfs/dbraw/zinc/19/27/87/330192787.db2.gz XBJVYHUUTURBNA-XPKDYRNWSA-N 1 3 278.465 3.666 20 0 CHADHO C[C@@H]1CC[C@@H]([NH2+]C[C@@]2(C)CCCNC2)c2sccc21 ZINC000423350150 330192788 /nfs/dbraw/zinc/19/27/88/330192788.db2.gz XBJVYHUUTURBNA-XPKDYRNWSA-N 1 3 278.465 3.666 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@@H](c3cccc(Cl)c3)C2)C1 ZINC000423359984 330193725 /nfs/dbraw/zinc/19/37/25/330193725.db2.gz DYEVKUBHCYKCIX-SIXLDLHFSA-N 1 3 292.854 3.836 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@@H](CC2CCC2)c2ccccc2)CCN1 ZINC000423362903 330193816 /nfs/dbraw/zinc/19/38/16/330193816.db2.gz ABJFTNIAMMHJLE-JLSDUUJJSA-N 1 3 272.436 3.648 20 0 CHADHO CCC[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccccc1 ZINC000423362332 330194131 /nfs/dbraw/zinc/19/41/31/330194131.db2.gz SRNNCVZTJAXIOY-IBGZPJMESA-N 1 3 280.415 3.921 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@H](C)NCC[C@H]1CCC[NH2+]1 ZINC000423365919 330194744 /nfs/dbraw/zinc/19/47/44/330194744.db2.gz WXCJYTCXPLILFH-HEHGZKQESA-N 1 3 280.843 3.564 20 0 CHADHO C[C@@H](CCCC(F)(F)F)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423370199 330194987 /nfs/dbraw/zinc/19/49/87/330194987.db2.gz FHZGJNGTMLIGLW-NSHDSACASA-N 1 3 286.341 3.501 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@@H]1N[C@H](CC1CCC1)c1ccccc1 ZINC000423397917 330195888 /nfs/dbraw/zinc/19/58/88/330195888.db2.gz OOWXPBDBHJYIEM-FHLIZLRMSA-N 1 3 272.436 3.506 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H](CC1CCC1)c1ccccc1 ZINC000423397917 330195889 /nfs/dbraw/zinc/19/58/89/330195889.db2.gz OOWXPBDBHJYIEM-FHLIZLRMSA-N 1 3 272.436 3.506 20 0 CHADHO CCCC[C@@H](C)[C@@H](C)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423398252 330195918 /nfs/dbraw/zinc/19/59/18/330195918.db2.gz UGPZYZXIPVRODH-ZIAGYGMSSA-N 1 3 260.425 3.594 20 0 CHADHO Fc1ccc2c(c1)[C@@H](NCc1ccc3c(c1)C[NH2+]C3)CCC2 ZINC000423399186 330195931 /nfs/dbraw/zinc/19/59/31/330195931.db2.gz UUPMJVHOASQCBL-IBGZPJMESA-N 1 3 296.389 3.596 20 0 CHADHO Cc1ccc2c(c1)[C@H](NCc1ccc3c(c1)C[NH2+]C3)CCC2 ZINC000423402151 330196351 /nfs/dbraw/zinc/19/63/51/330196351.db2.gz WHBYVSBLSSJUAS-HXUWFJFHSA-N 1 3 292.426 3.765 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@@H](N)C1)[C@@H](C)c1ccc(Cl)cc1 ZINC000423374273 330198769 /nfs/dbraw/zinc/19/87/69/330198769.db2.gz SOIRHTLUZNZCAI-NOXHYTERSA-N 1 3 280.843 3.692 20 0 CHADHO CCc1ccc([C@H](N[C@H]2CC[NH2+][C@H](C)C2)C(C)C)cc1 ZINC000423378617 330198842 /nfs/dbraw/zinc/19/88/42/330198842.db2.gz MIEAGSSLVZDOHO-FHLIZLRMSA-N 1 3 274.452 3.676 20 0 CHADHO CCc1ccc([C@H]([NH2+][C@H]2CCN[C@H](C)C2)C(C)C)cc1 ZINC000423378617 330198843 /nfs/dbraw/zinc/19/88/43/330198843.db2.gz MIEAGSSLVZDOHO-FHLIZLRMSA-N 1 3 274.452 3.676 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)CCN1 ZINC000423377879 330198903 /nfs/dbraw/zinc/19/89/03/330198903.db2.gz KPXZYHZAQWMCLB-CSMYWGQOSA-N 1 3 292.854 3.911 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)CCN1 ZINC000423377885 330199064 /nfs/dbraw/zinc/19/90/64/330199064.db2.gz KPXZYHZAQWMCLB-OAUYIBNBSA-N 1 3 292.854 3.911 20 0 CHADHO C[C@H](N[C@@H]1CC[NH2+][C@H](C)C1)c1cccc2ccccc21 ZINC000423381771 330199419 /nfs/dbraw/zinc/19/94/19/330199419.db2.gz OOOFAQMWLFCVLC-IJEWVQPXSA-N 1 3 268.404 3.631 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1cccc2ccccc21 ZINC000423381771 330199421 /nfs/dbraw/zinc/19/94/21/330199421.db2.gz OOOFAQMWLFCVLC-IJEWVQPXSA-N 1 3 268.404 3.631 20 0 CHADHO CCC[C@@H]([NH2+]Cc1ccc2c(c1)CNC2)C(C)(C)C ZINC000423385973 330199784 /nfs/dbraw/zinc/19/97/84/330199784.db2.gz LOTWSYSJYYHURY-MRXNPFEDSA-N 1 3 260.425 3.594 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)N[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000423387373 330200018 /nfs/dbraw/zinc/20/00/18/330200018.db2.gz SBSBFOOAMSLIAH-JZXOWHBKSA-N 1 3 274.452 3.812 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)[NH2+][C@@H]1CCN[C@@H](C)C1 ZINC000423387373 330200020 /nfs/dbraw/zinc/20/00/20/330200020.db2.gz SBSBFOOAMSLIAH-JZXOWHBKSA-N 1 3 274.452 3.812 20 0 CHADHO CC(C)[C@H](CSc1ccccc1)N[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423391106 330200365 /nfs/dbraw/zinc/20/03/65/330200365.db2.gz PIBGTSCQBMEPIE-INMHGKMJSA-N 1 3 292.492 3.663 20 0 CHADHO CC(C)[C@H](CSc1ccccc1)[NH2+][C@@H]1CCC[C@@H](N)C1 ZINC000423391106 330200367 /nfs/dbraw/zinc/20/03/67/330200367.db2.gz PIBGTSCQBMEPIE-INMHGKMJSA-N 1 3 292.492 3.663 20 0 CHADHO FC(F)(F)C1CCC([NH2+]Cc2ccc3c(c2)CNC3)CC1 ZINC000423394322 330200594 /nfs/dbraw/zinc/20/05/94/330200594.db2.gz RELUDKJNVKGXLZ-UHFFFAOYSA-N 1 3 298.352 3.501 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000423395780 330200883 /nfs/dbraw/zinc/20/08/83/330200883.db2.gz NNPGYIZWRAJCSY-XOKHGSTOSA-N 1 3 292.442 3.891 20 0 CHADHO C[C@@H]1C[C@@H](N[C@@H](c2ccccc2)C2CCCC2)CC[NH2+]1 ZINC000423395949 330201039 /nfs/dbraw/zinc/20/10/39/330201039.db2.gz TXAWYDTTXCSTKV-JLSDUUJJSA-N 1 3 272.436 3.648 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2)C2CCCC2)CCN1 ZINC000423395949 330201040 /nfs/dbraw/zinc/20/10/40/330201040.db2.gz TXAWYDTTXCSTKV-JLSDUUJJSA-N 1 3 272.436 3.648 20 0 CHADHO COc1ccccc1-c1ccc([C@H](C)[NH2+][C@@H](C)[C@@H](C)N)cc1 ZINC000423436611 330201409 /nfs/dbraw/zinc/20/14/09/330201409.db2.gz FKHVSCRAOZTZRS-ILXRZTDVSA-N 1 3 298.430 3.749 20 0 CHADHO CC(C)[C@H]([NH2+][C@@H](C)[C@@H](C)N)c1cccc(C(F)(F)F)c1 ZINC000423449449 330202631 /nfs/dbraw/zinc/20/26/31/330202631.db2.gz RMPAAZCJBSOMJZ-SUNKGSAMSA-N 1 3 288.357 3.728 20 0 CHADHO CCC[C@H]([NH2+][C@H](C)[C@H](C)N)c1cccc(C(F)(F)F)c1 ZINC000423451877 330202821 /nfs/dbraw/zinc/20/28/21/330202821.db2.gz VQBVNQTYWMPJNL-WDMOLILDSA-N 1 3 288.357 3.872 20 0 CHADHO CC[C@H]([NH2+][C@H](C)[C@@H](C)N)c1ccc(Cl)c(Cl)c1 ZINC000423454758 330203478 /nfs/dbraw/zinc/20/34/78/330203478.db2.gz ZNQHNWFFUQZVJR-KKFJDGPESA-N 1 3 275.223 3.770 20 0 CHADHO COc1ccc(Cl)cc1[C@H](C)NCCC[C@@H]1CCC[NH2+]1 ZINC000423474812 330205431 /nfs/dbraw/zinc/20/54/31/330205431.db2.gz HNRDPPPTBLLQCC-GXTWGEPZSA-N 1 3 296.842 3.531 20 0 CHADHO C[C@@H](NCCC[C@@H]1CCC[NH2+]1)c1ccc(F)cc1Cl ZINC000423475456 330205731 /nfs/dbraw/zinc/20/57/31/330205731.db2.gz HZHPXPCSJHBGAH-DGCLKSJQSA-N 1 3 284.806 3.662 20 0 CHADHO CC[C@H](N)C[NH2+][C@H](C)c1ccc(-c2cccs2)cc1 ZINC000423484739 330206662 /nfs/dbraw/zinc/20/66/62/330206662.db2.gz YWVLGMQJCRQDQS-DOMZBBRYSA-N 1 3 274.433 3.803 20 0 CHADHO CCC[C@@H]([NH2+]C[C@@H](N)CC)c1ccc(Cl)cc1 ZINC000423486003 330206879 /nfs/dbraw/zinc/20/68/79/330206879.db2.gz ZJBMOBAWOMNXRT-UONOGXRCSA-N 1 3 254.805 3.508 20 0 CHADHO CCc1cccnc1[C@@H](C)N[C@@H](CCC[NH3+])c1ccccc1 ZINC000423525455 330210075 /nfs/dbraw/zinc/21/00/75/330210075.db2.gz YIQPEBQSRGIXKD-QAPCUYQASA-N 1 3 297.446 3.775 20 0 CHADHO C[C@H](N[C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc(F)cc1Cl ZINC000423538726 330210807 /nfs/dbraw/zinc/21/08/07/330210807.db2.gz HABGUHQXBLCKLJ-FMCLSXCISA-N 1 3 296.817 3.518 20 0 CHADHO C[C@@H](NCCC1=CC[NH2+]CC1)c1ccc(-c2ccccc2)o1 ZINC000423544524 330211385 /nfs/dbraw/zinc/21/13/85/330211385.db2.gz WXFTWPLOEVVKPU-OAHLLOKOSA-N 1 3 296.414 3.907 20 0 CHADHO C[C@@H](C[NH2+]CCCN1CCCC[C@@H]1C)c1ccc(F)cc1 ZINC000527116832 330223215 /nfs/dbraw/zinc/22/32/15/330223215.db2.gz LAUAPSUSCLHHEP-HOTGVXAUSA-N 1 3 292.442 3.783 20 0 CHADHO C[C@@H](CNCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(F)cc1 ZINC000527116832 330223216 /nfs/dbraw/zinc/22/32/16/330223216.db2.gz LAUAPSUSCLHHEP-HOTGVXAUSA-N 1 3 292.442 3.783 20 0 CHADHO C[C@@H](CNCCC[N@H+]1CCCC[C@@H]1C)c1ccc(F)cc1 ZINC000527116832 330223217 /nfs/dbraw/zinc/22/32/17/330223217.db2.gz LAUAPSUSCLHHEP-HOTGVXAUSA-N 1 3 292.442 3.783 20 0 CHADHO CN1CC=C(C[NH2+][C@@H]2CCC[C@H](c3ccccc3)CC2)CC1 ZINC000527682511 330271055 /nfs/dbraw/zinc/27/10/55/330271055.db2.gz HJZAHRHFUSROGQ-VQTJNVASSA-N 1 3 298.474 3.954 20 0 CHADHO C[C@@H]1CCC[C@@H](N2CCC([NH2+]CC3CC=CC3)CC2)C1 ZINC000527943374 330294101 /nfs/dbraw/zinc/29/41/01/330294101.db2.gz KCBIMJGDEKXJRE-CRAIPNDOSA-N 1 3 276.468 3.585 20 0 CHADHO CC[C@H](C)[C@@H](C)[NH2+][C@@H](C)c1ccc(OCCN(C)C)cc1 ZINC000536878745 330313371 /nfs/dbraw/zinc/31/33/71/330313371.db2.gz STKSPPQOTGZJLN-XHSDSOJGSA-N 1 3 292.467 3.712 20 0 CHADHO C/C(=C\c1ccc(Cl)cc1)CNC[C@@H]1CCC[N@@H+](C)C1 ZINC000119150036 330371332 /nfs/dbraw/zinc/37/13/32/330371332.db2.gz IFVMATPREAFGIY-DKGMDFAASA-N 1 3 292.854 3.675 20 0 CHADHO C/C(=C\c1ccc(Cl)cc1)CNC[C@@H]1CCC[N@H+](C)C1 ZINC000119150036 330371333 /nfs/dbraw/zinc/37/13/33/330371333.db2.gz IFVMATPREAFGIY-DKGMDFAASA-N 1 3 292.854 3.675 20 0 CHADHO C[NH+](C)CCCN[C@H](c1ccc(F)cc1)C1CCCC1 ZINC000536962099 330373560 /nfs/dbraw/zinc/37/35/60/330373560.db2.gz ASYBYAXKTNCPJJ-KRWDZBQOSA-N 1 3 278.415 3.598 20 0 CHADHO C[C@@H](CNCc1cccc2ccccc21)C[NH+]1CCCC1 ZINC000057993870 330380283 /nfs/dbraw/zinc/38/02/83/330380283.db2.gz PUGUJDAQBQDSTK-INIZCTEOSA-N 1 3 282.431 3.661 20 0 CHADHO C[C@@H](C[NH2+]Cc1cccc2ccccc21)CN1CCCC1 ZINC000057993870 330380284 /nfs/dbraw/zinc/38/02/84/330380284.db2.gz PUGUJDAQBQDSTK-INIZCTEOSA-N 1 3 282.431 3.661 20 0 CHADHO C[C@@H]1CC[C@@H](N[C@@H]2C[C@H](C)[N@@H+](C)C[C@@H]2C)c2ccccc21 ZINC000090796135 330396323 /nfs/dbraw/zinc/39/63/23/330396323.db2.gz WWORSJKFUUTNEC-UJYOZEIHSA-N 1 3 286.463 3.943 20 0 CHADHO C[C@@H]1CC[C@@H](N[C@@H]2C[C@H](C)[N@H+](C)C[C@@H]2C)c2ccccc21 ZINC000090796135 330396324 /nfs/dbraw/zinc/39/63/24/330396324.db2.gz WWORSJKFUUTNEC-UJYOZEIHSA-N 1 3 286.463 3.943 20 0 CHADHO Cc1cc([C@H](C)[NH2+]C2CCN(c3ccncc3)CC2)c(C)o1 ZINC000314913048 330466888 /nfs/dbraw/zinc/46/68/88/330466888.db2.gz IDZGESBIXUNDHX-AWEZNQCLSA-N 1 3 299.418 3.611 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000436315524 330675547 /nfs/dbraw/zinc/67/55/47/330675547.db2.gz PTLYYVSDQLWZBM-FCGDIQPGSA-N 1 3 286.463 3.785 20 0 CHADHO C[C@@H]1CC[C@H](NC[C@H]2CC[N@@H+](C3CC3)C2)c2sccc21 ZINC000453076621 331086898 /nfs/dbraw/zinc/08/68/98/331086898.db2.gz JIVCWDKBTGFLFR-IOASZLSFSA-N 1 3 290.476 3.760 20 0 CHADHO C[C@@H]1CC[C@H](NC[C@H]2CC[N@H+](C3CC3)C2)c2sccc21 ZINC000453076621 331086899 /nfs/dbraw/zinc/08/68/99/331086899.db2.gz JIVCWDKBTGFLFR-IOASZLSFSA-N 1 3 290.476 3.760 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1ccsc1 ZINC000453139561 331093451 /nfs/dbraw/zinc/09/34/51/331093451.db2.gz RSDWXMNENIOIIH-ZNMIVQPWSA-N 1 3 266.454 3.662 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+][C@H](C2CC2)C2CCC2)C1 ZINC000453178868 331097727 /nfs/dbraw/zinc/09/77/27/331097727.db2.gz UFJZRCNPVNRYQE-QAPCUYQASA-N 1 3 278.484 3.523 20 0 CHADHO c1ccc([C@@H]2C[C@H]2C[NH+]2CCC(N3CCCCC3)CC2)cc1 ZINC000459320301 331276090 /nfs/dbraw/zinc/27/60/90/331276090.db2.gz YBWLASFTOOHHDZ-ICSRJNTNSA-N 1 3 298.474 3.740 20 0 CHADHO CC[C@@H](NCC[C@H]1CCC[N@H+](C)C1)c1ccccc1F ZINC000459724240 331295844 /nfs/dbraw/zinc/29/58/44/331295844.db2.gz AKIMHFIXFLXIJE-RHSMWYFYSA-N 1 3 278.415 3.598 20 0 CHADHO CC[C@@H](NCC[C@H]1CCC[N@@H+](C)C1)c1ccccc1F ZINC000459724240 331295845 /nfs/dbraw/zinc/29/58/45/331295845.db2.gz AKIMHFIXFLXIJE-RHSMWYFYSA-N 1 3 278.415 3.598 20 0 CHADHO CC[NH+]1CCC(CCNCc2ccsc2Cl)CC1 ZINC000480343860 331769008 /nfs/dbraw/zinc/76/90/08/331769008.db2.gz OZOACMUKIZWVDM-UHFFFAOYSA-N 1 3 286.872 3.613 20 0 CHADHO CC[C@]1(C)CCN(CCC[N@@H+]2CC[C@](C)(CC)C2)C1 ZINC000489297754 332045867 /nfs/dbraw/zinc/04/58/67/332045867.db2.gz VOXANJWXDKMFNV-CALCHBBNSA-N 1 3 266.473 3.621 20 0 CHADHO CC[C@]1(C)CCN(CCC[N@H+]2CC[C@](C)(CC)C2)C1 ZINC000489297754 332045869 /nfs/dbraw/zinc/04/58/69/332045869.db2.gz VOXANJWXDKMFNV-CALCHBBNSA-N 1 3 266.473 3.621 20 0 CHADHO CC[C@]1(C)CC[N@@H+](CCCN2CC[C@](C)(CC)C2)C1 ZINC000489297754 332045871 /nfs/dbraw/zinc/04/58/71/332045871.db2.gz VOXANJWXDKMFNV-CALCHBBNSA-N 1 3 266.473 3.621 20 0 CHADHO CC[C@]1(C)CC[N@H+](CCCN2CC[C@](C)(CC)C2)C1 ZINC000489297754 332045872 /nfs/dbraw/zinc/04/58/72/332045872.db2.gz VOXANJWXDKMFNV-CALCHBBNSA-N 1 3 266.473 3.621 20 0 CHADHO CC(C)c1ccc2c(c1)[C@@H]([NH2+]CCCN(C)C)CCCO2 ZINC000489548703 332058946 /nfs/dbraw/zinc/05/89/46/332058946.db2.gz GEBQZXWMJRJVEV-KRWDZBQOSA-N 1 3 290.451 3.565 20 0 CHADHO CC(C)(CN[C@H]1C[C@@H]([NH3+])c2ccccc21)C1=CCCC1 ZINC000308771322 333038506 /nfs/dbraw/zinc/03/85/06/333038506.db2.gz SSMDDBHCTHQBNU-SJORKVTESA-N 1 3 270.420 3.857 20 0 CHADHO CC(C)(CN[C@H]1C[C@H]([NH3+])c2ccccc21)C1=CCCC1 ZINC000308771321 333038595 /nfs/dbraw/zinc/03/85/95/333038595.db2.gz SSMDDBHCTHQBNU-IRXDYDNUSA-N 1 3 270.420 3.857 20 0 CHADHO CC[C@H](C)[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000310027205 333052999 /nfs/dbraw/zinc/05/29/99/333052999.db2.gz VWQGKXUOUCKLAC-WMZOPIPTSA-N 1 3 274.452 3.677 20 0 CHADHO CC[NH+](CC)CCCN1CC[C@H](c2ccccc2)[C@H]1C ZINC000514077355 333065023 /nfs/dbraw/zinc/06/50/23/333065023.db2.gz PSZOSIALXXLHOR-AEFFLSMTSA-N 1 3 274.452 3.596 20 0 CHADHO CCN(CC)CCC[N@@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000514077355 333065024 /nfs/dbraw/zinc/06/50/24/333065024.db2.gz PSZOSIALXXLHOR-AEFFLSMTSA-N 1 3 274.452 3.596 20 0 CHADHO CCN(CC)CCC[N@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000514077355 333065026 /nfs/dbraw/zinc/06/50/26/333065026.db2.gz PSZOSIALXXLHOR-AEFFLSMTSA-N 1 3 274.452 3.596 20 0 CHADHO CC(C)[C@@H]1C[C@@H](N[C@H](C)CC[NH+](C)C)c2ccccc21 ZINC000516906722 333085943 /nfs/dbraw/zinc/08/59/43/333085943.db2.gz QEWYSCPVCVPZTI-FHLIZLRMSA-N 1 3 274.452 3.801 20 0 CHADHO C[C@H]1C[C@H](C)C[NH+](CCCCNCc2ccc(Cl)o2)C1 ZINC000517537118 333101626 /nfs/dbraw/zinc/10/16/26/333101626.db2.gz FKSMCXHHWXDCNT-KBPBESRZSA-N 1 3 298.858 3.781 20 0 CHADHO CC[C@H](C)[C@H](C)[NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000183186609 333119280 /nfs/dbraw/zinc/11/92/80/333119280.db2.gz SRSNCUSBUFXBTA-YHUYYLMFSA-N 1 3 266.473 3.664 20 0 CHADHO C[C@@H]1CCCc2ccccc2[C@@H]1N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000184954243 333133581 /nfs/dbraw/zinc/13/35/81/333133581.db2.gz FRBTUEWMQXWMNC-DLVXIWMQSA-N 1 3 298.474 3.917 20 0 CHADHO C[C@@H]1CCCc2ccccc2[C@@H]1N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000184954243 333133583 /nfs/dbraw/zinc/13/35/83/333133583.db2.gz FRBTUEWMQXWMNC-DLVXIWMQSA-N 1 3 298.474 3.917 20 0 CHADHO CCCc1cccc(C[NH2+]C2CCN(CC3CC3)CC2)c1 ZINC000187133522 333168053 /nfs/dbraw/zinc/16/80/53/333168053.db2.gz SWRSZJQGKRWEMS-UHFFFAOYSA-N 1 3 286.463 3.603 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000226918433 333272217 /nfs/dbraw/zinc/27/22/17/333272217.db2.gz IVXJPYJDGXAGGP-DYVFJYSZSA-N 1 3 292.854 3.723 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000226918433 333272219 /nfs/dbraw/zinc/27/22/19/333272219.db2.gz IVXJPYJDGXAGGP-DYVFJYSZSA-N 1 3 292.854 3.723 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000226918433 333272220 /nfs/dbraw/zinc/27/22/20/333272220.db2.gz IVXJPYJDGXAGGP-DYVFJYSZSA-N 1 3 292.854 3.723 20 0 CHADHO C[C@@H](c1ccccc1F)N1CCC(C[NH+]2CCCC2)CC1 ZINC000194740668 333276963 /nfs/dbraw/zinc/27/69/63/333276963.db2.gz POLBPPPUXOWCSE-HNNXBMFYSA-N 1 3 290.426 3.695 20 0 CHADHO Cc1ccc(C2CC(NCCC[N@@H+](C)C(C)C)C2)cc1 ZINC000228812927 333297181 /nfs/dbraw/zinc/29/71/81/333297181.db2.gz FPLNCZKOZUNXDG-UHFFFAOYSA-N 1 3 274.452 3.561 20 0 CHADHO Cc1ccc(C2CC(NCCC[N@H+](C)C(C)C)C2)cc1 ZINC000228812927 333297183 /nfs/dbraw/zinc/29/71/83/333297183.db2.gz FPLNCZKOZUNXDG-UHFFFAOYSA-N 1 3 274.452 3.561 20 0 CHADHO Cc1ccc(C2CC([NH2+]CCCN(C)C(C)C)C2)cc1 ZINC000228812927 333297185 /nfs/dbraw/zinc/29/71/85/333297185.db2.gz FPLNCZKOZUNXDG-UHFFFAOYSA-N 1 3 274.452 3.561 20 0 CHADHO CC1=C[C@H](C)C[C@H](C[NH2+]C2CC(C)(C)NC(C)(C)C2)C1 ZINC000235370778 333368767 /nfs/dbraw/zinc/36/87/67/333368767.db2.gz KBIZBMLAIHHBHM-ZFWWWQNUSA-N 1 3 278.484 3.878 20 0 CHADHO C[C@@H]1CCC[C@@H]([NH2+]C2CCN(c3ccncc3)CC2)CC1 ZINC000235410396 333369340 /nfs/dbraw/zinc/36/93/40/333369340.db2.gz PMLBMEFQNOKXPY-HZPDHXFCSA-N 1 3 287.451 3.609 20 0 CHADHO CCN1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3)cc2)C1 ZINC000236826740 333375795 /nfs/dbraw/zinc/37/57/95/333375795.db2.gz OWPYJRLALMOWTN-GOSISDBHSA-N 1 3 294.442 3.785 20 0 CHADHO CN(CCc1ccc2ccccc2c1)C[C@H]1CCC[N@H+](C)C1 ZINC000525002656 333394957 /nfs/dbraw/zinc/39/49/57/333394957.db2.gz AIXKTTLZXOHXJT-SFHVURJKSA-N 1 3 296.458 3.656 20 0 CHADHO CN(CCc1ccc2ccccc2c1)C[C@H]1CCC[N@@H+](C)C1 ZINC000525002656 333394958 /nfs/dbraw/zinc/39/49/58/333394958.db2.gz AIXKTTLZXOHXJT-SFHVURJKSA-N 1 3 296.458 3.656 20 0 CHADHO CC[NH+]1CCC(CCNCc2ccc([C@@H]3C[C@@H]3C)o2)CC1 ZINC000174551764 335158621 /nfs/dbraw/zinc/15/86/21/335158621.db2.gz CJLUQDQKMVRIDI-WMLDXEAASA-N 1 3 290.451 3.615 20 0 CHADHO C[C@H](NCCC1CC[NH+](C)CC1)c1ccccc1Cl ZINC000135733061 334137296 /nfs/dbraw/zinc/13/72/96/334137296.db2.gz OBGOGUPMNLWQKK-ZDUSSCGKSA-N 1 3 280.843 3.723 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H](C)c2cc(C)cc(C)c2)C1 ZINC000246928640 334272251 /nfs/dbraw/zinc/27/22/51/334272251.db2.gz HATKHDMJRKQFNL-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H](C)c2cc(C)cc(C)c2)C1 ZINC000246928640 334272253 /nfs/dbraw/zinc/27/22/53/334272253.db2.gz HATKHDMJRKQFNL-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](C)c2cc(C)cc(C)c2)C1 ZINC000246928640 334272255 /nfs/dbraw/zinc/27/22/55/334272255.db2.gz HATKHDMJRKQFNL-IAGOWNOFSA-N 1 3 274.452 3.686 20 0 CHADHO C[C@@H](NCCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccoc1 ZINC000246995454 334273481 /nfs/dbraw/zinc/27/34/81/334273481.db2.gz KJCQGVYRYRLZBK-OWCLPIDISA-N 1 3 278.440 3.688 20 0 CHADHO C[C@@H](NCCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccoc1 ZINC000246995454 334273483 /nfs/dbraw/zinc/27/34/83/334273483.db2.gz KJCQGVYRYRLZBK-OWCLPIDISA-N 1 3 278.440 3.688 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@H](c2ccccc2)C(C)C)C1 ZINC000246013530 334227923 /nfs/dbraw/zinc/22/79/23/334227923.db2.gz KOWXAGZKQLBOGK-WMZOPIPTSA-N 1 3 274.452 3.705 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@H](c2ccccc2)C(C)C)C1 ZINC000246013530 334227924 /nfs/dbraw/zinc/22/79/24/334227924.db2.gz KOWXAGZKQLBOGK-WMZOPIPTSA-N 1 3 274.452 3.705 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](c2ccccc2)C(C)C)C1 ZINC000246013530 334227925 /nfs/dbraw/zinc/22/79/25/334227925.db2.gz KOWXAGZKQLBOGK-WMZOPIPTSA-N 1 3 274.452 3.705 20 0 CHADHO CCc1cccnc1[C@H](C)NCCCCC[NH+]1CCCC1 ZINC000551262999 334243374 /nfs/dbraw/zinc/24/33/74/334243374.db2.gz KENHLIVBBFAENV-INIZCTEOSA-N 1 3 289.467 3.561 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@H](C)c2cccc(C)c2C)C1 ZINC000247196182 334277461 /nfs/dbraw/zinc/27/74/61/334277461.db2.gz WBFDNUFEZKKSKL-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@H](C)c2cccc(C)c2C)C1 ZINC000247196182 334277463 /nfs/dbraw/zinc/27/74/63/334277463.db2.gz WBFDNUFEZKKSKL-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](C)c2cccc(C)c2C)C1 ZINC000247196182 334277464 /nfs/dbraw/zinc/27/74/64/334277464.db2.gz WBFDNUFEZKKSKL-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](C)c2ccc(CC)s2)C1 ZINC000247228446 334277700 /nfs/dbraw/zinc/27/77/00/334277700.db2.gz YDANFCZREMPYLR-KGLIPLIRSA-N 1 3 280.481 3.693 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](c2ccc(C)cc2)C2CCC2)C1 ZINC000249838356 334341049 /nfs/dbraw/zinc/34/10/49/334341049.db2.gz FRANYLXMAQJEJF-LPHOPBHVSA-N 1 3 286.463 3.768 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](c2ccc(C)cc2)C2CCC2)C1 ZINC000249838356 334341051 /nfs/dbraw/zinc/34/10/51/334341051.db2.gz FRANYLXMAQJEJF-LPHOPBHVSA-N 1 3 286.463 3.768 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](c2ccc(C)cc2)C2CCC2)C1 ZINC000249838356 334341053 /nfs/dbraw/zinc/34/10/53/334341053.db2.gz FRANYLXMAQJEJF-LPHOPBHVSA-N 1 3 286.463 3.768 20 0 CHADHO CC(C)(CN[C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1)c1cccs1 ZINC000250693702 334348758 /nfs/dbraw/zinc/34/87/58/334348758.db2.gz NQJGNELQOXSAPI-RBSFLKMASA-N 1 3 292.492 3.536 20 0 CHADHO CC[C@@H](NCc1ccc(C[NH3+])cc1)c1ccc(F)cc1 ZINC000566245199 334638194 /nfs/dbraw/zinc/63/81/94/334638194.db2.gz KLCMGAQEZGJZKN-QGZVFWFLSA-N 1 3 272.367 3.525 20 0 CHADHO CC(C)[C@@H]([NH2+]C1CCN(C2CCCCC2)CC1)C1CC1 ZINC000157553953 334775344 /nfs/dbraw/zinc/77/53/44/334775344.db2.gz DWATWGDRHMUFNZ-GOSISDBHSA-N 1 3 278.484 3.808 20 0 CHADHO CC[C@H]([NH2+]C1CCN(C2CCCCC2)CC1)C1CC1 ZINC000157553029 334775363 /nfs/dbraw/zinc/77/53/63/334775363.db2.gz MZGFAYOKFPWLDZ-KRWDZBQOSA-N 1 3 264.457 3.562 20 0 CHADHO CC1=C[C@H](C)C[C@H](C[N@@H+]2CC[C@H](C3CCN(C)CC3)C2)C1 ZINC000576438592 335203359 /nfs/dbraw/zinc/20/33/59/335203359.db2.gz RZEAGSXFMMUSNS-IEZWGBDMSA-N 1 3 290.495 3.643 20 0 CHADHO CC1=C[C@H](C)C[C@H](C[N@H+]2CC[C@H](C3CCN(C)CC3)C2)C1 ZINC000576438592 335203361 /nfs/dbraw/zinc/20/33/61/335203361.db2.gz RZEAGSXFMMUSNS-IEZWGBDMSA-N 1 3 290.495 3.643 20 0 CHADHO CCCOc1ccc(CNCc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000579087356 335707539 /nfs/dbraw/zinc/70/75/39/335707539.db2.gz UVNLEKHLZXVLCD-HNNXBMFYSA-N 1 3 298.430 3.785 20 0 CHADHO CCC[C@@H](CC)[NH2+][C@@H](C)c1cccc(OCCN(C)C)c1 ZINC000581268166 336034870 /nfs/dbraw/zinc/03/48/70/336034870.db2.gz SZZVLNWGEQFYRX-DOTOQJQBSA-N 1 3 292.467 3.856 20 0 CHADHO CC[C@@H](NCC1CC[NH+](CC)CC1)c1cc(F)ccc1F ZINC000581583203 336106169 /nfs/dbraw/zinc/10/61/69/336106169.db2.gz WONJZNZPTXQFSH-QGZVFWFLSA-N 1 3 296.405 3.737 20 0 CHADHO C[C@H](CC(C)(C)C)[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCCN1 ZINC000384682121 336129179 /nfs/dbraw/zinc/12/91/79/336129179.db2.gz UQEAOUUYLDWFMH-FXUDXRNXSA-N 1 3 266.473 3.712 20 0 CHADHO C[NH+](C)CCCC(C)(C)NCc1cc(Cl)ccc1F ZINC000387327879 336192285 /nfs/dbraw/zinc/19/22/85/336192285.db2.gz OAPTZGDLOWJLQV-UHFFFAOYSA-N 1 3 286.822 3.689 20 0 CHADHO Cc1cc2cc(CN3CCC([C@H](C)[NH3+])CC3)oc2cc1C ZINC000347111814 534085453 /nfs/dbraw/zinc/08/54/53/534085453.db2.gz PXPNRMYIDCCQJT-AWEZNQCLSA-N 1 3 286.419 3.609 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CCC[C@@H]([C@@H](C)[NH3+])C2)cc1 ZINC000226330969 519839914 /nfs/dbraw/zinc/83/99/14/519839914.db2.gz PMZCRRSZHVWILH-RVKKMQEKSA-N 1 3 274.452 3.930 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N[C@@H](C)c1ccc(C)o1 ZINC000019915074 520630657 /nfs/dbraw/zinc/63/06/57/520630657.db2.gz IOZYKTZJERQTRY-HIFRSBDPSA-N 1 3 266.429 3.749 20 0 CHADHO CCN1CC[C@@H]([N@H+](C)Cc2cnc3ccccc3c2)C[C@H]1C ZINC000337133575 521713618 /nfs/dbraw/zinc/71/36/18/521713618.db2.gz AZFCAPFYUQYMER-CRAIPNDOSA-N 1 3 297.446 3.539 20 0 CHADHO CCN1CC[C@@H]([N@@H+](C)Cc2cnc3ccccc3c2)C[C@H]1C ZINC000337133575 521713619 /nfs/dbraw/zinc/71/36/19/521713619.db2.gz AZFCAPFYUQYMER-CRAIPNDOSA-N 1 3 297.446 3.539 20 0 CHADHO C[C@@H]1C[C@@H](NCc2ccc(C3CCC3)cc2)CC[N@@H+]1C ZINC000277285116 525269408 /nfs/dbraw/zinc/26/94/08/525269408.db2.gz SXKRIDXUQYEIAK-KDOFPFPSSA-N 1 3 272.436 3.526 20 0 CHADHO C[C@@H]1C[C@@H](NCc2ccc(C3CCC3)cc2)CC[N@H+]1C ZINC000277285116 525269418 /nfs/dbraw/zinc/26/94/18/525269418.db2.gz SXKRIDXUQYEIAK-KDOFPFPSSA-N 1 3 272.436 3.526 20 0 CHADHO C[C@@H](NCC1(C)CC[NH+](C)CC1)c1ccc2ccccc2n1 ZINC000272606434 525419645 /nfs/dbraw/zinc/41/96/45/525419645.db2.gz VGXQANDKWXRWLI-OAHLLOKOSA-N 1 3 297.446 3.617 20 0 CHADHO CSc1ccc(C[NH2+]C2CCN(C(C)(C)C)CC2)cc1 ZINC000037786516 526002541 /nfs/dbraw/zinc/00/25/41/526002541.db2.gz HGXJBBSHYTWDPK-UHFFFAOYSA-N 1 3 292.492 3.761 20 0 CHADHO c1ccc2c(c1)CCCC[C@H]2NC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000037649278 526502169 /nfs/dbraw/zinc/50/21/69/526502169.db2.gz VUVJMDHBDMLYCS-DNVCBOLYSA-N 1 3 284.447 3.528 20 0 CHADHO c1ccc2c(c1)CCCC[C@H]2NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000037649278 526502174 /nfs/dbraw/zinc/50/21/74/526502174.db2.gz VUVJMDHBDMLYCS-DNVCBOLYSA-N 1 3 284.447 3.528 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NCCc2ccc(Cl)cc2)c2ccccc21 ZINC000157263686 527375768 /nfs/dbraw/zinc/37/57/68/527375768.db2.gz ZSRFUSKSVXTSEQ-IAGOWNOFSA-N 1 3 286.806 3.617 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2cccc3cccnc32)C[C@@H]1C ZINC000353746945 527834440 /nfs/dbraw/zinc/83/44/40/527834440.db2.gz LXSSLXJKRPCUDC-YJBOKZPZSA-N 1 3 297.446 3.539 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2cccc3cccnc32)C[C@@H]1C ZINC000353746945 527834442 /nfs/dbraw/zinc/83/44/42/527834442.db2.gz LXSSLXJKRPCUDC-YJBOKZPZSA-N 1 3 297.446 3.539 20 0 CHADHO CCSc1ccccc1[C@@H](C)NCC1=CC[N@H+](C)CC1 ZINC000344302024 529257337 /nfs/dbraw/zinc/25/73/37/529257337.db2.gz SGKJYZJGLCMNSH-CQSZACIVSA-N 1 3 290.476 3.711 20 0 CHADHO CCSc1ccccc1[C@@H](C)NCC1=CC[N@@H+](C)CC1 ZINC000344302024 529257340 /nfs/dbraw/zinc/25/73/40/529257340.db2.gz SGKJYZJGLCMNSH-CQSZACIVSA-N 1 3 290.476 3.711 20 0 CHADHO CC[C@@H]1CCC[C@H]([NH2+]C[C@H](C)CN2CCCC2)CC1 ZINC000251689231 1125484279 /nfs/dbraw/zinc/48/42/79/1125484279.db2.gz IHPZDZHBKSCHFX-BBWFWOEESA-N 1 3 266.473 3.667 20 0 CHADHO CC(C)(C)[C@H](N[C@@H]1CCC[NH2+]CC1)c1ccc(F)cc1 ZINC000133707830 1125485601 /nfs/dbraw/zinc/48/56/01/1125485601.db2.gz WLLMIFQYWJMMSC-HZPDHXFCSA-N 1 3 278.415 3.645 20 0 CHADHO CC[NH+](CC)Cc1cccc(CN[C@H](C)c2cccnc2)c1 ZINC000112531579 1125487565 /nfs/dbraw/zinc/48/75/65/1125487565.db2.gz KDXMSBTXMDXMJQ-MRXNPFEDSA-N 1 3 297.446 3.774 20 0 CHADHO CC[NH+]1CCC(CCN[C@@H](C)c2nc(C)sc2C)CC1 ZINC000676493321 1121436724 /nfs/dbraw/zinc/43/67/24/1121436724.db2.gz VSZBPPVNUQFVFW-LBPRGKRZSA-N 1 3 295.496 3.533 20 0 CHADHO C[C@@H]([NH2+]C[C@H](C)CN(C)C)c1cccc(C(F)(F)F)c1 ZINC000380522666 1123123598 /nfs/dbraw/zinc/12/35/98/1123123598.db2.gz CGEJPEMNFFPTLK-NWDGAFQWSA-N 1 3 288.357 3.554 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1CCC(C)(C)C ZINC001202096767 1123175530 /nfs/dbraw/zinc/17/55/30/1123175530.db2.gz ROSXROUIPYGBEB-HOTGVXAUSA-N 1 3 266.473 3.761 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@H+]1CCC(C)(C)C ZINC001202096767 1123175533 /nfs/dbraw/zinc/17/55/33/1123175533.db2.gz ROSXROUIPYGBEB-HOTGVXAUSA-N 1 3 266.473 3.761 20 0 CHADHO CC(C)c1nc([C@H](C)NC2CCC([NH+](C)C)CC2)cs1 ZINC000428458271 1124127627 /nfs/dbraw/zinc/12/76/27/1124127627.db2.gz YCXLVWNXSWILIV-HSBZDZAISA-N 1 3 295.496 3.790 20 0 CHADHO CCCCC(CCCC)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246335060 1131475337 /nfs/dbraw/zinc/47/53/37/1131475337.db2.gz WXXGZXCNGQVVFO-FVQHAEBGSA-N 1 3 266.473 3.998 20 0 CHADHO CCCC[C@@H]1C[C@@H]([N@@H+](C)CC2CCCCC2)CCN1 ZINC001246843477 1131789388 /nfs/dbraw/zinc/78/93/88/1131789388.db2.gz CPGDQZZKGHKDLV-SJORKVTESA-N 1 3 266.473 3.809 20 0 CHADHO CC[C@@H](CC(C)C)[NH+]1CCC(C)(N2CCCC2)CC1 ZINC001172405145 1132196590 /nfs/dbraw/zinc/19/65/90/1132196590.db2.gz SQKAEZFHHZIDDS-INIZCTEOSA-N 1 3 266.473 3.761 20 0 CHADHO C[C@@H](NCCCC[N@@H+]1CCCC[C@@H]1C)c1ccco1 ZINC000247167179 1125654189 /nfs/dbraw/zinc/65/41/89/1125654189.db2.gz ULWIRZDMIORSBA-LSDHHAIUSA-N 1 3 264.413 3.585 20 0 CHADHO C[C@@H](NCCCC[N@H+]1CCCC[C@@H]1C)c1ccco1 ZINC000247167179 1125654193 /nfs/dbraw/zinc/65/41/93/1125654193.db2.gz ULWIRZDMIORSBA-LSDHHAIUSA-N 1 3 264.413 3.585 20 0 CHADHO CN1CCCC[C@H]1CC[N@H+](C)Cc1cccc2cccnc21 ZINC000075860333 1125657818 /nfs/dbraw/zinc/65/78/18/1125657818.db2.gz GLMTUJJPWXAUQO-SFHVURJKSA-N 1 3 297.446 3.541 20 0 CHADHO CN1CCCC[C@H]1CC[N@@H+](C)Cc1cccc2cccnc21 ZINC000075860333 1125657822 /nfs/dbraw/zinc/65/78/22/1125657822.db2.gz GLMTUJJPWXAUQO-SFHVURJKSA-N 1 3 297.446 3.541 20 0 CHADHO C[C@@H]1CC[N@H+](CC[C@@H]2CCCN2C)[C@@H](c2ccco2)C1 ZINC000248142927 1125662927 /nfs/dbraw/zinc/66/29/27/1125662927.db2.gz ZADSIBSGUHAVKF-OWCLPIDISA-N 1 3 276.424 3.537 20 0 CHADHO C[C@@H]1CC[N@@H+](CC[C@@H]2CCCN2C)[C@@H](c2ccco2)C1 ZINC000248142927 1125662931 /nfs/dbraw/zinc/66/29/31/1125662931.db2.gz ZADSIBSGUHAVKF-OWCLPIDISA-N 1 3 276.424 3.537 20 0 CHADHO CCC[NH+]1CCC(N[C@H](C)c2cc3c(s2)CCC3)CC1 ZINC000161623886 1125707481 /nfs/dbraw/zinc/70/74/81/1125707481.db2.gz PVZXFSNJIHFYJG-CYBMUJFWSA-N 1 3 292.492 3.762 20 0 CHADHO CC(C)[N@H+](C)Cc1cccc(CN[C@H](C)c2cccnc2)c1 ZINC000092741813 1125761397 /nfs/dbraw/zinc/76/13/97/1125761397.db2.gz UDBYOTMAHDXFSE-MRXNPFEDSA-N 1 3 297.446 3.773 20 0 CHADHO CC(C)[N@@H+](C)Cc1cccc(CN[C@H](C)c2cccnc2)c1 ZINC000092741813 1125761402 /nfs/dbraw/zinc/76/14/02/1125761402.db2.gz UDBYOTMAHDXFSE-MRXNPFEDSA-N 1 3 297.446 3.773 20 0 CHADHO C/C(=C\c1ccccc1)CNC1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000174600841 1126772289 /nfs/dbraw/zinc/77/22/89/1126772289.db2.gz VLADPYQPTWSQAP-MBPVEPFQSA-N 1 3 284.447 3.695 20 0 CHADHO C/C(=C\c1ccccc1)CNC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000174600841 1126772292 /nfs/dbraw/zinc/77/22/92/1126772292.db2.gz VLADPYQPTWSQAP-MBPVEPFQSA-N 1 3 284.447 3.695 20 0 CHADHO CC1CC[NH+](Cc2ccc(CNCc3cc[nH]c3)cc2)CC1 ZINC000175695645 1126784926 /nfs/dbraw/zinc/78/49/26/1126784926.db2.gz ZLTRJNOVIKKARE-UHFFFAOYSA-N 1 3 297.446 3.536 20 0 CHADHO C[C@@H](NCc1cccc(C[NH+](C)C)c1)c1ccsc1 ZINC000177733827 1126804564 /nfs/dbraw/zinc/80/45/64/1126804564.db2.gz PDQYLWRATOXZAX-CYBMUJFWSA-N 1 3 274.433 3.661 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CC(C)(C)c3ccccc32)C1 ZINC000484463585 1126817652 /nfs/dbraw/zinc/81/76/52/1126817652.db2.gz ADRGNEDOSVGTKW-HDMKZQKVSA-N 1 3 286.463 3.871 20 0 CHADHO C[C@@H](NC1CC(C[NH3+])C1)c1cc(Cl)cc(Cl)c1F ZINC000904389811 1126851167 /nfs/dbraw/zinc/85/11/67/1126851167.db2.gz VSPGWUKUDDZTET-ZNFPMYQNSA-N 1 3 291.197 3.520 20 0 CHADHO CC[C@@H]([NH2+]C1CCN(CC2CC2)CC1)c1cccc(F)c1 ZINC000187798230 1126915078 /nfs/dbraw/zinc/91/50/78/1126915078.db2.gz GCCBMHWNGMTCSU-GOSISDBHSA-N 1 3 290.426 3.741 20 0 CHADHO CCC[C@@H](NC1CC[NH+](C2CC2)CC1)c1ccsc1 ZINC000191190519 1126949233 /nfs/dbraw/zinc/94/92/33/1126949233.db2.gz RPUDNZWKBFGYEB-MRXNPFEDSA-N 1 3 278.465 3.806 20 0 CHADHO Cc1ccc2c(c1)[C@H](NC1C[C@H]3CC[C@@H](C1)[N@H+]3C)CCC2 ZINC000193060669 1126965803 /nfs/dbraw/zinc/96/58/03/1126965803.db2.gz QNLAMVSBSRTBSE-RGPMPMONSA-N 1 3 284.447 3.587 20 0 CHADHO Cc1ccc2c(c1)[C@H](NC1C[C@H]3CC[C@@H](C1)[N@@H+]3C)CCC2 ZINC000193060669 1126965805 /nfs/dbraw/zinc/96/58/05/1126965805.db2.gz QNLAMVSBSRTBSE-RGPMPMONSA-N 1 3 284.447 3.587 20 0 CHADHO CCC(CC)N1CCC([NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170730657 1130834727 /nfs/dbraw/zinc/83/47/27/1130834727.db2.gz KTXIXJLBULWFHX-ACHSLPGTSA-N 1 3 278.484 3.664 20 0 CHADHO Cc1cccnc1[C@H]([NH2+]CC[C@@H]1CCCCN1C)C(C)C ZINC000268098208 1127011627 /nfs/dbraw/zinc/01/16/27/1127011627.db2.gz KDRVOOSMYALLOP-DLBZAZTESA-N 1 3 289.467 3.551 20 0 CHADHO c1ccc2c(c1)CCC[C@H]2NC1CC[NH+](C2CCC2)CC1 ZINC000269012565 1127032454 /nfs/dbraw/zinc/03/24/54/1127032454.db2.gz NXBVBEUIJMHEAS-LJQANCHMSA-N 1 3 284.447 3.671 20 0 CHADHO CCN(CCC[NH+](C)C)Cc1cccc2sccc21 ZINC001236681887 1130992815 /nfs/dbraw/zinc/99/28/15/1130992815.db2.gz IUYWUCHHUQDBQB-UHFFFAOYSA-N 1 3 276.449 3.675 20 0 CHADHO CCCCN1CCC([NH2+][C@H](C)c2ccnc(Cl)c2)CC1 ZINC000164480725 1127168082 /nfs/dbraw/zinc/16/80/82/1127168082.db2.gz ODWNGIVEEZQERV-CYBMUJFWSA-N 1 3 295.858 3.650 20 0 CHADHO COc1ccc([C@H](CCC(C)C)NCCC[NH+](C)C)cc1 ZINC000359378381 1127460797 /nfs/dbraw/zinc/46/07/97/1127460797.db2.gz LHZHVOGOMMQWEM-SFHVURJKSA-N 1 3 292.467 3.714 20 0 CHADHO Cc1cccnc1[C@H](N[C@@H]1C[C@@H]([NH3+])CC(C)(C)C1)C(C)C ZINC000925497808 1127486341 /nfs/dbraw/zinc/48/63/41/1127486341.db2.gz KESCINGYQRGVJT-BZUAXINKSA-N 1 3 289.467 3.583 20 0 CHADHO CC[C@@H](NC[C@H](CC)[NH+]1CCCC1)c1ccc(OC)cc1 ZINC000360089450 1127489369 /nfs/dbraw/zinc/48/93/69/1127489369.db2.gz UANNJFSODIPWHW-FUHWJXTLSA-N 1 3 290.451 3.610 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCCc3sccc32)C1 ZINC000361966943 1127602919 /nfs/dbraw/zinc/60/29/19/1127602919.db2.gz HNZPQPQBEUVERJ-GUTXKFCHSA-N 1 3 278.465 3.588 20 0 CHADHO C[C@H](CCc1ccccc1)N1CCC2(CCC[N@@H+]2C)CC1 ZINC000368612401 1127758643 /nfs/dbraw/zinc/75/86/43/1127758643.db2.gz KLEGCTCTNMVBQP-QGZVFWFLSA-N 1 3 286.463 3.568 20 0 CHADHO C[C@H](CCc1ccccc1)N1CCC2(CCC[N@H+]2C)CC1 ZINC000368612401 1127758645 /nfs/dbraw/zinc/75/86/45/1127758645.db2.gz KLEGCTCTNMVBQP-QGZVFWFLSA-N 1 3 286.463 3.568 20 0 CHADHO C[C@H](CCc1ccccc1)[NH+]1CCC2(CCCN2C)CC1 ZINC000368612401 1127758646 /nfs/dbraw/zinc/75/86/46/1127758646.db2.gz KLEGCTCTNMVBQP-QGZVFWFLSA-N 1 3 286.463 3.568 20 0 CHADHO CC(C)[NH2+]C1CCN(C[C@H]2CCCC(C)(C)C2)CC1 ZINC000539816431 1127942480 /nfs/dbraw/zinc/94/24/80/1127942480.db2.gz VCCHEWCSWRGWQJ-HNNXBMFYSA-N 1 3 266.473 3.665 20 0 CHADHO Cc1cc(C)cc(C2=CC[N@H+](CC[C@@H]3CCCN3C)CC2)c1 ZINC000539884846 1127951526 /nfs/dbraw/zinc/95/15/26/1127951526.db2.gz FJRLRFQPZJDYDE-FQEVSTJZSA-N 1 3 298.474 3.877 20 0 CHADHO Cc1cc(C)cc(C2=CC[N@@H+](CC[C@@H]3CCCN3C)CC2)c1 ZINC000539884846 1127951529 /nfs/dbraw/zinc/95/15/29/1127951529.db2.gz FJRLRFQPZJDYDE-FQEVSTJZSA-N 1 3 298.474 3.877 20 0 CHADHO C[C@@H](C[NH2+][C@H]1C[C@H](C)C[C@H](C)C1)CN1CCCCC1 ZINC000252137700 1127956335 /nfs/dbraw/zinc/95/63/35/1127956335.db2.gz MTBHSBFWTYXUQG-VVLHAWIVSA-N 1 3 266.473 3.523 20 0 CHADHO CCC(CC)(CC)C[N@@H+]1CC[C@H]2[C@@H](CCCN2C)C1 ZINC000542018888 1128047974 /nfs/dbraw/zinc/04/79/74/1128047974.db2.gz GCGFHGMHGZTTIG-HOTGVXAUSA-N 1 3 266.473 3.619 20 0 CHADHO CCC(CC)(CC)C[N@H+]1CC[C@H]2[C@@H](CCCN2C)C1 ZINC000542018888 1128047979 /nfs/dbraw/zinc/04/79/79/1128047979.db2.gz GCGFHGMHGZTTIG-HOTGVXAUSA-N 1 3 266.473 3.619 20 0 CHADHO CCC(CC)(CC)C[N@@H+]1CC[C@@H]2[C@@H](CCCN2C)C1 ZINC000542018890 1128048016 /nfs/dbraw/zinc/04/80/16/1128048016.db2.gz GCGFHGMHGZTTIG-JKSUJKDBSA-N 1 3 266.473 3.619 20 0 CHADHO CCC(CC)(CC)C[N@H+]1CC[C@@H]2[C@@H](CCCN2C)C1 ZINC000542018890 1128048021 /nfs/dbraw/zinc/04/80/21/1128048021.db2.gz GCGFHGMHGZTTIG-JKSUJKDBSA-N 1 3 266.473 3.619 20 0 CHADHO c1ccc([C@H]2CCCCC[N@H+]2C[C@@H]2CCCNC2)cc1 ZINC000469873125 1128056555 /nfs/dbraw/zinc/05/65/55/1128056555.db2.gz XUBQYIKVWGDMCM-SJLPKXTDSA-N 1 3 272.436 3.603 20 0 CHADHO c1ccc([C@H]2CCCCC[N@@H+]2C[C@@H]2CCCNC2)cc1 ZINC000469873125 1128056560 /nfs/dbraw/zinc/05/65/60/1128056560.db2.gz XUBQYIKVWGDMCM-SJLPKXTDSA-N 1 3 272.436 3.603 20 0 CHADHO CC(C)c1ccc(CCN[C@@H]2CC[N@@H+]3CCCC[C@@H]23)cc1 ZINC000470103638 1128063322 /nfs/dbraw/zinc/06/33/22/1128063322.db2.gz GXGBBELPGMIIQX-MOPGFXCFSA-N 1 3 286.463 3.569 20 0 CHADHO CC(C)c1ccc(CCN[C@@H]2CC[N@H+]3CCCC[C@@H]23)cc1 ZINC000470103638 1128063325 /nfs/dbraw/zinc/06/33/25/1128063325.db2.gz GXGBBELPGMIIQX-MOPGFXCFSA-N 1 3 286.463 3.569 20 0 CHADHO C[N@H+](CC1CC1)C[C@H]1CCN([C@@H]2CCCc3ccccc32)C1 ZINC000470976420 1128083866 /nfs/dbraw/zinc/08/38/66/1128083866.db2.gz KGMIQHSVJMXIDI-YLJYHZDGSA-N 1 3 298.474 3.728 20 0 CHADHO C[N@@H+](CC1CC1)C[C@H]1CCN([C@@H]2CCCc3ccccc32)C1 ZINC000470976420 1128083871 /nfs/dbraw/zinc/08/38/71/1128083871.db2.gz KGMIQHSVJMXIDI-YLJYHZDGSA-N 1 3 298.474 3.728 20 0 CHADHO CCC[C@@H](CC)[NH2+]C1CCN(C[C@@H]2CC=CCC2)CC1 ZINC001257254299 1128098586 /nfs/dbraw/zinc/09/85/86/1128098586.db2.gz PCYKPBDXFZQGLE-IAGOWNOFSA-N 1 3 278.484 3.975 20 0 CHADHO C[C@@H](N[C@@H](C)c1cccnc1)c1cccc(C[NH+](C)C)c1 ZINC000924565007 1128105239 /nfs/dbraw/zinc/10/52/39/1128105239.db2.gz QVFQALKEHRMISB-CABCVRRESA-N 1 3 283.419 3.555 20 0 CHADHO CC(C)=C1CC[C@@H](C)C[C@@H]1N[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000924694767 1128109885 /nfs/dbraw/zinc/10/98/85/1128109885.db2.gz GYWFSAALJSSJLU-HPFXQQBRSA-N 1 3 276.468 3.728 20 0 CHADHO CC(C)=C1CC[C@@H](C)C[C@@H]1N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000924694767 1128109886 /nfs/dbraw/zinc/10/98/86/1128109886.db2.gz GYWFSAALJSSJLU-HPFXQQBRSA-N 1 3 276.468 3.728 20 0 CHADHO c1ccc([C@H]2C[C@@H]2C[NH2+][C@@H]2CCNC[C@@H]2C2CCCC2)cc1 ZINC000925712312 1128137889 /nfs/dbraw/zinc/13/78/89/1128137889.db2.gz OOIRIOUELURISR-UAFMIMERSA-N 1 3 298.474 3.548 20 0 CHADHO CCC1([NH3+])CCN([C@H]2CC[C@@H](C)c3ccsc32)CC1 ZINC000925760802 1128140868 /nfs/dbraw/zinc/14/08/68/1128140868.db2.gz SESDNGUBTJNLMM-OCCSQVGLSA-N 1 3 278.465 3.890 20 0 CHADHO Cc1nc([C@H](C)NCCCCCC2CC[NH2+]CC2)cs1 ZINC000925809369 1128143555 /nfs/dbraw/zinc/14/35/55/1128143555.db2.gz UHGYUTVWLLMAMJ-ZDUSSCGKSA-N 1 3 295.496 3.662 20 0 CHADHO CC(C)CCN1CCC([NH2+]C[C@H]2CCCC2(F)F)CC1 ZINC000926524522 1128178260 /nfs/dbraw/zinc/17/82/60/1128178260.db2.gz OHICDDGPUIWFIY-CQSZACIVSA-N 1 3 288.426 3.522 20 0 CHADHO CC[C@H](c1ccccc1)[NH+]1CCC(C)(N(C)C)CC1 ZINC000931350535 1128357566 /nfs/dbraw/zinc/35/75/66/1128357566.db2.gz NNRWUYDAJBKAPW-MRXNPFEDSA-N 1 3 260.425 3.554 20 0 CHADHO c1ccc([C@H]2CCCC[C@@H]2[NH2+]CCCN2CCCC2)cc1 ZINC000037229534 1128424881 /nfs/dbraw/zinc/42/48/81/1128424881.db2.gz MNJOKIXBDMNIIM-MOPGFXCFSA-N 1 3 286.463 3.788 20 0 CHADHO CCCCN1CCC([NH2+]Cc2ccc(C)c(C)c2)CC1 ZINC000037319115 1128430649 /nfs/dbraw/zinc/43/06/49/1128430649.db2.gz WGTLAPOJVJBMKP-UHFFFAOYSA-N 1 3 274.452 3.658 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](c2cccs2)C2CCCC2)C1 ZINC000037644649 1128433551 /nfs/dbraw/zinc/43/35/51/1128433551.db2.gz SZAUIFLXOZCTFI-RHSMWYFYSA-N 1 3 292.492 3.911 20 0 CHADHO c1ccc([C@@H]2CCCCN2CC[C@H]2CCCC[NH2+]2)cc1 ZINC001205171636 1128433813 /nfs/dbraw/zinc/43/38/13/1128433813.db2.gz VDBQPVWKEUPYLU-MSOLQXFVSA-N 1 3 272.436 3.746 20 0 CHADHO CCCc1ccc([C@H](C)NC[C@H]2CC[N@H+](CC)C2)cc1 ZINC000037643998 1128434240 /nfs/dbraw/zinc/43/42/40/1128434240.db2.gz HGGLQSQSYCLCSM-DOTOQJQBSA-N 1 3 274.452 3.632 20 0 CHADHO CCCc1ccc([C@H](C)NC[C@H]2CC[N@@H+](CC)C2)cc1 ZINC000037643998 1128434247 /nfs/dbraw/zinc/43/42/47/1128434247.db2.gz HGGLQSQSYCLCSM-DOTOQJQBSA-N 1 3 274.452 3.632 20 0 CHADHO CCCc1ccc([C@H](C)[NH2+]C[C@H]2CCN(CC)C2)cc1 ZINC000037643998 1128434248 /nfs/dbraw/zinc/43/42/48/1128434248.db2.gz HGGLQSQSYCLCSM-DOTOQJQBSA-N 1 3 274.452 3.632 20 0 CHADHO CCc1ccc([C@@H](C)NC[C@H](C)C[NH+]2CCCC2)cc1 ZINC000062078078 1128436419 /nfs/dbraw/zinc/43/64/19/1128436419.db2.gz SSWLAKJNUFMZHL-JKSUJKDBSA-N 1 3 274.452 3.632 20 0 CHADHO Cc1cccc([C@H](C)[NH2+]C[C@H]2CCCN(C(C)C)C2)c1 ZINC000125983473 1128459643 /nfs/dbraw/zinc/45/96/43/1128459643.db2.gz MASLQLBBWFPUHC-DLBZAZTESA-N 1 3 274.452 3.766 20 0 CHADHO CCC[C@H](C)CC[C@@H](C)N1CCC([NH+](C)C)CC1 ZINC001257476521 1128481044 /nfs/dbraw/zinc/48/10/44/1128481044.db2.gz LPAWZLUKRSVGLY-LSDHHAIUSA-N 1 3 254.462 3.617 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCC23CCCC3)C1 ZINC000556104425 1128545393 /nfs/dbraw/zinc/54/53/93/1128545393.db2.gz WIKLUMJBJSWMEM-BZUAXINKSA-N 1 3 264.457 3.562 20 0 CHADHO CN(C)[C@@H]1CCC[N@H+](CCC2CCCCCC2)CC1 ZINC000567312517 1128562251 /nfs/dbraw/zinc/56/22/51/1128562251.db2.gz WYANCOKQNZLNBU-QGZVFWFLSA-N 1 3 266.473 3.763 20 0 CHADHO CN(C)[C@@H]1CCC[N@@H+](CCC2CCCCCC2)CC1 ZINC000567312517 1128562253 /nfs/dbraw/zinc/56/22/53/1128562253.db2.gz WYANCOKQNZLNBU-QGZVFWFLSA-N 1 3 266.473 3.763 20 0 CHADHO CC[N@H+](CCC1CCN(Cc2ccco2)CC1)CC(C)C ZINC000567429295 1128564612 /nfs/dbraw/zinc/56/46/12/1128564612.db2.gz IAXQMFIJVJBXEH-UHFFFAOYSA-N 1 3 292.467 3.860 20 0 CHADHO CC[N@@H+](CCC1CCN(Cc2ccco2)CC1)CC(C)C ZINC000567429295 1128564616 /nfs/dbraw/zinc/56/46/16/1128564616.db2.gz IAXQMFIJVJBXEH-UHFFFAOYSA-N 1 3 292.467 3.860 20 0 CHADHO CC1(C)CC[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000556585186 1128606641 /nfs/dbraw/zinc/60/66/41/1128606641.db2.gz JCGBTPMLYCOLLY-MRXNPFEDSA-N 1 3 264.457 3.562 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[NH2+]CC[C@@H]1CCCN1C ZINC001258056466 1128713929 /nfs/dbraw/zinc/71/39/29/1128713929.db2.gz PKZDFKPVILAWFX-JYJNAYRXSA-N 1 3 254.462 3.521 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CCNC2(CCC2)C1)C(C)(C)c1ccccc1 ZINC000643545861 1117791301 /nfs/dbraw/zinc/79/13/01/1117791301.db2.gz DKMVWXVTZRVRBX-NVXWUHKLSA-N 1 3 286.463 3.617 20 0 CHADHO c1ccc2c(c1)CCCC[C@H]2N[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643545716 1117791467 /nfs/dbraw/zinc/79/14/67/1117791467.db2.gz BFYWVZVJRUVWFS-SJLPKXTDSA-N 1 3 284.447 3.718 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCNC2(CCC2)C1)[C@@H](C)C1CCCCC1 ZINC000643546865 1117794543 /nfs/dbraw/zinc/79/45/43/1117794543.db2.gz VZCDHCMBYYHSDY-HLLBOEOZSA-N 1 3 278.484 3.856 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCN(C)C(C)(C)C1)c1ccc(F)cc1F ZINC000623426459 1117854327 /nfs/dbraw/zinc/85/43/27/1117854327.db2.gz MNRNYZOXSRKUGD-CJNGLKHVSA-N 1 3 296.405 3.878 20 0 CHADHO NCCC[N@H+](C1CCCCC1)C1CCCCCC1 ZINC000036732281 1117883705 /nfs/dbraw/zinc/88/37/05/1117883705.db2.gz IBEHJLGKVBBHDW-UHFFFAOYSA-N 1 3 252.446 3.693 20 0 CHADHO NCCC[N@@H+](C1CCCCC1)C1CCCCCC1 ZINC000036732281 1117883711 /nfs/dbraw/zinc/88/37/11/1117883711.db2.gz IBEHJLGKVBBHDW-UHFFFAOYSA-N 1 3 252.446 3.693 20 0 CHADHO CN(CCC[NH+]1CCCC1)CCC(C)(C)c1ccccc1 ZINC001208665686 1117903809 /nfs/dbraw/zinc/90/38/09/1117903809.db2.gz FEMRNFAFEBNDOP-UHFFFAOYSA-N 1 3 288.479 3.772 20 0 CHADHO CN1CCCC[C@@H](C[NH2+][C@@H]2CCSc3ccccc32)C1 ZINC000624119849 1117983852 /nfs/dbraw/zinc/98/38/52/1117983852.db2.gz KWEXDPSTKDUESQ-GOEBONIOSA-N 1 3 290.476 3.545 20 0 CHADHO CC[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccc(F)cc1 ZINC000624120017 1117983997 /nfs/dbraw/zinc/98/39/97/1117983997.db2.gz POHXIQRBOILMPD-YOEHRIQHSA-N 1 3 278.415 3.598 20 0 CHADHO CSc1ccc([C@H](C)[NH2+]C[C@H]2CCCCN(C)C2)cc1 ZINC000624120249 1117985096 /nfs/dbraw/zinc/98/50/96/1117985096.db2.gz UTSKGVBSRLKDJN-LSDHHAIUSA-N 1 3 292.492 3.791 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1nccc2ccccc21 ZINC000624123567 1117986929 /nfs/dbraw/zinc/98/69/29/1117986929.db2.gz OGXPHMDXKJZKOF-CVEARBPZSA-N 1 3 297.446 3.617 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1cccc(C2CC2)c1 ZINC000624124163 1117987630 /nfs/dbraw/zinc/98/76/30/1117987630.db2.gz YRKQCLSSAZHREB-JKSUJKDBSA-N 1 3 286.463 3.947 20 0 CHADHO CC(C)CN1CCC([NH2+]C[C@H](C)Cc2ccccc2)CC1 ZINC000182051864 1118012980 /nfs/dbraw/zinc/01/29/80/1118012980.db2.gz JQJXNZGUPLPWOV-QGZVFWFLSA-N 1 3 288.479 3.575 20 0 CHADHO CC[C@@H](NC[C@@H]1CC[N@H+](CC)C1)c1ccc(Cl)cc1 ZINC000037644080 1118033010 /nfs/dbraw/zinc/03/30/10/1118033010.db2.gz QMZLUPMQQXYCKX-XJKSGUPXSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@@H](NC[C@@H]1CC[N@@H+](CC)C1)c1ccc(Cl)cc1 ZINC000037644080 1118033016 /nfs/dbraw/zinc/03/30/16/1118033016.db2.gz QMZLUPMQQXYCKX-XJKSGUPXSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H]1CCN(CC)C1)c1ccc(Cl)cc1 ZINC000037644080 1118033020 /nfs/dbraw/zinc/03/30/20/1118033020.db2.gz QMZLUPMQQXYCKX-XJKSGUPXSA-N 1 3 280.843 3.723 20 0 CHADHO CC[NH+]1CCC(CCN[C@@H](C)c2cccc(F)c2F)CC1 ZINC000183272809 1118041177 /nfs/dbraw/zinc/04/11/77/1118041177.db2.gz NJVFOZFSJWFXNW-ZDUSSCGKSA-N 1 3 296.405 3.737 20 0 CHADHO C[C@H](C[NH2+][C@H](C)c1ccccc1C(F)(F)F)CN(C)C ZINC000380422881 1118069624 /nfs/dbraw/zinc/06/96/24/1118069624.db2.gz IFPIMVFWRPDVII-VXGBXAGGSA-N 1 3 288.357 3.554 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](C)c2cccc(C3CC3)c2)C1 ZINC000340188101 1118106108 /nfs/dbraw/zinc/10/61/08/1118106108.db2.gz DWYGJEZGKGYETG-HUUCEWRRSA-N 1 3 272.436 3.556 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](C)c2cccc(C3CC3)c2)C1 ZINC000340188101 1118106111 /nfs/dbraw/zinc/10/61/11/1118106111.db2.gz DWYGJEZGKGYETG-HUUCEWRRSA-N 1 3 272.436 3.556 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](C)c2cccc(C3CC3)c2)C1 ZINC000340188101 1118106113 /nfs/dbraw/zinc/10/61/13/1118106113.db2.gz DWYGJEZGKGYETG-HUUCEWRRSA-N 1 3 272.436 3.556 20 0 CHADHO C[C@@H](C[NH2+]Cc1cc(-c2ccccc2)cs1)CN(C)C ZINC000312520546 1118150505 /nfs/dbraw/zinc/15/05/05/1118150505.db2.gz OKVRJKVTGFXZEA-AWEZNQCLSA-N 1 3 288.460 3.702 20 0 CHADHO COc1ccc2c(c1)nccc2NCC1([NH+](C)C)CCCC1 ZINC000765469791 1118153739 /nfs/dbraw/zinc/15/37/39/1118153739.db2.gz VQESCSYTSKUEMD-UHFFFAOYSA-N 1 3 299.418 3.530 20 0 CHADHO CCC[NH+]1CCC(NC[C@H](C)Sc2ccccc2)CC1 ZINC000129685844 1118444047 /nfs/dbraw/zinc/44/40/47/1118444047.db2.gz GZRLBDRPMKOIPD-HNNXBMFYSA-N 1 3 292.492 3.631 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H](C)c2cccc(C3CC3)c2)C1 ZINC000580906659 1118519707 /nfs/dbraw/zinc/51/97/07/1118519707.db2.gz HVGMUEUXCMGCSL-JKSUJKDBSA-N 1 3 286.463 3.947 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H](C)c2cccc(C3CC3)c2)C1 ZINC000580906659 1118519710 /nfs/dbraw/zinc/51/97/10/1118519710.db2.gz HVGMUEUXCMGCSL-JKSUJKDBSA-N 1 3 286.463 3.947 20 0 CHADHO CC[C@H]([NH2+]CC[C@@H]1CCCN1C)c1ccc(Cl)cc1 ZINC000341215228 1118624699 /nfs/dbraw/zinc/62/46/99/1118624699.db2.gz DVAHKMPLQIFBPS-HOTGVXAUSA-N 1 3 280.843 3.865 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2C[C@H](C)CC[C@@H]2CC)C1 ZINC000430732714 1118765358 /nfs/dbraw/zinc/76/53/58/1118765358.db2.gz PYEXRVFNFFGMPE-WCXIOVBPSA-N 1 3 266.473 3.523 20 0 CHADHO C(C1CCCC1)N1CCC([NH2+][C@@H]2CC[C@@H]2C2CCC2)CC1 ZINC000510668666 1118786173 /nfs/dbraw/zinc/78/61/73/1118786173.db2.gz STWTZKBVZNWGDL-RTBURBONSA-N 1 3 290.495 3.809 20 0 CHADHO CN(C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCc3cc(F)ccc32)C1 ZINC000341719566 1118813954 /nfs/dbraw/zinc/81/39/54/1118813954.db2.gz CJNHZWPFNRDGFO-JFIYKMOQSA-N 1 3 290.426 3.666 20 0 CHADHO CC[C@@H]1CCC[C@H](N[C@@H]2C[C@H]([NH3+])c3ccccc32)C1 ZINC000132140929 1118826673 /nfs/dbraw/zinc/82/66/73/1118826673.db2.gz FDUKQACTUBBZMR-OSRSDYAFSA-N 1 3 258.409 3.690 20 0 CHADHO CN(Cc1ccc(Cl)cc1Cl)C1CCC([NH3+])CC1 ZINC000091844764 1118835697 /nfs/dbraw/zinc/83/56/97/1118835697.db2.gz ZLAKIVUQAXJTHM-UHFFFAOYSA-N 1 3 287.234 3.695 20 0 CHADHO Cc1ccc2[nH]c(C[NH2+]C3CCN(C(C)C)CC3)cc2c1C ZINC000472077467 1118960565 /nfs/dbraw/zinc/96/05/65/1118960565.db2.gz ZMJAUQXSYBEUBW-UHFFFAOYSA-N 1 3 299.462 3.747 20 0 CHADHO Cc1ccc([C@H](C)C[N@@H+]2CC[C@@H]3[C@@H](CCCN3C)C2)cc1 ZINC000628190950 1128824770 /nfs/dbraw/zinc/82/47/70/1128824770.db2.gz VPYNNEGENMZAIL-NZSAHSFTSA-N 1 3 286.463 3.515 20 0 CHADHO Cc1ccc([C@H](C)C[N@H+]2CC[C@@H]3[C@@H](CCCN3C)C2)cc1 ZINC000628190950 1128824773 /nfs/dbraw/zinc/82/47/73/1128824773.db2.gz VPYNNEGENMZAIL-NZSAHSFTSA-N 1 3 286.463 3.515 20 0 CHADHO Cc1ccc([C@H](C)C[N@@H+]2CC[C@H]3[C@@H](CCCN3C)C2)cc1 ZINC000628190949 1128824920 /nfs/dbraw/zinc/82/49/20/1128824920.db2.gz VPYNNEGENMZAIL-NEWSRXKRSA-N 1 3 286.463 3.515 20 0 CHADHO Cc1ccc([C@H](C)C[N@H+]2CC[C@H]3[C@@H](CCCN3C)C2)cc1 ZINC000628190949 1128824928 /nfs/dbraw/zinc/82/49/28/1128824928.db2.gz VPYNNEGENMZAIL-NEWSRXKRSA-N 1 3 286.463 3.515 20 0 CHADHO CC[C@H](C)CC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000657586129 1119198575 /nfs/dbraw/zinc/19/85/75/1119198575.db2.gz HZWMQNQAOWKQAF-HNNXBMFYSA-N 1 3 266.473 3.809 20 0 CHADHO CC[C@H](N[C@@H]1CC[NH2+]CC(C)(C)C1)c1cccc(OC)c1 ZINC000635009213 1119369141 /nfs/dbraw/zinc/36/91/41/1119369141.db2.gz GGINPNFLOWOLBZ-WBVHZDCISA-N 1 3 290.451 3.514 20 0 CHADHO CSCCCCCCN[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000235167231 1119393744 /nfs/dbraw/zinc/39/37/44/1119393744.db2.gz IISHRQJNAYJLON-HOTGVXAUSA-N 1 3 278.465 3.644 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H](C)C(C)(C)c2ccccc2)C1 ZINC000151098692 1119394004 /nfs/dbraw/zinc/39/40/04/1119394004.db2.gz JXHYHKFVKKVEIZ-IRXDYDNUSA-N 1 3 288.479 3.674 20 0 CHADHO CC[C@H](c1ccccc1)N1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000081632317 1119519938 /nfs/dbraw/zinc/51/99/38/1119519938.db2.gz LXFYLSXUFZWCFY-IEBWSBKVSA-N 1 3 286.463 3.801 20 0 CHADHO CC[C@H](c1ccccc1)N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000081632317 1119519941 /nfs/dbraw/zinc/51/99/41/1119519941.db2.gz LXFYLSXUFZWCFY-IEBWSBKVSA-N 1 3 286.463 3.801 20 0 CHADHO C(C1CCCC1)N1CCC([NH2+][C@@H]2CCCSCC2)CC1 ZINC000657858592 1119533346 /nfs/dbraw/zinc/53/33/46/1119533346.db2.gz JDUDDHHDEJRKJT-MRXNPFEDSA-N 1 3 296.524 3.516 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H]2[C@@H]3CCC[C@@H]3C2(C)C)C1 ZINC000657872308 1119583678 /nfs/dbraw/zinc/58/36/78/1119583678.db2.gz MUEXPLDWPBIPHE-VVLHAWIVSA-N 1 3 278.484 3.521 20 0 CHADHO CC(C)C[C@H](C)C[NH2+]C1CCN(C2CCCC2)CC1 ZINC000685425559 1119606274 /nfs/dbraw/zinc/60/62/74/1119606274.db2.gz WAAAFUPGLACVTF-HNNXBMFYSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@@H](CC[NH2+]C[C@H]1CCCCN(C)C1)c1ccccc1 ZINC000628425639 1128859211 /nfs/dbraw/zinc/85/92/11/1128859211.db2.gz QUNOLUZZODMMGD-DLBZAZTESA-N 1 3 274.452 3.502 20 0 CHADHO CC[C@H]([NH2+]C1CCN([C@@H]2CCC[C@H](C)C2)CC1)C1CC1 ZINC000658236082 1119712101 /nfs/dbraw/zinc/71/21/01/1119712101.db2.gz SXXVEJKXUGQVIB-QGTPRVQTSA-N 1 3 278.484 3.808 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)CCc2ccccc2Cl)C[C@@H]1C ZINC000531140602 1119802914 /nfs/dbraw/zinc/80/29/14/1119802914.db2.gz DKIUCFMUTWDKLI-GOEBONIOSA-N 1 3 294.870 3.687 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)CCc2ccccc2Cl)C[C@@H]1C ZINC000531140602 1119802916 /nfs/dbraw/zinc/80/29/16/1119802916.db2.gz DKIUCFMUTWDKLI-GOEBONIOSA-N 1 3 294.870 3.687 20 0 CHADHO COc1cccc(CN[C@H](C)c2cccc(C[NH+](C)C)c2)c1 ZINC000924565480 1119864870 /nfs/dbraw/zinc/86/48/70/1119864870.db2.gz UDQDDHNBNXAHEI-OAHLLOKOSA-N 1 3 298.430 3.608 20 0 CHADHO C[C@H](C[NH2+][C@H](C)[C@@H]1CC2CCC1CC2)CN1CCCC1 ZINC000381595013 1128882035 /nfs/dbraw/zinc/88/20/35/1128882035.db2.gz FGKGJMKDJRKTJN-IUGQGLEPSA-N 1 3 278.484 3.523 20 0 CHADHO C[C@@H]1C[N@H+](CC[C@H]2CCCCN2C)[C@H]1c1ccccc1 ZINC000472590617 1119989858 /nfs/dbraw/zinc/98/98/58/1119989858.db2.gz GTRYHWVICPDSGD-KBAYOESNSA-N 1 3 272.436 3.554 20 0 CHADHO C[C@@H]1C[N@@H+](CC[C@H]2CCCCN2C)[C@H]1c1ccccc1 ZINC000472590617 1119989861 /nfs/dbraw/zinc/98/98/61/1119989861.db2.gz GTRYHWVICPDSGD-KBAYOESNSA-N 1 3 272.436 3.554 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccc(Cl)cc1 ZINC000623657060 1120065273 /nfs/dbraw/zinc/06/52/73/1120065273.db2.gz IZWVFUJEYCZIKE-KGLIPLIRSA-N 1 3 280.843 3.723 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)C1 ZINC000623657252 1120065645 /nfs/dbraw/zinc/06/56/45/1120065645.db2.gz MDZVGOSYJRDORU-NZSAHSFTSA-N 1 3 286.463 3.644 20 0 CHADHO CC(C)CCC[C@H](C)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000624120780 1120066020 /nfs/dbraw/zinc/06/60/20/1120066020.db2.gz GWJCFKLOZJORDE-HOTGVXAUSA-N 1 3 254.462 3.523 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@H]2CCc3cc(Cl)ccc32)C1 ZINC000624120890 1120067204 /nfs/dbraw/zinc/06/72/04/1120067204.db2.gz JJOSSXXSVVUCJJ-DYVFJYSZSA-N 1 3 292.854 3.649 20 0 CHADHO CN1CCCC[C@@H](C[NH2+][C@H]2CCc3cc(Cl)ccc32)C1 ZINC000624120891 1120067644 /nfs/dbraw/zinc/06/76/44/1120067644.db2.gz JJOSSXXSVVUCJJ-GUYCJALGSA-N 1 3 292.854 3.649 20 0 CHADHO CC[N@@H+]1CCC[C@@H](CN[C@H](c2ccc(F)cc2)C2CC2)C1 ZINC001116473027 1120127304 /nfs/dbraw/zinc/12/73/04/1120127304.db2.gz JHCBZZJDPMBLRJ-KSSFIOAISA-N 1 3 290.426 3.598 20 0 CHADHO CC[N@H+]1CCC[C@@H](CN[C@H](c2ccc(F)cc2)C2CC2)C1 ZINC001116473027 1120127309 /nfs/dbraw/zinc/12/73/09/1120127309.db2.gz JHCBZZJDPMBLRJ-KSSFIOAISA-N 1 3 290.426 3.598 20 0 CHADHO CC(C)(C)N1CCC([NH2+]C[C@@H]2CCc3ccccc32)CC1 ZINC000765905152 1120171616 /nfs/dbraw/zinc/17/16/16/1120171616.db2.gz NLFCNRREHZRSTO-INIZCTEOSA-N 1 3 286.463 3.569 20 0 CHADHO CC(C)[C@H]([NH3+])CCN[C@H]1C[C@@H](c2ccccc2)C1(C)C ZINC000665282153 1120210393 /nfs/dbraw/zinc/21/03/93/1120210393.db2.gz RWCZYYCABUGOOS-BBWFWOEESA-N 1 3 274.452 3.532 20 0 CHADHO c1cc2c(cccc2C[NH2+]C2CCN(C3CCCC3)CC2)[nH]1 ZINC000176992945 1120212019 /nfs/dbraw/zinc/21/20/19/1120212019.db2.gz FOTUETMKVSVWPB-UHFFFAOYSA-N 1 3 297.446 3.665 20 0 CHADHO C[C@H]1CC[NH2+]CC[C@@H]1N[C@H]1CCCc2ccc(Cl)cc21 ZINC000629549003 1128914793 /nfs/dbraw/zinc/91/47/93/1128914793.db2.gz PJMHHRMLMGUKKA-ZLIFDBKOSA-N 1 3 292.854 3.695 20 0 CHADHO COc1ccccc1-c1ccc(CN[C@@H](C)C[C@@H](C)[NH3+])cc1 ZINC000575181194 1120448328 /nfs/dbraw/zinc/44/83/28/1120448328.db2.gz UDJSCKVMPYNGCZ-CABCVRRESA-N 1 3 298.430 3.578 20 0 CHADHO Cc1cc(C)c(C[N@H+]2CCC[C@H]3CN(C)CC[C@H]32)cc1C ZINC000584866061 1120471959 /nfs/dbraw/zinc/47/19/59/1120471959.db2.gz NEMCKMKHGORESP-PKOBYXMFSA-N 1 3 286.463 3.528 20 0 CHADHO Cc1cc(C)c(C[N@@H+]2CCC[C@H]3CN(C)CC[C@H]32)cc1C ZINC000584866061 1120471962 /nfs/dbraw/zinc/47/19/62/1120471962.db2.gz NEMCKMKHGORESP-PKOBYXMFSA-N 1 3 286.463 3.528 20 0 CHADHO CC(C)(C[NH2+]C[C@@H]1C[C@H]1c1ccccc1)CN1CCCC1 ZINC000418039877 1120508960 /nfs/dbraw/zinc/50/89/60/1120508960.db2.gz UUZGPMVONVIDRR-ROUUACIJSA-N 1 3 286.463 3.502 20 0 CHADHO C[C@@H](c1cccc(Cl)c1)[N@H+](C)CCCN1CCCC1 ZINC000499910636 1120550573 /nfs/dbraw/zinc/55/05/73/1120550573.db2.gz WQBGSPXGATWHLG-AWEZNQCLSA-N 1 3 280.843 3.819 20 0 CHADHO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)CCCN1CCCC1 ZINC000499910636 1120550578 /nfs/dbraw/zinc/55/05/78/1120550578.db2.gz WQBGSPXGATWHLG-AWEZNQCLSA-N 1 3 280.843 3.819 20 0 CHADHO CC[C@@H](c1ccc(F)cc1)[N@@H+]1CCC[C@]2(CCN(C)C2)C1 ZINC000660658604 1120674321 /nfs/dbraw/zinc/67/43/21/1120674321.db2.gz HUGWAQJHTTVYIF-ZWKOTPCHSA-N 1 3 290.426 3.695 20 0 CHADHO CC[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@]2(CCN(C)C2)C1 ZINC000660658604 1120674322 /nfs/dbraw/zinc/67/43/22/1120674322.db2.gz HUGWAQJHTTVYIF-ZWKOTPCHSA-N 1 3 290.426 3.695 20 0 CHADHO CCCSC[C@H](C)[NH2+][C@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000893487726 1120795489 /nfs/dbraw/zinc/79/54/89/1120795489.db2.gz LWGZRHBCSWEDQD-XHSDSOJGSA-N 1 3 298.540 3.761 20 0 CHADHO CC[C@H](C[C@@H](C)CC)[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000251929793 1120884148 /nfs/dbraw/zinc/88/41/48/1120884148.db2.gz RCRYLDLUSLMNLT-ARFHVFGLSA-N 1 3 254.462 3.521 20 0 CHADHO CC1(C)CNCC[C@@H]1[NH2+]C[C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000662277914 1120917997 /nfs/dbraw/zinc/91/79/97/1120917997.db2.gz TXMMIEHPFZJSQH-NXHRZFHOSA-N 1 3 286.463 3.548 20 0 CHADHO CCC(C)(C)[C@H](C)[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663465532 1120980692 /nfs/dbraw/zinc/98/06/92/1120980692.db2.gz KJHNKASHMWVBFK-HOCLYGCPSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)CC[C@@H](C)[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663470215 1120984714 /nfs/dbraw/zinc/98/47/14/1120984714.db2.gz SZGHQTXZRGXBKV-NVXWUHKLSA-N 1 3 266.473 3.523 20 0 CHADHO C([NH2+][C@H]1CCC[C@@H](C2CC2)C1)[C@H]1CCCN(CC2CC2)C1 ZINC000663472152 1120985343 /nfs/dbraw/zinc/98/53/43/1120985343.db2.gz ZBZWEOLRCHMUJR-QRQLOZEOSA-N 1 3 290.495 3.667 20 0 CHADHO CC(C)c1ccc([C@H](C)[NH2+]C[C@H]2CNCCC2(F)F)cc1 ZINC000925777856 1120986407 /nfs/dbraw/zinc/98/64/07/1120986407.db2.gz HOFQEBWWDJNZIO-XJKSGUPXSA-N 1 3 296.405 3.705 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]C[C@@H]1CCCCN1 ZINC000643502890 1121002320 /nfs/dbraw/zinc/00/23/20/1121002320.db2.gz UPUUHESNMOZFKX-KBXCAEBGSA-N 1 3 297.446 3.585 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]C[C@H]1CCCCN1 ZINC000643502891 1121002699 /nfs/dbraw/zinc/00/26/99/1121002699.db2.gz UPUUHESNMOZFKX-KDOFPFPSSA-N 1 3 297.446 3.585 20 0 CHADHO CC(C)CC[C@@H]1CC[C@@H]([NH2+][C@@H]2CCNC3(CCC3)C2)C1 ZINC000643548131 1121012156 /nfs/dbraw/zinc/01/21/56/1121012156.db2.gz MWTDKUGGECSQDJ-BRWVUGGUSA-N 1 3 278.484 3.856 20 0 CHADHO C[NH+](C)CC[C@H](NCc1ccc2occc2c1)C(C)(C)C ZINC000512051674 1121039926 /nfs/dbraw/zinc/03/99/26/1121039926.db2.gz JBNHASUPLHQCSZ-KRWDZBQOSA-N 1 3 288.435 3.889 20 0 CHADHO C[C@@H]1CCC[C@H]([NH+]2CCC(NCCC(C)(C)F)CC2)C1 ZINC000658193028 1121212534 /nfs/dbraw/zinc/21/25/34/1121212534.db2.gz RUGNLKFROZKVML-ZBFHGGJFSA-N 1 3 284.463 3.757 20 0 CHADHO C[C@@H]1CCC[C@H](N2CCC([NH2+]CCC(C)(C)F)CC2)C1 ZINC000658193028 1121212537 /nfs/dbraw/zinc/21/25/37/1121212537.db2.gz RUGNLKFROZKVML-ZBFHGGJFSA-N 1 3 284.463 3.757 20 0 CHADHO Cc1ccc([C@@H](C)C[NH2+]C2CCN(C(C)(C)C)CC2)cc1 ZINC000766096688 1121230904 /nfs/dbraw/zinc/23/09/04/1121230904.db2.gz WZAZUBJRTQYXLV-INIZCTEOSA-N 1 3 288.479 3.951 20 0 CHADHO CCC[NH+]1CCC(N[C@@H]2CC(C)(C)c3ccccc32)CC1 ZINC000675733945 1121346487 /nfs/dbraw/zinc/34/64/87/1121346487.db2.gz RNWKZSGVUBZHMO-GOSISDBHSA-N 1 3 286.463 3.873 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21)C1CC1 ZINC000512615258 1121494164 /nfs/dbraw/zinc/49/41/64/1121494164.db2.gz YWUKVMIOUHKGTD-YGWPLHOASA-N 1 3 298.474 3.675 20 0 CHADHO c1ccc(CN2C[C@@H]3CCC[C@H]([NH2+]CCC4CC4)[C@@H]3C2)cc1 ZINC000512666422 1121672665 /nfs/dbraw/zinc/67/26/65/1121672665.db2.gz KKANHFVWWBYJRN-ZCNNSNEGSA-N 1 3 298.474 3.677 20 0 CHADHO Cc1cc(C)c(/C=C\C[NH2+]C[C@H]2CCN(C3CC3)C2)c(C)c1 ZINC001177226677 1121719137 /nfs/dbraw/zinc/71/91/37/1121719137.db2.gz VKEUIPLXUFVTPL-PYTPGESOSA-N 1 3 298.474 3.699 20 0 CHADHO Cc1cc(C)c(/C=C\CNC[C@@H]2CCC[N@@H+](C)C2)c(C)c1 ZINC001177795143 1121751450 /nfs/dbraw/zinc/75/14/50/1121751450.db2.gz OJEMHLGXXCDQPU-MTIYJEKLSA-N 1 3 286.463 3.556 20 0 CHADHO Cc1cc(C)c(/C=C\CNC[C@@H]2CCC[N@H+](C)C2)c(C)c1 ZINC001177795143 1121751454 /nfs/dbraw/zinc/75/14/54/1121751454.db2.gz OJEMHLGXXCDQPU-MTIYJEKLSA-N 1 3 286.463 3.556 20 0 CHADHO Cc1cc(C)c(/C=C\CN[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@@H]23)c(C)c1 ZINC001179817261 1121912749 /nfs/dbraw/zinc/91/27/49/1121912749.db2.gz PHTVTKIWLOQGPE-MVSSULDISA-N 1 3 298.474 3.555 20 0 CHADHO Cc1cc(C)c(/C=C\CN[C@@H]2CC[C@@H]3C[N@H+](C)C[C@@H]23)c(C)c1 ZINC001179817261 1121912757 /nfs/dbraw/zinc/91/27/57/1121912757.db2.gz PHTVTKIWLOQGPE-MVSSULDISA-N 1 3 298.474 3.555 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)[N@@H+](C[C@H](C)N)C1CC1 ZINC000420322914 1121996033 /nfs/dbraw/zinc/99/60/33/1121996033.db2.gz SSPKKZMHEXPACE-UONOGXRCSA-N 1 3 268.404 3.712 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)[N@H+](C[C@H](C)N)C1CC1 ZINC000420322914 1121996047 /nfs/dbraw/zinc/99/60/47/1121996047.db2.gz SSPKKZMHEXPACE-UONOGXRCSA-N 1 3 268.404 3.712 20 0 CHADHO CC[C@@H]1C[C@]1([NH2+]CC[C@@H]1CCCN1C)c1cccc(C)c1 ZINC000502479158 1122091068 /nfs/dbraw/zinc/09/10/68/1122091068.db2.gz DAPWMWPWFMNSPR-NZSAHSFTSA-N 1 3 286.463 3.694 20 0 CHADHO C[C@]1([NH3+])CCCN(Cc2ccc(F)c3ccccc23)CC1 ZINC001205273253 1122226317 /nfs/dbraw/zinc/22/63/17/1122226317.db2.gz IVLGMHOVPYYBDG-SFHVURJKSA-N 1 3 286.394 3.682 20 0 CHADHO CCCCc1ccc(CN2CCC[C@@](C)([NH3+])CC2)cc1 ZINC001205281116 1122237221 /nfs/dbraw/zinc/23/72/21/1122237221.db2.gz PUPKZIMDIHEQRV-GOSISDBHSA-N 1 3 274.452 3.733 20 0 CHADHO CCC1(N2CCC2)CC[NH+](C[C@H](C)c2ccccc2)CC1 ZINC001183865233 1122245452 /nfs/dbraw/zinc/24/54/52/1122245452.db2.gz RMZOLSQETROZOQ-KRWDZBQOSA-N 1 3 286.463 3.740 20 0 CHADHO CC(C)[C@H](c1ccc(F)cc1)N(C)CC[C@H]1CCC[N@@H+]1C ZINC000434623340 1122385150 /nfs/dbraw/zinc/38/51/50/1122385150.db2.gz LCEXWPIAPJFCIX-QZTJIDSGSA-N 1 3 292.442 3.939 20 0 CHADHO CC(C)[C@H](c1ccc(F)cc1)N(C)CC[C@H]1CCC[N@H+]1C ZINC000434623340 1122385155 /nfs/dbraw/zinc/38/51/55/1122385155.db2.gz LCEXWPIAPJFCIX-QZTJIDSGSA-N 1 3 292.442 3.939 20 0 CHADHO CCN(Cc1cc2cc(F)ccc2o1)[C@@H]1CCC[NH2+]CC1 ZINC000435379359 1122461414 /nfs/dbraw/zinc/46/14/14/1122461414.db2.gz BOYKOSKKFQXVBI-OAHLLOKOSA-N 1 3 290.382 3.536 20 0 CHADHO Cc1ccccc1C[N@H+]1CCCC[C@@H]1C[C@@H]1CCCN1C ZINC001203709608 1122517355 /nfs/dbraw/zinc/51/73/55/1122517355.db2.gz KLUBMZMKRVGUEL-RBUKOAKNSA-N 1 3 286.463 3.834 20 0 CHADHO Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C[C@@H]1CCCN1C ZINC001203709608 1122517359 /nfs/dbraw/zinc/51/73/59/1122517359.db2.gz KLUBMZMKRVGUEL-RBUKOAKNSA-N 1 3 286.463 3.834 20 0 CHADHO CCN(CC)CCC[NH2+][C@H]1CC[C@H](c2ccccc2)C1 ZINC000436276932 1122530154 /nfs/dbraw/zinc/53/01/54/1122530154.db2.gz VSONNHYLKDJVBV-ROUUACIJSA-N 1 3 274.452 3.644 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1)CN1CCCC1 ZINC000436276873 1122533193 /nfs/dbraw/zinc/53/31/93/1122533193.db2.gz VSERVRBETYRFMK-BHIYHBOVSA-N 1 3 286.463 3.644 20 0 CHADHO C[C@@H]1C[C@H]2CCCC[C@H]2N1CC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001191076083 1122569402 /nfs/dbraw/zinc/56/94/02/1122569402.db2.gz GASNIWNITICOHT-CWQOZTLDSA-N 1 3 278.484 3.617 20 0 CHADHO C[C@@H]1C[C@H]2CCCC[C@H]2N1CC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001191076083 1122569403 /nfs/dbraw/zinc/56/94/03/1122569403.db2.gz GASNIWNITICOHT-CWQOZTLDSA-N 1 3 278.484 3.617 20 0 CHADHO CC(C)=CCCN1CCC[C@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC001191048442 1122570940 /nfs/dbraw/zinc/57/09/40/1122570940.db2.gz OBCIDHVQFFGDGK-ROUUACIJSA-N 1 3 278.484 3.929 20 0 CHADHO CC(C)=CCCN1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC001191048442 1122570943 /nfs/dbraw/zinc/57/09/43/1122570943.db2.gz OBCIDHVQFFGDGK-ROUUACIJSA-N 1 3 278.484 3.929 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+]C2CCN([C@H]3CCC[C@@H](C)C3)CC2)C1 ZINC000437052940 1122606187 /nfs/dbraw/zinc/60/61/87/1122606187.db2.gz XOVWBXXTRPZMHB-LMSBXDPUSA-N 1 3 278.484 3.808 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2cc3ccc(C)cc3o2)C1 ZINC000425924538 1122661495 /nfs/dbraw/zinc/66/14/95/1122661495.db2.gz MVCVXCHDMAEVJH-GJZGRUSLSA-N 1 3 286.419 3.734 20 0 CHADHO CCN(CC)CCC[N@@H+](CC)[C@H]1CCCC[C@@H]1C ZINC001193412574 1122690441 /nfs/dbraw/zinc/69/04/41/1122690441.db2.gz FOUQSSRCAPHSRU-HOTGVXAUSA-N 1 3 254.462 3.619 20 0 CHADHO CC[C@@H]([NH2+]C[C@H](C)CN(C)C)c1ccc(Cl)s1 ZINC000425938377 1122667958 /nfs/dbraw/zinc/66/79/58/1122667958.db2.gz PYWDOULRIKUIFB-WDEREUQCSA-N 1 3 274.861 3.640 20 0 CHADHO C[C@@H]([NH2+]C[C@H](C)CN(C)C)c1ccc(-c2ccncc2)cc1 ZINC000425941788 1122671800 /nfs/dbraw/zinc/67/18/00/1122671800.db2.gz DYYXLUIVZUCHLA-JKSUJKDBSA-N 1 3 297.446 3.597 20 0 CHADHO CC(C)[C@@H]([NH2+]C[C@H](C)CN(C)C)c1cc2ccccc2o1 ZINC000425943771 1122673727 /nfs/dbraw/zinc/67/37/27/1122673727.db2.gz SUUNFYFOAYRTHK-KBXCAEBGSA-N 1 3 288.435 3.917 20 0 CHADHO CCN(CC)CCC[N@H+](CC)[C@H]1CCCC[C@@H]1C ZINC001193412574 1122690438 /nfs/dbraw/zinc/69/04/38/1122690438.db2.gz FOUQSSRCAPHSRU-HOTGVXAUSA-N 1 3 254.462 3.619 20 0 CHADHO CN(CCC[NH+]1CCCC1)CC[C@@H]1CCc2ccccc21 ZINC001193850226 1122724645 /nfs/dbraw/zinc/72/46/45/1122724645.db2.gz VZMDJNKLTKFFDQ-SFHVURJKSA-N 1 3 286.463 3.524 20 0 CHADHO C[C@H]1CCC[C@@H](N2CCC([NH2+]C3CC(C)(C)C3)CC2)C1 ZINC000578524557 1122796203 /nfs/dbraw/zinc/79/62/03/1122796203.db2.gz JJMMPQXHEJQOSY-WMLDXEAASA-N 1 3 278.484 3.808 20 0 CHADHO CCCCN1CCC([NH2+]Cc2ccc(CCC)cc2)CC1 ZINC000620760428 1129084348 /nfs/dbraw/zinc/08/43/48/1129084348.db2.gz VRYUVDTVJZHOIE-UHFFFAOYSA-N 1 3 288.479 3.993 20 0 CHADHO CCC[NH+]1CCC(N[C@H](c2cccs2)C2CC2)CC1 ZINC000049956859 1122894702 /nfs/dbraw/zinc/89/47/02/1122894702.db2.gz SPAJDOORYDFTOI-INIZCTEOSA-N 1 3 278.465 3.663 20 0 CHADHO CC[C@@H](F)CN1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000440774563 1123037576 /nfs/dbraw/zinc/03/75/76/1123037576.db2.gz YFQFIKQKPJULGO-NVXWUHKLSA-N 1 3 284.463 3.711 20 0 CHADHO CC[C@@H](F)CN1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000440774563 1123037583 /nfs/dbraw/zinc/03/75/83/1123037583.db2.gz YFQFIKQKPJULGO-NVXWUHKLSA-N 1 3 284.463 3.711 20 0 CHADHO CC/C=C\CCCCC[N@@H+]1CCC[C@H](CN)[C@@H]1C ZINC001205901694 1123059864 /nfs/dbraw/zinc/05/98/64/1123059864.db2.gz FDVBPJFTJWYEEN-XETQRACLSA-N 1 3 252.446 3.572 20 0 CHADHO CC/C=C\CCCCC[N@H+]1CCC[C@H](CN)[C@@H]1C ZINC001205901694 1123059869 /nfs/dbraw/zinc/05/98/69/1123059869.db2.gz FDVBPJFTJWYEEN-XETQRACLSA-N 1 3 252.446 3.572 20 0 CHADHO CCC(CC)[N@H+](C)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167995022 1123102858 /nfs/dbraw/zinc/10/28/58/1123102858.db2.gz UFVOXCKUIQROAW-SJPCQFCGSA-N 1 3 264.457 3.512 20 0 CHADHO CCC(CC)[N@@H+](C)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167995022 1123102861 /nfs/dbraw/zinc/10/28/61/1123102861.db2.gz UFVOXCKUIQROAW-SJPCQFCGSA-N 1 3 264.457 3.512 20 0 CHADHO CC(C)C1CC[NH+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001167995108 1123103232 /nfs/dbraw/zinc/10/32/32/1123103232.db2.gz WOFMOADBPKUWOX-DFNIBXOVSA-N 1 3 290.495 3.760 20 0 CHADHO CCC(CC)C[N@@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001201531770 1123122239 /nfs/dbraw/zinc/12/22/39/1123122239.db2.gz VLLSUCYLAJNXRI-QGZVFWFLSA-N 1 3 266.473 3.763 20 0 CHADHO CCC(CC)C[N@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001201531770 1123122241 /nfs/dbraw/zinc/12/22/41/1123122241.db2.gz VLLSUCYLAJNXRI-QGZVFWFLSA-N 1 3 266.473 3.763 20 0 CHADHO CC(C)(C)CC[N@@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001202086549 1123173843 /nfs/dbraw/zinc/17/38/43/1123173843.db2.gz FDMYZCKIFNOCOM-MRXNPFEDSA-N 1 3 266.473 3.763 20 0 CHADHO CC(C)(C)CC[N@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001202086549 1123173845 /nfs/dbraw/zinc/17/38/45/1123173845.db2.gz FDMYZCKIFNOCOM-MRXNPFEDSA-N 1 3 266.473 3.763 20 0 CHADHO C[C@@H](CC[NH+](C)C)N[C@@H](C)c1ccc(F)c2ccccc21 ZINC000520620705 1123189805 /nfs/dbraw/zinc/18/98/05/1123189805.db2.gz KMUKALILPMOZOZ-KBPBESRZSA-N 1 3 288.410 3.970 20 0 CHADHO C[C@@H](N[C@@H](C)CC[NH+](C)C)c1ccc(F)c2ccccc21 ZINC000520620707 1123189880 /nfs/dbraw/zinc/18/98/80/1123189880.db2.gz KMUKALILPMOZOZ-UONOGXRCSA-N 1 3 288.410 3.970 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000536496458 1123233736 /nfs/dbraw/zinc/23/37/36/1123233736.db2.gz GZRZJOZVFBDJPR-GUYCJALGSA-N 1 3 292.854 3.649 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000536496458 1123233739 /nfs/dbraw/zinc/23/37/39/1123233739.db2.gz GZRZJOZVFBDJPR-GUYCJALGSA-N 1 3 292.854 3.649 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000536496458 1123233741 /nfs/dbraw/zinc/23/37/41/1123233741.db2.gz GZRZJOZVFBDJPR-GUYCJALGSA-N 1 3 292.854 3.649 20 0 CHADHO C(C1CCCCC1)N1CCC([NH2+][C@H]2CCCC23CC3)CC1 ZINC000850430190 1123266007 /nfs/dbraw/zinc/26/60/07/1123266007.db2.gz JQMQLAXTTWFHHH-SFHVURJKSA-N 1 3 290.495 3.953 20 0 CHADHO CCCCC[C@H](C)[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000853240653 1123428810 /nfs/dbraw/zinc/42/88/10/1123428810.db2.gz QEEPQUVBPBXUOU-RDJZCZTQSA-N 1 3 266.473 3.667 20 0 CHADHO CCN1CCC[C@H](C[NH2+]Cc2c(C)oc3ccccc32)C1 ZINC001648959995 1123441869 /nfs/dbraw/zinc/44/18/69/1123441869.db2.gz IPDJXCUXNZEEBM-OAHLLOKOSA-N 1 3 286.419 3.563 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1C[N@@H+]1CC[C@@H](CN(C)CC2CC2)C1 ZINC000443641870 1123456215 /nfs/dbraw/zinc/45/62/15/1123456215.db2.gz MRBLKZGEDCDJHB-YTQUADARSA-N 1 3 290.495 3.643 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1C[N@H+]1CC[C@@H](CN(C)CC2CC2)C1 ZINC000443641870 1123456218 /nfs/dbraw/zinc/45/62/18/1123456218.db2.gz MRBLKZGEDCDJHB-YTQUADARSA-N 1 3 290.495 3.643 20 0 CHADHO C[C@@H]1CCC[C@@H](CC[N@@H+]2CCC[C@@H](N(C)C)CC2)C1 ZINC000429531813 1123557965 /nfs/dbraw/zinc/55/79/65/1123557965.db2.gz WRDALCDVBXFXBG-IXDOHACOSA-N 1 3 266.473 3.619 20 0 CHADHO C[C@@H]1CCC[C@@H](CC[N@H+]2CCC[C@@H](N(C)C)CC2)C1 ZINC000429531813 1123557967 /nfs/dbraw/zinc/55/79/67/1123557967.db2.gz WRDALCDVBXFXBG-IXDOHACOSA-N 1 3 266.473 3.619 20 0 CHADHO C[C@@H]1CCN1C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168038973 1123559453 /nfs/dbraw/zinc/55/94/53/1123559453.db2.gz AQGNHSLKJBKQKB-BZUAXINKSA-N 1 3 272.436 3.522 20 0 CHADHO CN(C)[C@H]1CCC[N@H+](CC2CCC(C)(C)CC2)CC1 ZINC000429541296 1123595011 /nfs/dbraw/zinc/59/50/11/1123595011.db2.gz OHXJNGZJELDBDN-INIZCTEOSA-N 1 3 266.473 3.619 20 0 CHADHO CN(C)[C@H]1CCC[N@@H+](CC2CCC(C)(C)CC2)CC1 ZINC000429541296 1123595013 /nfs/dbraw/zinc/59/50/13/1123595013.db2.gz OHXJNGZJELDBDN-INIZCTEOSA-N 1 3 266.473 3.619 20 0 CHADHO C[C@@H]([NH3+])[C@@H]1CCN(Cc2ccc(-c3ccccc3)s2)C1 ZINC000346694001 1123706624 /nfs/dbraw/zinc/70/66/24/1123706624.db2.gz RBFYYLJRRZIMIO-UKRRQHHQSA-N 1 3 286.444 3.584 20 0 CHADHO C[C@H](CC[NH2+][C@@H]1CCCc2sccc21)N1CCCCC1 ZINC000346876263 1123728850 /nfs/dbraw/zinc/72/88/50/1123728850.db2.gz JQNPUHWXVALQHM-GDBMZVCRSA-N 1 3 292.492 3.980 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1C[N@@H+]1CCCC12CCN(C)CC2 ZINC000475131410 1123796768 /nfs/dbraw/zinc/79/67/68/1123796768.db2.gz RNSILQGMBSXIDN-IRXDYDNUSA-N 1 3 276.468 3.539 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1C[N@H+]1CCCC12CCN(C)CC2 ZINC000475131410 1123796770 /nfs/dbraw/zinc/79/67/70/1123796770.db2.gz RNSILQGMBSXIDN-IRXDYDNUSA-N 1 3 276.468 3.539 20 0 CHADHO CC1(CC[NH2+][C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)CC1 ZINC000475216109 1123825425 /nfs/dbraw/zinc/82/54/25/1123825425.db2.gz MZAVGQOSRDDNKX-CEXWTWQISA-N 1 3 298.474 3.677 20 0 CHADHO CS[C@H]1C[C@H](NC2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)C1 ZINC000866486346 1124071564 /nfs/dbraw/zinc/07/15/64/1124071564.db2.gz FDHHQFWLVLLPNH-MXASKKJJSA-N 1 3 296.524 3.513 20 0 CHADHO CS[C@H]1C[C@H]([NH2+]C2CCN([C@H]3CCC[C@@H](C)C3)CC2)C1 ZINC000866486346 1124071566 /nfs/dbraw/zinc/07/15/66/1124071566.db2.gz FDHHQFWLVLLPNH-MXASKKJJSA-N 1 3 296.524 3.513 20 0 CHADHO CCC[C@@H]([NH2+]C[C@H]1CCCN(CC)C1)c1cc(C)ccn1 ZINC001118991242 1131244271 /nfs/dbraw/zinc/24/42/71/1131244271.db2.gz JPCVFGAOJBWKMY-IAGOWNOFSA-N 1 3 289.467 3.553 20 0 CHADHO CC[NH+]1CCC(N[C@H]2C[C@H](C(C)C)c3ccccc32)CC1 ZINC000447521197 1124479699 /nfs/dbraw/zinc/47/96/99/1124479699.db2.gz VPSNXKOZRILUNH-MOPGFXCFSA-N 1 3 286.463 3.945 20 0 CHADHO CC(C)[C@H]1C[C@@H](N[C@@H]2CC[N@H+](C)[C@@H](C)C2)c2ccccc21 ZINC000448026529 1124555555 /nfs/dbraw/zinc/55/55/55/1124555555.db2.gz INWLQYCGDSGEMI-OSGQAZFXSA-N 1 3 286.463 3.943 20 0 CHADHO CC(C)[C@H]1C[C@@H](N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c2ccccc21 ZINC000448026529 1124555558 /nfs/dbraw/zinc/55/55/58/1124555558.db2.gz INWLQYCGDSGEMI-OSGQAZFXSA-N 1 3 286.463 3.943 20 0 CHADHO C[C@H](Cc1coc2ccccc12)N[C@@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000449083018 1124646415 /nfs/dbraw/zinc/64/64/15/1124646415.db2.gz RREOHVGDDBOFFD-OLMNPRSZSA-N 1 3 298.430 3.580 20 0 CHADHO C[C@H](Cc1coc2ccccc12)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000449083018 1124646418 /nfs/dbraw/zinc/64/64/18/1124646418.db2.gz RREOHVGDDBOFFD-OLMNPRSZSA-N 1 3 298.430 3.580 20 0 CHADHO CC(C)(C)CC(C)(C)[NH+]1CCC(N[C@H]2CCSC2)CC1 ZINC000449178524 1124661238 /nfs/dbraw/zinc/66/12/38/1124661238.db2.gz XNAUMSPSRXYZOJ-HNNXBMFYSA-N 1 3 298.540 3.761 20 0 CHADHO C[C@@H]1CC[C@H](C)[C@@H]([NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000449187355 1124668861 /nfs/dbraw/zinc/66/88/61/1124668861.db2.gz QMDYEKUCJVEUJC-VKJFTORMSA-N 1 3 278.484 3.808 20 0 CHADHO Cc1ccc(C2(CN[C@@H]3CC[N@@H+]4CCC[C@H]4C3)CC2)c(C)c1 ZINC000449378326 1124715552 /nfs/dbraw/zinc/71/55/52/1124715552.db2.gz QYYAWXDSAXUXHK-MSOLQXFVSA-N 1 3 298.474 3.551 20 0 CHADHO Cc1ccc(C2(CN[C@@H]3CC[N@H+]4CCC[C@H]4C3)CC2)c(C)c1 ZINC000449378326 1124715558 /nfs/dbraw/zinc/71/55/58/1124715558.db2.gz QYYAWXDSAXUXHK-MSOLQXFVSA-N 1 3 298.474 3.551 20 0 CHADHO CC/C=C\CNC1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449463655 1124759144 /nfs/dbraw/zinc/75/91/44/1124759144.db2.gz XDZZGIBDOGJRFA-LYLYKKCESA-N 1 3 286.463 3.638 20 0 CHADHO C[C@H](NCc1ccc(F)cc1)c1cccc(C[NH+](C)C)c1 ZINC000820803430 1131302886 /nfs/dbraw/zinc/30/28/86/1131302886.db2.gz VWPDZNITZDNAEN-AWEZNQCLSA-N 1 3 286.394 3.738 20 0 CHADHO C[C@H](c1cc2ccccc2o1)[N@H+](C)CC[C@@H]1CCCN1C ZINC000124848118 1124895153 /nfs/dbraw/zinc/89/51/53/1124895153.db2.gz YFYOXQADFFOHCO-ZBFHGGJFSA-N 1 3 286.419 3.910 20 0 CHADHO C[C@H](c1cc2ccccc2o1)[N@@H+](C)CC[C@@H]1CCCN1C ZINC000124848118 1124895161 /nfs/dbraw/zinc/89/51/61/1124895161.db2.gz YFYOXQADFFOHCO-ZBFHGGJFSA-N 1 3 286.419 3.910 20 0 CHADHO CC[C@H](Cc1ccc(C)cc1)[N@H+](C)CCCN(CC)CC ZINC001307495163 1124936120 /nfs/dbraw/zinc/93/61/20/1124936120.db2.gz BTFAIFUNTUCPQC-LJQANCHMSA-N 1 3 290.495 3.980 20 0 CHADHO CC[C@H](Cc1ccc(C)cc1)[N@@H+](C)CCCN(CC)CC ZINC001307495163 1124936123 /nfs/dbraw/zinc/93/61/23/1124936123.db2.gz BTFAIFUNTUCPQC-LJQANCHMSA-N 1 3 290.495 3.980 20 0 CHADHO CC[C@H](Cc1ccc(C)cc1)N(C)CCC[NH+](CC)CC ZINC001307495163 1124936125 /nfs/dbraw/zinc/93/61/25/1124936125.db2.gz BTFAIFUNTUCPQC-LJQANCHMSA-N 1 3 290.495 3.980 20 0 CHADHO CCC[NH+]1CCC(N(C)C[C@H]2CCCCC2(F)F)CC1 ZINC000450467950 1125037810 /nfs/dbraw/zinc/03/78/10/1125037810.db2.gz MQTRHCVOZAYFLC-CQSZACIVSA-N 1 3 288.426 3.618 20 0 CHADHO CC(C)(C)C1CCC(NC[C@]2(F)CCCC[NH2+]C2)CC1 ZINC001246110186 1131329693 /nfs/dbraw/zinc/32/96/93/1131329693.db2.gz HNXOIRZANJNHRH-DQPZFDDXSA-N 1 3 284.463 3.663 20 0 CHADHO CC[C@@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)c1ccc(F)cc1 ZINC000125950716 1125452868 /nfs/dbraw/zinc/45/28/68/1125452868.db2.gz UQCPYZUWSBXLLW-CRAIPNDOSA-N 1 3 292.442 3.987 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCCN1)c1cc2ccccc2s1 ZINC000643502298 1129443012 /nfs/dbraw/zinc/44/30/12/1129443012.db2.gz CDWSMIWQBRZLSU-JSGCOSHPSA-N 1 3 274.433 3.694 20 0 CHADHO C1CC2(C1)C[C@@H]([NH2+][C@@H]1CCCC13CCCCC3)CCN2 ZINC000643548698 1129446189 /nfs/dbraw/zinc/44/61/89/1129446189.db2.gz TYGBRWYIVLCMOY-JKSUJKDBSA-N 1 3 276.468 3.754 20 0 CHADHO Cc1ccc([C@H](N[C@@H]2CC[NH2+]C3(CCC3)C2)C2CC2)cc1 ZINC000643549059 1129446194 /nfs/dbraw/zinc/44/61/94/1129446194.db2.gz ZRPHRSYYLZNMEF-MSOLQXFVSA-N 1 3 284.447 3.710 20 0 CHADHO C[C@H]1SCC[C@@H]1NC1CC[NH+]([C@H]2CCCC[C@H]2C)CC1 ZINC000647358839 1129575302 /nfs/dbraw/zinc/57/53/02/1129575302.db2.gz YNZKZQSBKZMAIF-JHNDHUHGSA-N 1 3 296.524 3.513 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)N1CCC(C)([NH3+])CC1 ZINC000647925297 1129587858 /nfs/dbraw/zinc/58/78/58/1129587858.db2.gz CFXILKMEFBZXJG-CQSZACIVSA-N 1 3 268.404 3.714 20 0 CHADHO Cc1ccc(CN[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc12 ZINC001169099558 1129696563 /nfs/dbraw/zinc/69/65/63/1129696563.db2.gz BHLILDXPXRBRCS-NNZMDNLPSA-N 1 3 294.442 3.863 20 0 CHADHO Cc1ccc(CN[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc12 ZINC001169099558 1129696567 /nfs/dbraw/zinc/69/65/67/1129696567.db2.gz BHLILDXPXRBRCS-NNZMDNLPSA-N 1 3 294.442 3.863 20 0 CHADHO CC(C)[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)N2C)c1ccccc1F ZINC001169101180 1129697869 /nfs/dbraw/zinc/69/78/69/1129697869.db2.gz OQWYQXVDAAGYQS-ZXFNITATSA-N 1 3 290.426 3.738 20 0 CHADHO Cc1ccc2c(c1)[C@@H](N[C@@H]1C[C@H]3CC[C@@H](C1)[N@H+]3C)CCC2 ZINC001169124368 1129701519 /nfs/dbraw/zinc/70/15/19/1129701519.db2.gz QNLAMVSBSRTBSE-BMFAXAFESA-N 1 3 284.447 3.587 20 0 CHADHO Cc1ccc2c(c1)[C@@H](N[C@@H]1C[C@H]3CC[C@@H](C1)[N@@H+]3C)CCC2 ZINC001169124368 1129701520 /nfs/dbraw/zinc/70/15/20/1129701520.db2.gz QNLAMVSBSRTBSE-BMFAXAFESA-N 1 3 284.447 3.587 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](NCc1cccc3sccc31)C2 ZINC001169107879 1129703678 /nfs/dbraw/zinc/70/36/78/1129703678.db2.gz MAIWEVDDOFJLMQ-QDMKHBRRSA-N 1 3 286.444 3.616 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](NCc1cccc3sccc31)C2 ZINC001169107879 1129703680 /nfs/dbraw/zinc/70/36/80/1129703680.db2.gz MAIWEVDDOFJLMQ-QDMKHBRRSA-N 1 3 286.444 3.616 20 0 CHADHO [NH3+]Cc1ccc(CN[C@@H](CC2CC2)c2ccccc2)c(F)c1 ZINC000650753102 1129721435 /nfs/dbraw/zinc/72/14/35/1129721435.db2.gz GUVRBLOUQOJUGP-IBGZPJMESA-N 1 3 298.405 3.915 20 0 CHADHO CN(CC/C=C\c1ccccc1)CCC[NH+]1CCCC1 ZINC001169761259 1129755292 /nfs/dbraw/zinc/75/52/92/1129755292.db2.gz GLWZGICDZNJIHT-XGICHPGQSA-N 1 3 272.436 3.508 20 0 CHADHO C[C@@H]1CCC[C@@H](N2CCC([NH2+]C3(C4CCC4)CC3)CC2)C1 ZINC000652272766 1129761955 /nfs/dbraw/zinc/76/19/55/1129761955.db2.gz VYMQBCZPISNQGN-CRAIPNDOSA-N 1 3 290.495 3.952 20 0 CHADHO [NH3+][C@H]1C[C@H](NCCC2CCC(F)(F)CC2)c2ccccc21 ZINC000902456691 1130012468 /nfs/dbraw/zinc/01/24/68/1130012468.db2.gz QPFOOQFAWTWDHT-HOTGVXAUSA-N 1 3 294.389 3.936 20 0 CHADHO C[NH+](C)Cc1ccccc1-c1ccc2c(N)ccnc2c1 ZINC001239683088 1130052526 /nfs/dbraw/zinc/05/25/26/1130052526.db2.gz GMYGFIDNABQBGC-UHFFFAOYSA-N 1 3 277.371 3.546 20 0 CHADHO C[C@@H](N[C@@H](CC[NH+](C)C)c1cccnc1)C1CCCCC1 ZINC000903383579 1130169092 /nfs/dbraw/zinc/16/90/92/1130169092.db2.gz NOBUUAHUYWLOCD-QAPCUYQASA-N 1 3 289.467 3.633 20 0 CHADHO CCCC(CCC)N[C@H](CC[NH+](C)C)c1cccnc1 ZINC000903384997 1130169952 /nfs/dbraw/zinc/16/99/52/1130169952.db2.gz UWNGJKGRQWGZEG-QGZVFWFLSA-N 1 3 277.456 3.633 20 0 CHADHO CCC(CC)[C@H](NC[C@H]([NH3+])CC(F)F)c1ccccc1 ZINC000903925602 1130210172 /nfs/dbraw/zinc/21/01/72/1130210172.db2.gz OUMFWYGWWBMGID-ZBFHGGJFSA-N 1 3 284.394 3.736 20 0 CHADHO C[N@@H+]1CCC[C@@H](NC(C)(C)c2ccc(Cl)cc2)CC1 ZINC001254501764 1130255315 /nfs/dbraw/zinc/25/53/15/1130255315.db2.gz XKCYGIYEHBOALH-OAHLLOKOSA-N 1 3 280.843 3.649 20 0 CHADHO C[N@H+]1CCC[C@@H](NC(C)(C)c2ccc(Cl)cc2)CC1 ZINC001254501764 1130255321 /nfs/dbraw/zinc/25/53/21/1130255321.db2.gz XKCYGIYEHBOALH-OAHLLOKOSA-N 1 3 280.843 3.649 20 0 CHADHO C[C@@H]1CC[C@H]([NH+]2CCC3(CN(Cc4ccccc4)C3)CC2)C1 ZINC001170150314 1130357427 /nfs/dbraw/zinc/35/74/27/1130357427.db2.gz NQHGAMZZHVRXAV-MJGOQNOKSA-N 1 3 298.474 3.773 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+][C@H](CC1CC1)c1ccccc1 ZINC000678776497 1130454064 /nfs/dbraw/zinc/45/40/64/1130454064.db2.gz GAJHQLLQWAQNMV-QZTJIDSGSA-N 1 3 272.436 3.602 20 0 CHADHO C[N@@H+]1CCC[C@@H]1CCN[C@H](CC1CC1)c1ccccc1 ZINC000678776497 1130454067 /nfs/dbraw/zinc/45/40/67/1130454067.db2.gz GAJHQLLQWAQNMV-QZTJIDSGSA-N 1 3 272.436 3.602 20 0 CHADHO C[N@H+]1CCC[C@@H]1CCN[C@H](CC1CC1)c1ccccc1 ZINC000678776497 1130454072 /nfs/dbraw/zinc/45/40/72/1130454072.db2.gz GAJHQLLQWAQNMV-QZTJIDSGSA-N 1 3 272.436 3.602 20 0 CHADHO CC1(C)CC[C@H]1[NH2+]C1CCN(CC2CCCCC2)CC1 ZINC000793523020 1130562162 /nfs/dbraw/zinc/56/21/62/1130562162.db2.gz DFNWUNTZKFKSBS-QGZVFWFLSA-N 1 3 278.484 3.809 20 0 CHADHO C=Cc1ccc(C[NH2+]C2CCN(C(C)(C)C)CC2)cc1 ZINC001256562376 1130676443 /nfs/dbraw/zinc/67/64/43/1130676443.db2.gz SJJKNKVMSQVEDI-UHFFFAOYSA-N 1 3 272.436 3.682 20 0 CHADHO c1ccc2cc(CN3CCC[C@@]4(CCC[NH2+]4)CC3)ccc2c1 ZINC001235039894 1130705759 /nfs/dbraw/zinc/70/57/59/1130705759.db2.gz JBEGMJPFUCBHOJ-FQEVSTJZSA-N 1 3 294.442 3.948 20 0 CHADHO c1cc(C[N@H+]2CCCC23CCNCC3)c2cccccc1-2 ZINC001235145205 1130715446 /nfs/dbraw/zinc/71/54/46/1130715446.db2.gz QGSDWKRLTOJWJR-UHFFFAOYSA-N 1 3 280.415 3.509 20 0 CHADHO c1cc(C[N@@H+]2CCCC23CCNCC3)c2cccccc1-2 ZINC001235145205 1130715441 /nfs/dbraw/zinc/71/54/41/1130715441.db2.gz QGSDWKRLTOJWJR-UHFFFAOYSA-N 1 3 280.415 3.509 20 0 CHADHO C[C@H](N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccc[nH]1 ZINC000781515910 1130722440 /nfs/dbraw/zinc/72/24/40/1130722440.db2.gz AVYONHUWZKGVCK-SOLBZPMBSA-N 1 3 297.446 3.718 20 0 CHADHO C[C@H](N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccc[nH]1 ZINC000781515910 1130722443 /nfs/dbraw/zinc/72/24/43/1130722443.db2.gz AVYONHUWZKGVCK-SOLBZPMBSA-N 1 3 297.446 3.718 20 0 CHADHO [NH3+]C[C@H]1CCCN(Cc2cccc(-c3ccsc3)c2)C1 ZINC001235672297 1130764089 /nfs/dbraw/zinc/76/40/89/1130764089.db2.gz AEQCMLQUJXMRGN-OAHLLOKOSA-N 1 3 286.444 3.586 20 0 CHADHO CC(C)c1ccc(C[C@H](C)C[N@@H+]2CCC[C@@H](CN)C2)cc1 ZINC001235672848 1130764440 /nfs/dbraw/zinc/76/44/40/1130764440.db2.gz IOGXCQBDFKJLAE-WMZOPIPTSA-N 1 3 288.479 3.659 20 0 CHADHO CC(C)c1ccc(C[C@H](C)C[N@H+]2CCC[C@@H](CN)C2)cc1 ZINC001235672848 1130764446 /nfs/dbraw/zinc/76/44/46/1130764446.db2.gz IOGXCQBDFKJLAE-WMZOPIPTSA-N 1 3 288.479 3.659 20 0 CHADHO CCN(Cc1ccc(C(C)(C)CC)cc1)C1CC[NH2+]CC1 ZINC001235760797 1130776446 /nfs/dbraw/zinc/77/64/46/1130776446.db2.gz KVXBFJXHUPGALB-UHFFFAOYSA-N 1 3 288.479 3.948 20 0 CHADHO CCC(C)(C)c1ccc(CN2[C@@H]3CC[C@H]2C[C@@H]([NH3+])C3)cc1 ZINC001235808739 1130782428 /nfs/dbraw/zinc/78/24/28/1130782428.db2.gz GAZGMHGVSKIJCC-BCDXTJNWSA-N 1 3 286.463 3.828 20 0 CHADHO c1cc(C2CCCCC2)ccc1CN1C[C@H]2C[NH2+]CC[C@@H]2C1 ZINC001235934787 1130810775 /nfs/dbraw/zinc/81/07/75/1130810775.db2.gz ALEYGGSCMXRREM-WOJBJXKFSA-N 1 3 298.474 3.776 20 0 CHADHO CCCCCCN(CCCCCC)Cc1c[nH]c(N)[nH+]1 ZINC001235947425 1130813158 /nfs/dbraw/zinc/81/31/58/1130813158.db2.gz BRDGKHUDRAKTHR-UHFFFAOYSA-N 1 3 280.460 3.955 20 0 CHADHO CC(C)[N@H+](CCN)Cc1ccc(-c2ccccc2)cc1 ZINC001235948877 1130814162 /nfs/dbraw/zinc/81/41/62/1130814162.db2.gz VHWLFPWQQOMAQL-UHFFFAOYSA-N 1 3 268.404 3.523 20 0 CHADHO CC(C)[N@@H+](CCN)Cc1ccc(-c2ccccc2)cc1 ZINC001235948877 1130814169 /nfs/dbraw/zinc/81/41/69/1130814169.db2.gz VHWLFPWQQOMAQL-UHFFFAOYSA-N 1 3 268.404 3.523 20 0 CHADHO Cc1c2ccccc2sc1CN(C)C[C@H]1CCC[NH2+]C1 ZINC001235950629 1130815739 /nfs/dbraw/zinc/81/57/39/1130815739.db2.gz JFRNHDDLAFNRNI-AWEZNQCLSA-N 1 3 288.460 3.641 20 0 CHADHO CC1(C)[C@@H]2C[C@@H]([NH2+]C3CCN(CC4CCCC4)CC3)C[C@@H]21 ZINC001170729225 1130829581 /nfs/dbraw/zinc/82/95/81/1130829581.db2.gz BMZOMIMJERIKKQ-NNZMDNLPSA-N 1 3 290.495 3.665 20 0 CHADHO Cc1ccc(CN2CC3(C2)CCC[NH2+]CC3)c(C)c1Cl ZINC001236007231 1130829932 /nfs/dbraw/zinc/82/99/32/1130829932.db2.gz UPODYMVOPZWHRF-UHFFFAOYSA-N 1 3 292.854 3.532 20 0 CHADHO C[C@@H]1C[C@@H](N)C[N@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001236044878 1130838127 /nfs/dbraw/zinc/83/81/27/1130838127.db2.gz AQXQNHUZUPZECV-UKRRQHHQSA-N 1 3 294.398 3.755 20 0 CHADHO C[C@@H]1C[C@@H](N)C[N@@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001236044878 1130838130 /nfs/dbraw/zinc/83/81/30/1130838130.db2.gz AQXQNHUZUPZECV-UKRRQHHQSA-N 1 3 294.398 3.755 20 0 CHADHO CC(C)Cc1ccc(C[N@H+](C)[C@H]2CCCC[C@H]2N)cc1 ZINC001236218025 1130894160 /nfs/dbraw/zinc/89/41/60/1130894160.db2.gz RANWRIJYTBYGOH-MSOLQXFVSA-N 1 3 274.452 3.587 20 0 CHADHO CC(C)Cc1ccc(C[N@@H+](C)[C@H]2CCCC[C@H]2N)cc1 ZINC001236218025 1130894163 /nfs/dbraw/zinc/89/41/63/1130894163.db2.gz RANWRIJYTBYGOH-MSOLQXFVSA-N 1 3 274.452 3.587 20 0 CHADHO CC/C=C\CC[N@H+](Cc1ccccc1)C1CCNCC1 ZINC001236288148 1130910996 /nfs/dbraw/zinc/91/09/96/1130910996.db2.gz WKBYIPIIUKFZIT-ARJAWSKDSA-N 1 3 272.436 3.597 20 0 CHADHO CC/C=C\CC[N@@H+](Cc1ccccc1)C1CCNCC1 ZINC001236288148 1130911001 /nfs/dbraw/zinc/91/10/01/1130911001.db2.gz WKBYIPIIUKFZIT-ARJAWSKDSA-N 1 3 272.436 3.597 20 0 CHADHO CC/C=C\CCN(Cc1ccccc1)C1CC[NH2+]CC1 ZINC001236288148 1130911007 /nfs/dbraw/zinc/91/10/07/1130911007.db2.gz WKBYIPIIUKFZIT-ARJAWSKDSA-N 1 3 272.436 3.597 20 0 CHADHO Cc1cccc(C)c1C[N@H+](CC(C)(C)C)C1CCNCC1 ZINC001236458167 1130946670 /nfs/dbraw/zinc/94/66/70/1130946670.db2.gz RVXJWLMSKFHSHY-UHFFFAOYSA-N 1 3 288.479 3.904 20 0 CHADHO Cc1cccc(C)c1C[N@@H+](CC(C)(C)C)C1CCNCC1 ZINC001236458167 1130946672 /nfs/dbraw/zinc/94/66/72/1130946672.db2.gz RVXJWLMSKFHSHY-UHFFFAOYSA-N 1 3 288.479 3.904 20 0 CHADHO CCCCCN(Cc1ccc(F)cc1C)C1CC[NH2+]CC1 ZINC001236516772 1130961675 /nfs/dbraw/zinc/96/16/75/1130961675.db2.gz IGRBFQGAXLQMHO-UHFFFAOYSA-N 1 3 292.442 3.878 20 0 CHADHO CCCCC[N@H+](Cc1ccc(F)cc1C)C1CCNCC1 ZINC001236516772 1130961679 /nfs/dbraw/zinc/96/16/79/1130961679.db2.gz IGRBFQGAXLQMHO-UHFFFAOYSA-N 1 3 292.442 3.878 20 0 CHADHO CCCCC[N@@H+](Cc1ccc(F)cc1C)C1CCNCC1 ZINC001236516772 1130961683 /nfs/dbraw/zinc/96/16/83/1130961683.db2.gz IGRBFQGAXLQMHO-UHFFFAOYSA-N 1 3 292.442 3.878 20 0 CHADHO C[C@H](CC[N@H+](C[C@@H]1CCCNC1)C1CC1)CC(C)(C)C ZINC001236584550 1130980270 /nfs/dbraw/zinc/98/02/70/1130980270.db2.gz LURVNLRTXIGCKM-HZPDHXFCSA-N 1 3 280.500 3.913 20 0 CHADHO C[C@H](CC[N@@H+](C[C@@H]1CCCNC1)C1CC1)CC(C)(C)C ZINC001236584550 1130980273 /nfs/dbraw/zinc/98/02/73/1130980273.db2.gz LURVNLRTXIGCKM-HZPDHXFCSA-N 1 3 280.500 3.913 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CC[C@](C)(CN)C1 ZINC001236604795 1130984255 /nfs/dbraw/zinc/98/42/55/1130984255.db2.gz OBCQFFDQMYKPKV-YIEVGGLXSA-N 1 3 252.446 3.574 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CC[C@](C)(CN)C1 ZINC001236604795 1130984258 /nfs/dbraw/zinc/98/42/58/1130984258.db2.gz OBCQFFDQMYKPKV-YIEVGGLXSA-N 1 3 252.446 3.574 20 0 CHADHO c1ccc(C2CC2)c(C[N@H+](C2CCC2)C2CCNCC2)c1 ZINC001236634353 1130986744 /nfs/dbraw/zinc/98/67/44/1130986744.db2.gz RYFUTLMAPZUVKH-UHFFFAOYSA-N 1 3 284.447 3.671 20 0 CHADHO c1ccc(C2CC2)c(C[N@@H+](C2CCC2)C2CCNCC2)c1 ZINC001236634353 1130986749 /nfs/dbraw/zinc/98/67/49/1130986749.db2.gz RYFUTLMAPZUVKH-UHFFFAOYSA-N 1 3 284.447 3.671 20 0 CHADHO c1ccc(C2CC2)c(CN(C2CCC2)C2CC[NH2+]CC2)c1 ZINC001236634353 1130986751 /nfs/dbraw/zinc/98/67/51/1130986751.db2.gz RYFUTLMAPZUVKH-UHFFFAOYSA-N 1 3 284.447 3.671 20 0 CHADHO CCc1cccc(C)c1C[N@H+](C1CCC1)C1CCNCC1 ZINC001236637113 1130987710 /nfs/dbraw/zinc/98/77/10/1130987710.db2.gz MPDAHBHGHSSWSC-UHFFFAOYSA-N 1 3 286.463 3.664 20 0 CHADHO CCc1cccc(C)c1C[N@@H+](C1CCC1)C1CCNCC1 ZINC001236637113 1130987712 /nfs/dbraw/zinc/98/77/12/1130987712.db2.gz MPDAHBHGHSSWSC-UHFFFAOYSA-N 1 3 286.463 3.664 20 0 CHADHO CCCN(Cc1cccc(C(C)(C)C)c1)C[C@H]1CC[NH2+]C1 ZINC001236836822 1131020050 /nfs/dbraw/zinc/02/00/50/1131020050.db2.gz YGSGQHVUFXFLPG-KRWDZBQOSA-N 1 3 288.479 3.806 20 0 CHADHO CCCN(Cc1ccc(F)c(C2CC2)c1)C[C@@H]1CC[NH2+]C1 ZINC001236843540 1131021779 /nfs/dbraw/zinc/02/17/79/1131021779.db2.gz JSGNCSLJVSACJF-OAHLLOKOSA-N 1 3 290.426 3.525 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+]3CCCC34CC4)cc21 ZINC001237881890 1131148357 /nfs/dbraw/zinc/14/83/57/1131148357.db2.gz YWHSBJIOZAHENH-UHFFFAOYSA-N 1 3 282.431 3.816 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+]3CCCC34CC4)cc21 ZINC001237881890 1131148359 /nfs/dbraw/zinc/14/83/59/1131148359.db2.gz YWHSBJIOZAHENH-UHFFFAOYSA-N 1 3 282.431 3.816 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+]3C[C@H]4CC[C@@H]3C4)cc21 ZINC001237886490 1131148388 /nfs/dbraw/zinc/14/83/88/1131148388.db2.gz OATLSZCMWMBZLA-WMLDXEAASA-N 1 3 282.431 3.672 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+]3C[C@H]4CC[C@@H]3C4)cc21 ZINC001237886490 1131148392 /nfs/dbraw/zinc/14/83/92/1131148392.db2.gz OATLSZCMWMBZLA-WMLDXEAASA-N 1 3 282.431 3.672 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC1CCCCCCC1 ZINC000817889130 1131185596 /nfs/dbraw/zinc/18/55/96/1131185596.db2.gz MPUBZNFFRLEBDQ-AWEZNQCLSA-N 1 3 289.467 3.860 20 0 CHADHO C[C@@H](NCc1ccc(CC[NH3+])cc1)c1cccc(Cl)c1 ZINC000817946925 1131189662 /nfs/dbraw/zinc/18/96/62/1131189662.db2.gz ICVPKSURHNKYJW-CYBMUJFWSA-N 1 3 288.822 3.692 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@H](C)Cc2ccccc2Cl)C1 ZINC001117639460 1131189960 /nfs/dbraw/zinc/18/99/60/1131189960.db2.gz HTGVJGDJBWJOCD-HUUCEWRRSA-N 1 3 294.870 3.591 20 0 CHADHO CCN1CCC[C@@H](C[NH2+][C@@H](C)c2nccc3ccccc32)C1 ZINC001117671528 1131191200 /nfs/dbraw/zinc/19/12/00/1131191200.db2.gz KASHBMGUUJBNRT-HOTGVXAUSA-N 1 3 297.446 3.617 20 0 CHADHO CCOc1cccc([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000817962157 1131192972 /nfs/dbraw/zinc/19/29/72/1131192972.db2.gz GOGMOHOPCCQDHL-LSDHHAIUSA-N 1 3 298.430 3.956 20 0 CHADHO COc1c(C)cc([C@H](C)N[C@H]2CCC[C@H]([NH3+])C2)cc1Cl ZINC000817970355 1131194006 /nfs/dbraw/zinc/19/40/06/1131194006.db2.gz RZSNGJAEPQYWCU-UBHSHLNASA-N 1 3 296.842 3.578 20 0 CHADHO C[C@@H](CC(C)(C)SCc1ccco1)[NH2+]CC(C)(C)CN ZINC001246252452 1131432300 /nfs/dbraw/zinc/43/23/00/1131432300.db2.gz WDZLWWHYXFSQQZ-ZDUSSCGKSA-N 1 3 298.496 3.645 20 0 CHADHO C[C@@H](CSc1ccc(Cl)cc1)NCCC(C)(C)[NH3+] ZINC001246274967 1131440251 /nfs/dbraw/zinc/44/02/51/1131440251.db2.gz XSXOCHXLMBMACH-NSHDSACASA-N 1 3 286.872 3.538 20 0 CHADHO CC[C@H]([NH3+])CCN[C@H](C)Cc1ccc(Cl)cc1Cl ZINC001246307714 1131457140 /nfs/dbraw/zinc/45/71/40/1131457140.db2.gz NXOKGETZQQVMMQ-MFKMUULPSA-N 1 3 289.250 3.641 20 0 CHADHO CCCC[C@H](CC(C)C)[N@@H+]1CCC[C@H](CN)[C@@H]1C ZINC001246566709 1131633145 /nfs/dbraw/zinc/63/31/45/1131633145.db2.gz UYZUMAIXQIOVLP-ARFHVFGLSA-N 1 3 254.462 3.651 20 0 CHADHO CCCC[C@H](CC(C)C)[N@H+]1CCC[C@H](CN)[C@@H]1C ZINC001246566709 1131633147 /nfs/dbraw/zinc/63/31/47/1131633147.db2.gz UYZUMAIXQIOVLP-ARFHVFGLSA-N 1 3 254.462 3.651 20 0 CHADHO C[C@@]1(CN)CCCC[N@@H+](C2CCC(C(F)(F)F)CC2)C1 ZINC001246587234 1131698393 /nfs/dbraw/zinc/69/83/93/1131698393.db2.gz WFXDYJSTKKUMRO-RUXDESIVSA-N 1 3 292.389 3.558 20 0 CHADHO C[C@@]1(CN)CCCC[N@H+](C2CCC(C(F)(F)F)CC2)C1 ZINC001246587234 1131698395 /nfs/dbraw/zinc/69/83/95/1131698395.db2.gz WFXDYJSTKKUMRO-RUXDESIVSA-N 1 3 292.389 3.558 20 0 CHADHO C[C@@]1(C[NH3+])CCCCN(C2CCC(C(F)(F)F)CC2)C1 ZINC001246587234 1131698397 /nfs/dbraw/zinc/69/83/97/1131698397.db2.gz WFXDYJSTKKUMRO-RUXDESIVSA-N 1 3 292.389 3.558 20 0 CHADHO CCCCC(CCCC)[N@@H+]1CCC12CCNCC2 ZINC001246643183 1131767183 /nfs/dbraw/zinc/76/71/83/1131767183.db2.gz RJDMDMRXTYXJPJ-UHFFFAOYSA-N 1 3 252.446 3.563 20 0 CHADHO CCCCC(CCCC)[N@H+]1CCC12CCNCC2 ZINC001246643183 1131767187 /nfs/dbraw/zinc/76/71/87/1131767187.db2.gz RJDMDMRXTYXJPJ-UHFFFAOYSA-N 1 3 252.446 3.563 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@@H+]2CCCCC[C@@H]2C)CCN1 ZINC001246771587 1131782524 /nfs/dbraw/zinc/78/25/24/1131782524.db2.gz ZEVKZHOQGFSANA-ARFHVFGLSA-N 1 3 252.446 3.562 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@H+]2CCCCC[C@@H]2C)CCN1 ZINC001246771587 1131782531 /nfs/dbraw/zinc/78/25/31/1131782531.db2.gz ZEVKZHOQGFSANA-ARFHVFGLSA-N 1 3 252.446 3.562 20 0 CHADHO CCCC[C@@H]1C[C@@H]([N@H+](C)CC2CCCCC2)CCN1 ZINC001246843477 1131789383 /nfs/dbraw/zinc/78/93/83/1131789383.db2.gz CPGDQZZKGHKDLV-SJORKVTESA-N 1 3 266.473 3.809 20 0 CHADHO c1ccc(CN2C[C@@H]3C[C@H]2C[C@H]([NH2+][C@H]2CC=CCC2)C3)cc1 ZINC000716627723 1132029027 /nfs/dbraw/zinc/02/90/27/1132029027.db2.gz UAEDTMCYAWTRGH-HAGHYFMRSA-N 1 3 296.458 3.738 20 0 CHADHO C=C/C=C/CC[NH2+][C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 ZINC000716703097 1132030211 /nfs/dbraw/zinc/03/02/11/1132030211.db2.gz XNQITIVWFZXMOE-KXTSPJLFSA-N 1 3 296.458 3.761 20 0 CHADHO C[C@H]1CCC[N@@H+](C2CC(C)(C)N(C)C(C)(C)C2)CC1 ZINC001171631968 1132062840 /nfs/dbraw/zinc/06/28/40/1132062840.db2.gz RLCBZLFDNSDHDG-AWEZNQCLSA-N 1 3 266.473 3.760 20 0 CHADHO C[C@H]1CCC[N@H+](C2CC(C)(C)N(C)C(C)(C)C2)CC1 ZINC001171631968 1132062846 /nfs/dbraw/zinc/06/28/46/1132062846.db2.gz RLCBZLFDNSDHDG-AWEZNQCLSA-N 1 3 266.473 3.760 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@H]2CCCC2(C)C)CC1(C)C ZINC001171624849 1132066926 /nfs/dbraw/zinc/06/69/26/1132066926.db2.gz ZVYMOOCWHPBCTN-AWEZNQCLSA-N 1 3 266.473 3.806 20 0 CHADHO C[C@H]([NH2+]C1CC(C)(C)N(C)C(C)(C)C1)C1CCCC1 ZINC001171622937 1132067509 /nfs/dbraw/zinc/06/75/09/1132067509.db2.gz DGYZUKWBWMRLJU-ZDUSSCGKSA-N 1 3 266.473 3.806 20 0 CHADHO CCCC1([NH2+]C2CC(C)(C)N(C)C(C)(C)C2)CCC1 ZINC001171627567 1132067720 /nfs/dbraw/zinc/06/77/20/1132067720.db2.gz WYIJSDWVNGSMFF-UHFFFAOYSA-N 1 3 266.473 3.950 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CC[C@H]3CCCC[C@H]3C1)C2 ZINC001172126187 1132125278 /nfs/dbraw/zinc/12/52/78/1132125278.db2.gz UCVHNSNFTYFCNE-MDMSPXHWSA-N 1 3 276.468 3.514 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CC[C@H]3CCCC[C@H]3C1)C2 ZINC001172126187 1132125280 /nfs/dbraw/zinc/12/52/80/1132125280.db2.gz UCVHNSNFTYFCNE-MDMSPXHWSA-N 1 3 276.468 3.514 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1Cc3ccc(Cl)cc3C1)C2 ZINC001172127704 1132127099 /nfs/dbraw/zinc/12/70/99/1132127099.db2.gz KXHQFJOQBZREAT-FVQHAEBGSA-N 1 3 290.838 3.671 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1Cc3ccc(Cl)cc3C1)C2 ZINC001172127704 1132127102 /nfs/dbraw/zinc/12/71/02/1132127102.db2.gz KXHQFJOQBZREAT-FVQHAEBGSA-N 1 3 290.838 3.671 20 0 CHADHO Cc1ccc([C@H](C)N[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1C ZINC001172118612 1132131354 /nfs/dbraw/zinc/13/13/54/1132131354.db2.gz SDEMAWLJCUNUSZ-KANFNMMFSA-N 1 3 286.463 3.969 20 0 CHADHO Cc1ccc([C@H](C)N[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1C ZINC001172118612 1132131360 /nfs/dbraw/zinc/13/13/60/1132131360.db2.gz SDEMAWLJCUNUSZ-KANFNMMFSA-N 1 3 286.463 3.969 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC3(CCCC3)CC1)C2 ZINC001172120755 1132136265 /nfs/dbraw/zinc/13/62/65/1132136265.db2.gz MNDCITVVXTVNKJ-BJWYYQGGSA-N 1 3 276.468 3.658 20 0 CHADHO CC[C@H](C)OCC[C@@H](C)[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001172324984 1132161039 /nfs/dbraw/zinc/16/10/39/1132161039.db2.gz PMXWZFUPBHXZAT-CABCVRRESA-N 1 3 298.515 3.821 20 0 CHADHO CCC(CC)N1CCC([NH2+][C@@H](C)CCO[C@H](C)CC)CC1 ZINC001172332351 1132172645 /nfs/dbraw/zinc/17/26/45/1132172645.db2.gz DNLAHDSAYQZDBZ-JKSUJKDBSA-N 1 3 298.515 3.823 20 0 CHADHO CC(C)[N@H+](CCCN)C1CCC2(CCCC2)CC1 ZINC001172724041 1132297710 /nfs/dbraw/zinc/29/77/10/1132297710.db2.gz ASFKQMDWOBWNQT-UHFFFAOYSA-N 1 3 252.446 3.549 20 0 CHADHO CC(C)[N@@H+](CCCN)C1CCC2(CCCC2)CC1 ZINC001172724041 1132297715 /nfs/dbraw/zinc/29/77/15/1132297715.db2.gz ASFKQMDWOBWNQT-UHFFFAOYSA-N 1 3 252.446 3.549 20 0 CHADHO c1c2cnccc2[nH]c1C[N@@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC001232013890 1132411784 /nfs/dbraw/zinc/41/17/84/1132411784.db2.gz HQQNNUWPLHIIIO-INIZCTEOSA-N 1 3 291.398 3.628 20 0 CHADHO c1c2cnccc2[nH]c1C[N@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC001232013890 1132411788 /nfs/dbraw/zinc/41/17/88/1132411788.db2.gz HQQNNUWPLHIIIO-INIZCTEOSA-N 1 3 291.398 3.628 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@H+](C)CC2CCCC2)c1 ZINC001232146029 1132426983 /nfs/dbraw/zinc/42/69/83/1132426983.db2.gz GRFQWAVXACVYAT-UHFFFAOYSA-N 1 3 278.415 3.509 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@@H+](C)CC2CCCC2)c1 ZINC001232146029 1132426987 /nfs/dbraw/zinc/42/69/87/1132426987.db2.gz GRFQWAVXACVYAT-UHFFFAOYSA-N 1 3 278.415 3.509 20 0 CHADHO C[C@@H]1CCC[N@H+](Cc2cc(F)cc(CN(C)C)c2)[C@H]1C ZINC001232146775 1132427287 /nfs/dbraw/zinc/42/72/87/1132427287.db2.gz HCSJBNQUHHQBSA-KGLIPLIRSA-N 1 3 278.415 3.508 20 0 CHADHO C[C@@H]1CCC[N@@H+](Cc2cc(F)cc(CN(C)C)c2)[C@H]1C ZINC001232146775 1132427290 /nfs/dbraw/zinc/42/72/90/1132427290.db2.gz HCSJBNQUHHQBSA-KGLIPLIRSA-N 1 3 278.415 3.508 20 0 CHADHO C[C@H]1CCCCC[N@@H+]1Cc1cc(F)cc(CN(C)C)c1 ZINC001232146805 1132427845 /nfs/dbraw/zinc/42/78/45/1132427845.db2.gz HVPRUHULZZUYSG-AWEZNQCLSA-N 1 3 278.415 3.652 20 0 CHADHO C[C@H]1CCCCC[N@H+]1Cc1cc(F)cc(CN(C)C)c1 ZINC001232146805 1132427850 /nfs/dbraw/zinc/42/78/50/1132427850.db2.gz HVPRUHULZZUYSG-AWEZNQCLSA-N 1 3 278.415 3.652 20 0 CHADHO C[C@@H]1CC[N@H+](Cc2cc(F)cc(CN(C)C)c2)[C@@H](C)C1 ZINC001232146676 1132427912 /nfs/dbraw/zinc/42/79/12/1132427912.db2.gz YAOFNUVMMRWDFN-KGLIPLIRSA-N 1 3 278.415 3.508 20 0 CHADHO C[C@@H]1CC[N@@H+](Cc2cc(F)cc(CN(C)C)c2)[C@@H](C)C1 ZINC001232146676 1132427917 /nfs/dbraw/zinc/42/79/17/1132427917.db2.gz YAOFNUVMMRWDFN-KGLIPLIRSA-N 1 3 278.415 3.508 20 0 CHADHO CC(C)C1CC[NH+](Cc2cc(F)cc(CN(C)C)c2)CC1 ZINC001232146071 1132428255 /nfs/dbraw/zinc/42/82/55/1132428255.db2.gz IBPSNNYUDOZDFC-UHFFFAOYSA-N 1 3 292.442 3.755 20 0 CHADHO CC[C@H]1CC[C@@H]([NH2+]C2CCN(CC3CCCC3)CC2)C1 ZINC001173270073 1132435555 /nfs/dbraw/zinc/43/55/55/1132435555.db2.gz AGVDDSPGAQCTSK-MAUKXSAKSA-N 1 3 278.484 3.809 20 0 CHADHO CC[C@H]1CC[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC001173271663 1132436371 /nfs/dbraw/zinc/43/63/71/1132436371.db2.gz HONVTVWWCXQGQW-DOTOQJQBSA-N 1 3 278.484 3.952 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+]C2CCC(F)(F)CC2)C1 ZINC000842694870 1132451663 /nfs/dbraw/zinc/45/16/63/1132451663.db2.gz SVCWSODLZNQLLA-CQSZACIVSA-N 1 3 288.426 3.522 20 0 CHADHO CC1(N)CC[NH+]([C@@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173341877 1132468551 /nfs/dbraw/zinc/46/85/51/1132468551.db2.gz SACPLBHJXIMBAI-OAHLLOKOSA-N 1 3 264.457 3.693 20 0 CHADHO CC(C)C[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)c1ccncc1 ZINC000842847924 1132468930 /nfs/dbraw/zinc/46/89/30/1132468930.db2.gz DUWLYJKPLNVDGW-KSZLIROESA-N 1 3 289.467 3.631 20 0 CHADHO Cc1cnccc1Nc1cccc(C[NH+]2CCCCC2)c1 ZINC001174537781 1132898881 /nfs/dbraw/zinc/89/88/81/1132898881.db2.gz QGOCTLSASRPJQC-UHFFFAOYSA-N 1 3 281.403 3.541 20 0 CHADHO CC(C)(C)c1cc(Nc2ccccc2C[NH3+])ccn1 ZINC001159735465 1132901696 /nfs/dbraw/zinc/90/16/96/1132901696.db2.gz UTEFCBYCOBBUQG-UHFFFAOYSA-N 1 3 255.365 3.581 20 0 CHADHO CC[NH2+]Cc1cccc(Nc2ccccc2CN(C)C)c1 ZINC001159956020 1132928789 /nfs/dbraw/zinc/92/87/89/1132928789.db2.gz PVRGHRMPORVZGY-UHFFFAOYSA-N 1 3 283.419 3.601 20 0 CHADHO Cc1cc(C)nc(NCC2CC[NH+](CC3CCC3)CC2)c1 ZINC001161229415 1132995534 /nfs/dbraw/zinc/99/55/34/1132995534.db2.gz UMTUPPXNGGORSP-UHFFFAOYSA-N 1 3 287.451 3.622 20 0 CHADHO Cc1cc2cc(NC[C@H]3CCC[NH2+]C[C@@H]3C)ccc2cn1 ZINC001162472910 1133080542 /nfs/dbraw/zinc/08/05/42/1133080542.db2.gz ZQCBDYCTAAMBEL-DZGCQCFKSA-N 1 3 283.419 3.591 20 0 CHADHO CC(C)(C)C(=[NH2+])Nc1ccnc(N2CCCCC2)c1 ZINC001162664275 1133102985 /nfs/dbraw/zinc/10/29/85/1133102985.db2.gz BBJDKEYCZUZTRH-UHFFFAOYSA-N 1 3 260.385 3.507 20 0 CHADHO [NH3+]Cc1cc2cc(Cl)ccc2n1-c1c[nH]cc2ccnc1-2 ZINC001163898783 1133183967 /nfs/dbraw/zinc/18/39/67/1133183967.db2.gz YBPGFENZQAQSPT-UHFFFAOYSA-N 1 3 296.761 3.619 20 0 CHADHO [NH3+]Cc1cc2cc(Cl)ccc2n1-c1cncc2cc[nH]c21 ZINC001163898783 1133183971 /nfs/dbraw/zinc/18/39/71/1133183971.db2.gz YBPGFENZQAQSPT-UHFFFAOYSA-N 1 3 296.761 3.619 20 0 CHADHO C[C@@H]1CCC[C@@H](C)N1CCC[NH2+]C1CCCCC1 ZINC001204599353 1133465662 /nfs/dbraw/zinc/46/56/62/1133465662.db2.gz XLTQMZIKKIOQPF-HUUCEWRRSA-N 1 3 252.446 3.562 20 0 CHADHO C[NH2+]C[C@H]1CCCN(Cc2ccccc2-c2ccccc2)C1 ZINC001205008545 1133516158 /nfs/dbraw/zinc/51/61/58/1133516158.db2.gz CMLIBVYPPFJVKX-QGZVFWFLSA-N 1 3 294.442 3.785 20 0 CHADHO [NH3+][C@@H]1CCCN(Cc2ccc(-c3cccs3)cc2)CC1 ZINC001205109507 1133531277 /nfs/dbraw/zinc/53/12/77/1133531277.db2.gz HFWKSIBHFYBSFY-MRXNPFEDSA-N 1 3 286.444 3.728 20 0 CHADHO Cc1ccc(-c2cccc(CN3CCC[C@H]([NH3+])CC3)c2)cc1 ZINC001205116953 1133531827 /nfs/dbraw/zinc/53/18/27/1133531827.db2.gz JZLIFMFSWIRZLE-FQEVSTJZSA-N 1 3 294.442 3.975 20 0 CHADHO Cc1ccc(-c2cccc(CN3CCC[C@@H]([NH3+])CC3)c2)cc1 ZINC001205116954 1133532336 /nfs/dbraw/zinc/53/23/36/1133532336.db2.gz JZLIFMFSWIRZLE-HXUWFJFHSA-N 1 3 294.442 3.975 20 0 CHADHO COc1ccc2ccccc2c1CN1CCC[C@@](C)([NH3+])CC1 ZINC001205266351 1133552710 /nfs/dbraw/zinc/55/27/10/1133552710.db2.gz TZOQMHIGRJMFMI-LJQANCHMSA-N 1 3 298.430 3.552 20 0 CHADHO Cc1ccc(-c2ccc(CN3CC[C@H](C)[C@@H](C[NH3+])C3)cc2)o1 ZINC001205303601 1133557530 /nfs/dbraw/zinc/55/75/30/1133557530.db2.gz IJGITNAXGOGKKA-KSSFIOAISA-N 1 3 298.430 3.672 20 0 CHADHO C[C@@H]1CCNCC[N@@H+]1Cc1ccc(-c2cccs2)cc1 ZINC001205331024 1133562192 /nfs/dbraw/zinc/56/21/92/1133562192.db2.gz CPYVFRIIWCNKBJ-CQSZACIVSA-N 1 3 286.444 3.599 20 0 CHADHO C[C@@H]1CCNCC[N@H+]1Cc1ccc(-c2cccs2)cc1 ZINC001205331024 1133562194 /nfs/dbraw/zinc/56/21/94/1133562194.db2.gz CPYVFRIIWCNKBJ-CQSZACIVSA-N 1 3 286.444 3.599 20 0 CHADHO C[C@H](CC[N@@H+]1CCC[C@@H](CN)[C@@H]1C)CC(C)(C)C ZINC001205905162 1133629091 /nfs/dbraw/zinc/62/90/91/1133629091.db2.gz ZDNHALHDCWEQCT-ILXRZTDVSA-N 1 3 254.462 3.508 20 0 CHADHO C[C@H](CC[N@H+]1CCC[C@@H](CN)[C@@H]1C)CC(C)(C)C ZINC001205905162 1133629094 /nfs/dbraw/zinc/62/90/94/1133629094.db2.gz ZDNHALHDCWEQCT-ILXRZTDVSA-N 1 3 254.462 3.508 20 0 CHADHO CCC(C)(C)c1ccc(CN2CCC[C@H](C[NH3+])[C@H]2C)cc1 ZINC001205915626 1133629689 /nfs/dbraw/zinc/62/96/89/1133629689.db2.gz QBHYTVOJOALMKM-NVXWUHKLSA-N 1 3 288.479 3.933 20 0 CHADHO N[C@@H]1CCCC[N@H+](Cc2ccc(-c3ccc(F)cc3)cc2)C1 ZINC001205930854 1133632800 /nfs/dbraw/zinc/63/28/00/1133632800.db2.gz DTRLHTCLQJNZLU-LJQANCHMSA-N 1 3 298.405 3.806 20 0 CHADHO N[C@@H]1CCCC[N@@H+](Cc2ccc(-c3ccc(F)cc3)cc2)C1 ZINC001205930854 1133632803 /nfs/dbraw/zinc/63/28/03/1133632803.db2.gz DTRLHTCLQJNZLU-LJQANCHMSA-N 1 3 298.405 3.806 20 0 CHADHO CCC(C)(C)c1ccc(CN2CC[C@@H]([NH3+])[C@H](F)CC2)cc1 ZINC001206188836 1133669534 /nfs/dbraw/zinc/66/95/34/1133669534.db2.gz VZVAGOMCYCUIMZ-IAGOWNOFSA-N 1 3 292.442 3.635 20 0 CHADHO CCCCc1ccc(C[N@@H+]2CCCC[C@](F)(CN)C2)cc1 ZINC001206360756 1133694309 /nfs/dbraw/zinc/69/43/09/1133694309.db2.gz ATBANBJYUCHLRI-SFHVURJKSA-N 1 3 292.442 3.682 20 0 CHADHO CCCCc1ccc(C[N@H+]2CCCC[C@](F)(CN)C2)cc1 ZINC001206360756 1133694311 /nfs/dbraw/zinc/69/43/11/1133694311.db2.gz ATBANBJYUCHLRI-SFHVURJKSA-N 1 3 292.442 3.682 20 0 CHADHO Cc1cc(CN(C(C)C)[C@@H]2CCC[NH2+]CC2)c(C)s1 ZINC001206588546 1133722833 /nfs/dbraw/zinc/72/28/33/1133722833.db2.gz AZULUKVBPODXMH-MRXNPFEDSA-N 1 3 280.481 3.717 20 0 CHADHO CC/C=C\CCCCCC[N@@H+]1CCCC[C@@H](CN)C1 ZINC001206607247 1133726818 /nfs/dbraw/zinc/72/68/18/1133726818.db2.gz YPSTYLBKXNVGFG-LIMHQNJXSA-N 1 3 266.473 3.964 20 0 CHADHO CC/C=C\CCCCCC[N@H+]1CCCC[C@@H](CN)C1 ZINC001206607247 1133726821 /nfs/dbraw/zinc/72/68/21/1133726821.db2.gz YPSTYLBKXNVGFG-LIMHQNJXSA-N 1 3 266.473 3.964 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@@H+]1C[C@@H](CN)CC[C@H]1C ZINC001206761293 1133743017 /nfs/dbraw/zinc/74/30/17/1133743017.db2.gz WDAWPGXZMMHREV-GVDBMIGSSA-N 1 3 298.515 3.667 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@H+]1C[C@@H](CN)CC[C@H]1C ZINC001206761293 1133743021 /nfs/dbraw/zinc/74/30/21/1133743021.db2.gz WDAWPGXZMMHREV-GVDBMIGSSA-N 1 3 298.515 3.667 20 0 CHADHO CCC1([NH+](C)C)CCN(CCC2CCCCC2)CC1 ZINC001207034859 1133761447 /nfs/dbraw/zinc/76/14/47/1133761447.db2.gz KUFMPAARVVRNCX-UHFFFAOYSA-N 1 3 266.473 3.763 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC001207858150 1133855419 /nfs/dbraw/zinc/85/54/19/1133855419.db2.gz FOSZGPATCCVLOF-BHYGNILZSA-N 1 3 266.473 3.665 20 0 CHADHO CC1=C[C@@H](C)[C@H](C[NH+]2CCC(N(C)C3CC3)CC2)CC1 ZINC001208181395 1133901045 /nfs/dbraw/zinc/90/10/45/1133901045.db2.gz MBOPKHIVPSUOPX-CVEARBPZSA-N 1 3 276.468 3.537 20 0 CHADHO CN(C)CC1(C[N@H+](C)Cc2cccc(Cl)c2)CCCC1 ZINC001208191772 1133902585 /nfs/dbraw/zinc/90/25/85/1133902585.db2.gz PKBCACOLQIXKJD-UHFFFAOYSA-N 1 3 294.870 3.894 20 0 CHADHO CN(C)CC1(C[N@@H+](C)Cc2cccc(Cl)c2)CCCC1 ZINC001208191772 1133902588 /nfs/dbraw/zinc/90/25/88/1133902588.db2.gz PKBCACOLQIXKJD-UHFFFAOYSA-N 1 3 294.870 3.894 20 0 CHADHO C[C@@H](C[NH+]1CCC(N(C)C)CC1)c1cccc2ccccc21 ZINC001208707839 1133933677 /nfs/dbraw/zinc/93/36/77/1133933677.db2.gz ULMUZVLGYQOMBC-INIZCTEOSA-N 1 3 296.458 3.969 20 0 CHADHO C[N@H+](C1CC1)C1CCN(CC2(C)CCCCC2)CC1 ZINC001208902465 1133960516 /nfs/dbraw/zinc/96/05/16/1133960516.db2.gz JUVALEMBSUJASE-UHFFFAOYSA-N 1 3 264.457 3.515 20 0 CHADHO C[N@@H+](C1CC1)C1CCN(CC2(C)CCCCC2)CC1 ZINC001208902465 1133960519 /nfs/dbraw/zinc/96/05/19/1133960519.db2.gz JUVALEMBSUJASE-UHFFFAOYSA-N 1 3 264.457 3.515 20 0 CHADHO CN(C1CC1)C1CC[NH+](CC2(C)CCCCC2)CC1 ZINC001208902465 1133960523 /nfs/dbraw/zinc/96/05/23/1133960523.db2.gz JUVALEMBSUJASE-UHFFFAOYSA-N 1 3 264.457 3.515 20 0 CHADHO c1ccc(C[N@H+]2CC[C@@H](CN3CCC4(CCC4)CC3)C2)cc1 ZINC001208940180 1133967878 /nfs/dbraw/zinc/96/78/78/1133967878.db2.gz AVXPZMKVHRNORC-IBGZPJMESA-N 1 3 298.474 3.775 20 0 CHADHO c1ccc(C[N@@H+]2CC[C@@H](CN3CCC4(CCC4)CC3)C2)cc1 ZINC001208940180 1133967884 /nfs/dbraw/zinc/96/78/84/1133967884.db2.gz AVXPZMKVHRNORC-IBGZPJMESA-N 1 3 298.474 3.775 20 0 CHADHO c1ccc(CN2CC[C@@H](C[NH+]3CCC4(CCC4)CC3)C2)cc1 ZINC001208940180 1133967889 /nfs/dbraw/zinc/96/78/89/1133967889.db2.gz AVXPZMKVHRNORC-IBGZPJMESA-N 1 3 298.474 3.775 20 0 CHADHO Cc1ccc(CN2CCC3(CCC[NH2+]C3)CC2)cc1Cl ZINC001222457636 1135245021 /nfs/dbraw/zinc/24/50/21/1135245021.db2.gz UQDZCCRRLCNUTM-UHFFFAOYSA-N 1 3 292.854 3.614 20 0 CHADHO c1ccc(-c2ccccc2C[N@@H+]2CC[C@H]3CNCC[C@H]32)cc1 ZINC001222620304 1135256831 /nfs/dbraw/zinc/25/68/31/1135256831.db2.gz LZCCRMJWDAQISL-FXAWDEMLSA-N 1 3 292.426 3.537 20 0 CHADHO c1ccc(-c2ccccc2C[N@H+]2CC[C@H]3CNCC[C@H]32)cc1 ZINC001222620304 1135256837 /nfs/dbraw/zinc/25/68/37/1135256837.db2.gz LZCCRMJWDAQISL-FXAWDEMLSA-N 1 3 292.426 3.537 20 0 CHADHO C[N@@H+]1CC[C@H](NCc2ccc(C3CC3)cc2)[C@H]2CCC[C@H]21 ZINC000353688038 529806665 /nfs/dbraw/zinc/80/66/65/529806665.db2.gz NVAQHLLNIYEDMM-CEXWTWQISA-N 1 3 284.447 3.526 20 0 CHADHO C[N@H+]1CC[C@H](NCc2ccc(C3CC3)cc2)[C@H]2CCC[C@H]21 ZINC000353688038 529806667 /nfs/dbraw/zinc/80/66/67/529806667.db2.gz NVAQHLLNIYEDMM-CEXWTWQISA-N 1 3 284.447 3.526 20 0 CHADHO Cc1ccc(CN[C@@H]2CCC[C@@H]([NH3+])C2)c2ccccc12 ZINC000573507109 334943410 /nfs/dbraw/zinc/94/34/10/334943410.db2.gz ZYWOGPAJQXTQTI-HZPDHXFCSA-N 1 3 268.404 3.508 20 0 CHADHO CN1CCC2(CCC[N@@H+]2Cc2ccc(C(F)F)cc2)CC1 ZINC000336492529 530051097 /nfs/dbraw/zinc/05/10/97/530051097.db2.gz LHPWMLIAIDSSHR-UHFFFAOYSA-N 1 3 294.389 3.684 20 0 CHADHO CN1CCC2(CCC[N@H+]2Cc2ccc(C(F)F)cc2)CC1 ZINC000336492529 530051098 /nfs/dbraw/zinc/05/10/98/530051098.db2.gz LHPWMLIAIDSSHR-UHFFFAOYSA-N 1 3 294.389 3.684 20 0 CHADHO CCC[NH+]1CCC(N[C@H](CC)c2cccs2)CC1 ZINC000020190128 171056595 /nfs/dbraw/zinc/05/65/95/171056595.db2.gz VBPYCKAVQQWLQT-CQSZACIVSA-N 1 3 266.454 3.663 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H]1C[C@H](C)CC(C)(C)C1 ZINC000021009377 171286005 /nfs/dbraw/zinc/28/60/05/171286005.db2.gz BHFCHRYQDUYFIO-LSDHHAIUSA-N 1 3 254.462 3.523 20 0 CHADHO Cc1ccc(-c2ccc(CN3CC[C@H](C[NH3+])C3)s2)cc1 ZINC000347067992 226011753 /nfs/dbraw/zinc/01/17/53/226011753.db2.gz NGJOYBVJDFWJMG-CQSZACIVSA-N 1 3 286.444 3.504 20 0 CHADHO Cc1ccc(-c2ccc(CN3CC[C@@H](C[NH3+])C3)s2)cc1 ZINC000347067989 226011832 /nfs/dbraw/zinc/01/18/32/226011832.db2.gz NGJOYBVJDFWJMG-AWEZNQCLSA-N 1 3 286.444 3.504 20 0 CHADHO c1cc2c(o1)CCC[C@H]2NCCCCC[NH+]1CCCCC1 ZINC000192860323 227314201 /nfs/dbraw/zinc/31/42/01/227314201.db2.gz PTMSIMVXIUDFKO-QGZVFWFLSA-N 1 3 290.451 3.903 20 0 CHADHO CC1(C)CC[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000518006365 260334135 /nfs/dbraw/zinc/33/41/35/260334135.db2.gz PUSSFLXDBOZKCW-MRXNPFEDSA-N 1 3 278.484 3.952 20 0 CHADHO C[C@H]1CC[C@H](NC[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc21 ZINC000126540582 260353976 /nfs/dbraw/zinc/35/39/76/260353976.db2.gz OVBOQTJATACSEQ-DOXZYTNZSA-N 1 3 284.447 3.699 20 0 CHADHO C[C@H]1CC[C@H](NC[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc21 ZINC000126540582 260353978 /nfs/dbraw/zinc/35/39/78/260353978.db2.gz OVBOQTJATACSEQ-DOXZYTNZSA-N 1 3 284.447 3.699 20 0 CHADHO CC(C)[C@@H](N[C@@H]1CCC[NH2+]CC1)c1ccc(Cl)cc1 ZINC000128998049 260379926 /nfs/dbraw/zinc/37/99/26/260379926.db2.gz AOBDKMZULPIMOG-HZPDHXFCSA-N 1 3 280.843 3.769 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@H](C)CCc1ccc(F)cc1F ZINC000514082471 261198724 /nfs/dbraw/zinc/19/87/24/261198724.db2.gz GZUHVOSNFOUURA-CQSZACIVSA-N 1 3 298.421 3.606 20 0 CHADHO CC(C)[N@@H+](C)CCCN[C@H](C)CCc1ccc(F)cc1F ZINC000514082471 261198727 /nfs/dbraw/zinc/19/87/27/261198727.db2.gz GZUHVOSNFOUURA-CQSZACIVSA-N 1 3 298.421 3.606 20 0 CHADHO CC(C)[N@H+](C)CCCN[C@H](C)CCc1ccc(F)cc1F ZINC000514082471 261198730 /nfs/dbraw/zinc/19/87/30/261198730.db2.gz GZUHVOSNFOUURA-CQSZACIVSA-N 1 3 298.421 3.606 20 0 CHADHO C[C@H]([NH2+]CCCN1CCC(C)CC1)c1cccc(F)c1 ZINC000019230743 262173999 /nfs/dbraw/zinc/17/39/99/262173999.db2.gz CCJWVKXTQUREDR-HNNXBMFYSA-N 1 3 278.415 3.598 20 0 CHADHO C[C@H](CC[NH2+][C@@H]1CS[C@H](C(C)(C)C)C1)N1CCCCC1 ZINC000488562387 262363806 /nfs/dbraw/zinc/36/38/06/262363806.db2.gz SIPFOBHUOZCSPS-PMPSAXMXSA-N 1 3 298.540 3.761 20 0 CHADHO C[C@H](CCN[C@@H]1CS[C@H](C(C)(C)C)C1)[NH+]1CCCCC1 ZINC000488562387 262363808 /nfs/dbraw/zinc/36/38/08/262363808.db2.gz SIPFOBHUOZCSPS-PMPSAXMXSA-N 1 3 298.540 3.761 20 0 CHADHO C[C@@H]([NH2+]CCCN1CCCCC1)c1cccc(Cl)c1 ZINC000021032135 262374266 /nfs/dbraw/zinc/37/42/66/262374266.db2.gz HCXALKJEQANKEX-CQSZACIVSA-N 1 3 280.843 3.867 20 0 CHADHO CC[C@H](NCC1=CC[N@H+](C)CC1)c1cccc(Cl)c1F ZINC000274049763 263021128 /nfs/dbraw/zinc/02/11/28/263021128.db2.gz LALHSBYMNDZSAX-HNNXBMFYSA-N 1 3 296.817 3.782 20 0 CHADHO CC[C@H](NCC1=CC[N@@H+](C)CC1)c1cccc(Cl)c1F ZINC000274049763 263021129 /nfs/dbraw/zinc/02/11/29/263021129.db2.gz LALHSBYMNDZSAX-HNNXBMFYSA-N 1 3 296.817 3.782 20 0 CHADHO CCN(Cc1ccc(Cl)cc1C)[C@H]1CCC[NH2+]CC1 ZINC000414719287 263034535 /nfs/dbraw/zinc/03/45/35/263034535.db2.gz UVMXDYFZDZDPJQ-INIZCTEOSA-N 1 3 280.843 3.612 20 0 CHADHO Cc1cc(Cl)cc(C)c1CN(C)[C@H]1CCC[NH2+]CC1 ZINC000414756988 263039475 /nfs/dbraw/zinc/03/94/75/263039475.db2.gz WMXMADWAVJZLSY-HNNXBMFYSA-N 1 3 280.843 3.531 20 0 CHADHO CCC([NH3+])(CC)CNC[C@@H](c1ccccc1)C(C)C ZINC000414809431 263052365 /nfs/dbraw/zinc/05/23/65/263052365.db2.gz MKPYPQSTZRWJLT-MRXNPFEDSA-N 1 3 262.441 3.533 20 0 CHADHO CCC([NH3+])(CC)CNC[C@H](c1ccccc1)C(C)C ZINC000414809428 263052451 /nfs/dbraw/zinc/05/24/51/263052451.db2.gz MKPYPQSTZRWJLT-INIZCTEOSA-N 1 3 262.441 3.533 20 0 CHADHO CCC([NH3+])(CC)CNCCCc1c(F)cccc1Cl ZINC000414811185 263052971 /nfs/dbraw/zinc/05/29/71/263052971.db2.gz OZGSRINCPQXNAI-UHFFFAOYSA-N 1 3 286.822 3.519 20 0 CHADHO CC(C)C[C@H](Cc1cccc(Cl)c1)[NH2+]CC[C@H](C)N ZINC000414822101 263054802 /nfs/dbraw/zinc/05/48/02/263054802.db2.gz MNKVOUIEZAWFFV-XJKSGUPXSA-N 1 3 282.859 3.624 20 0 CHADHO CC(C)C[C@H](Cc1cccc(Cl)c1)NCC[C@H](C)[NH3+] ZINC000414822101 263054803 /nfs/dbraw/zinc/05/48/03/263054803.db2.gz MNKVOUIEZAWFFV-XJKSGUPXSA-N 1 3 282.859 3.624 20 0 CHADHO [NH3+]C1(CN[C@@H]2CCC[C@@H]2c2ccc(F)cc2)CCCCC1 ZINC000414836746 263057247 /nfs/dbraw/zinc/05/72/47/263057247.db2.gz GGJDIHPUYGGBSG-IAGOWNOFSA-N 1 3 290.426 3.713 20 0 CHADHO Cc1cccc(CC[C@H](C)NCC2([NH3+])CCCCC2)c1 ZINC000414849467 263065303 /nfs/dbraw/zinc/06/53/03/263065303.db2.gz XOPHHJHFPAWQBD-INIZCTEOSA-N 1 3 274.452 3.567 20 0 CHADHO C[C@H](CCc1ccccc1)NCC1([NH3+])CCCCCC1 ZINC000414856872 263073356 /nfs/dbraw/zinc/07/33/56/263073356.db2.gz BCXAUBVMAXJIIH-MRXNPFEDSA-N 1 3 274.452 3.649 20 0 CHADHO C[C@@H](NCC1([NH3+])CCCCCC1)[C@H](C)c1ccccc1 ZINC000414858053 263074074 /nfs/dbraw/zinc/07/40/74/263074074.db2.gz HPAPQDQYTJOVNY-JKSUJKDBSA-N 1 3 274.452 3.820 20 0 CHADHO CCC[C@@H](CCc1ccccc1)[NH2+][C@H]1CCCNCC1 ZINC000414906324 263113213 /nfs/dbraw/zinc/11/32/13/263113213.db2.gz ARKUPRXUPKNDHZ-ROUUACIJSA-N 1 3 274.452 3.520 20 0 CHADHO C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3)s2)CCN1 ZINC000414941510 263149906 /nfs/dbraw/zinc/14/99/06/263149906.db2.gz CVPWTGOJVCGTFB-UKRRQHHQSA-N 1 3 286.444 3.645 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+]CC1CCC(c2ccccc2)CC1 ZINC000414948421 263156317 /nfs/dbraw/zinc/15/63/17/263156317.db2.gz YDVMSHOMKZGEKX-JVDULTGUSA-N 1 3 286.463 3.548 20 0 CHADHO Cc1ccccc1-c1cccc(C[NH2+][C@@H]2CCNC[C@@H]2C)c1 ZINC000414966366 263169546 /nfs/dbraw/zinc/16/95/46/263169546.db2.gz WNYNWNJSMFKRQN-OXJNMPFZSA-N 1 3 294.442 3.750 20 0 CHADHO CC(C)(C)c1ccc(C[NH2+][C@@H]2CCNCC2(C)C)s1 ZINC000414970122 263171456 /nfs/dbraw/zinc/17/14/56/263171456.db2.gz JZWGHSCRTXLVJL-CYBMUJFWSA-N 1 3 280.481 3.523 20 0 CHADHO Clc1cccc(Cl)c1CNCCC[C@@H]1CCC[NH2+]1 ZINC000414979068 263179346 /nfs/dbraw/zinc/17/93/46/263179346.db2.gz UOCDSFLQJMDQHN-LLVKDONJSA-N 1 3 287.234 3.615 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H](C2CC2)C2CCCC2)C1 ZINC000453116071 263190769 /nfs/dbraw/zinc/19/07/69/263190769.db2.gz XRHPIZQIATUCSR-QAPCUYQASA-N 1 3 278.484 3.665 20 0 CHADHO Cc1cc([C@H](C)[NH2+][C@@H]2CCC[C@H](N(C)C)C2)cs1 ZINC000453133910 263193730 /nfs/dbraw/zinc/19/37/30/263193730.db2.gz NIFJEBUWWVPVRQ-CFVMTHIKSA-N 1 3 266.454 3.580 20 0 CHADHO FC(F)c1ccc(CN2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)cc1 ZINC000415034770 263257206 /nfs/dbraw/zinc/25/72/06/263257206.db2.gz DBMGOTMTJCXNAY-HZPDHXFCSA-N 1 3 294.389 3.588 20 0 CHADHO [NH3+]CCC[C@H](NCc1ccccc1Cl)c1ccccc1 ZINC000415047101 263258006 /nfs/dbraw/zinc/25/80/06/263258006.db2.gz DTFZRCOORBIKOS-KRWDZBQOSA-N 1 3 288.822 3.910 20 0 CHADHO Clc1ccccc1[C@H]1CCC[C@@H]1[NH2+]CCCNC1CC1 ZINC000415065977 263259379 /nfs/dbraw/zinc/25/93/79/263259379.db2.gz IFDIBLDBPXDDLG-WBVHZDCISA-N 1 3 292.854 3.708 20 0 CHADHO [NH3+]CCC[C@H](NCc1ccc(F)c(F)c1)c1ccccc1 ZINC000415069031 263259505 /nfs/dbraw/zinc/25/95/05/263259505.db2.gz SAYUAIMRGDZTEK-KRWDZBQOSA-N 1 3 290.357 3.535 20 0 CHADHO CC[C@H]([NH2+]C1CCN(CC(C)C)CC1)c1cccc(F)c1 ZINC000187744045 263267859 /nfs/dbraw/zinc/26/78/59/263267859.db2.gz GQJRILYEMRYXAY-SFHVURJKSA-N 1 3 292.442 3.987 20 0 CHADHO CCc1ccccc1CN[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415084916 263268670 /nfs/dbraw/zinc/26/86/70/263268670.db2.gz PFEOUKHXRSPGME-VQTJNVASSA-N 1 3 294.442 3.832 20 0 CHADHO CCc1ccccc1CN[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415084918 263268821 /nfs/dbraw/zinc/26/88/21/263268821.db2.gz PFEOUKHXRSPGME-WOJBJXKFSA-N 1 3 294.442 3.832 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)N[C@@H]1CCC[NH2+]CC1 ZINC000415115600 263274274 /nfs/dbraw/zinc/27/42/74/263274274.db2.gz UGUITFRJCMFVOA-AEFFLSMTSA-N 1 3 274.452 3.814 20 0 CHADHO Cc1ccc2cc([C@H](C)[NH2+][C@@H](C)CCN(C)C)oc2c1 ZINC000425958309 264226505 /nfs/dbraw/zinc/22/65/05/264226505.db2.gz MLQKGBKIBIQABS-KBPBESRZSA-N 1 3 274.408 3.732 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H]2CCCc3c(C)ccc(C)c32)C1 ZINC000349812022 265208870 /nfs/dbraw/zinc/20/88/70/265208870.db2.gz JQHWPLAYBROSOM-SJLPKXTDSA-N 1 3 286.463 3.612 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H]2CCCc3c(C)ccc(C)c32)C1 ZINC000349812022 265208873 /nfs/dbraw/zinc/20/88/73/265208873.db2.gz JQHWPLAYBROSOM-SJLPKXTDSA-N 1 3 286.463 3.612 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H]2CCCc3c(C)ccc(C)c32)C1 ZINC000349812022 265208875 /nfs/dbraw/zinc/20/88/75/265208875.db2.gz JQHWPLAYBROSOM-SJLPKXTDSA-N 1 3 286.463 3.612 20 0 CHADHO CC(C)[C@@H]1C[C@H]([NH2+]C2CCN(C3CCCC3)CC2)CS1 ZINC000368460542 267173644 /nfs/dbraw/zinc/17/36/44/267173644.db2.gz DOQJJYWEZVGYMW-RDJZCZTQSA-N 1 3 296.524 3.513 20 0 CHADHO CC(C)[C@@H]1C[C@H](NC2CC[NH+](C3CCCC3)CC2)CS1 ZINC000368460542 267173646 /nfs/dbraw/zinc/17/36/46/267173646.db2.gz DOQJJYWEZVGYMW-RDJZCZTQSA-N 1 3 296.524 3.513 20 0 CHADHO C[NH+]1CCC2(CCCN(c3ccnc4ccccc43)C2)CC1 ZINC000376678868 268008279 /nfs/dbraw/zinc/00/82/79/268008279.db2.gz IKKOSZWPTGIYIS-UHFFFAOYSA-N 1 3 295.430 3.547 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCc1ccc(-c2ccc(F)cc2)s1 ZINC000563135065 327928232 /nfs/dbraw/zinc/92/82/32/327928232.db2.gz DSYJWRHZALBCNI-NWDGAFQWSA-N 1 3 292.423 3.770 20 0 CHADHO CC1CCN(CCC[NH2+][C@H](c2ccccc2)C2CC2)CC1 ZINC000041075346 328026741 /nfs/dbraw/zinc/02/67/41/328026741.db2.gz LSVUXKJAWAUQPO-LJQANCHMSA-N 1 3 286.463 3.849 20 0 CHADHO C[C@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccccc1C(C)(C)C ZINC000534353147 328048312 /nfs/dbraw/zinc/04/83/12/328048312.db2.gz PNKIVLVYJXORCQ-HOTGVXAUSA-N 1 3 288.479 3.977 20 0 CHADHO C[C@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccccc1C(C)(C)C ZINC000534353147 328048313 /nfs/dbraw/zinc/04/83/13/328048313.db2.gz PNKIVLVYJXORCQ-HOTGVXAUSA-N 1 3 288.479 3.977 20 0 CHADHO CC[C@@H](C[NH2+]C1CCN(C(C)(C)C)CC1)CC(F)(F)F ZINC000414253944 328153465 /nfs/dbraw/zinc/15/34/65/328153465.db2.gz DVVPJCORYVBREP-GFCCVEGCSA-N 1 3 294.405 3.818 20 0 CHADHO CC[C@H](C[NH2+]C1CCN(C(C)(C)C)CC1)CC(F)(F)F ZINC000414253948 328153500 /nfs/dbraw/zinc/15/35/00/328153500.db2.gz DVVPJCORYVBREP-LBPRGKRZSA-N 1 3 294.405 3.818 20 0 CHADHO C[C@@H](N)[C@H]1CC[N@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC000414655067 328208678 /nfs/dbraw/zinc/20/86/78/328208678.db2.gz CTHCBFGCRYDQSE-JVDULTGUSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@@H](N)[C@H]1CC[N@@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC000414655067 328208679 /nfs/dbraw/zinc/20/86/79/328208679.db2.gz CTHCBFGCRYDQSE-JVDULTGUSA-N 1 3 286.463 3.630 20 0 CHADHO C[C@@H](c1cccc(C(F)(F)F)c1)N(CCC[NH3+])C1CC1 ZINC000414751209 328219327 /nfs/dbraw/zinc/21/93/27/328219327.db2.gz SHHUFLABQMISKJ-NSHDSACASA-N 1 3 286.341 3.580 20 0 CHADHO C[N@H+]([C@@H]1CC[C@](C)(c2ccccc2)C1)[C@@H]1CCCNCC1 ZINC000414754746 328220258 /nfs/dbraw/zinc/22/02/58/328220258.db2.gz SCZHGSWZSQHRDX-QRVBRYPASA-N 1 3 286.463 3.571 20 0 CHADHO C[N@@H+]([C@@H]1CC[C@](C)(c2ccccc2)C1)[C@@H]1CCCNCC1 ZINC000414754746 328220259 /nfs/dbraw/zinc/22/02/59/328220259.db2.gz SCZHGSWZSQHRDX-QRVBRYPASA-N 1 3 286.463 3.571 20 0 CHADHO CCC([NH3+])(CC)CN[C@@H]1CCC[C@H]1c1ccc(C)cc1 ZINC000414802878 328231544 /nfs/dbraw/zinc/23/15/44/328231544.db2.gz BYINDHPFDSKCMY-DLBZAZTESA-N 1 3 274.452 3.738 20 0 CHADHO c1ccc(-c2cccc(CCN[C@@H]3CCC[NH2+]CC3)c2)cc1 ZINC000415082694 328302710 /nfs/dbraw/zinc/30/27/10/328302710.db2.gz DSIAJQSQXZOPNL-HXUWFJFHSA-N 1 3 294.442 3.628 20 0 CHADHO c1ccc(-c2cccc(CC[NH2+][C@@H]3CCCNCC3)c2)cc1 ZINC000415082694 328302711 /nfs/dbraw/zinc/30/27/11/328302711.db2.gz DSIAJQSQXZOPNL-HXUWFJFHSA-N 1 3 294.442 3.628 20 0 CHADHO CCSc1ccc([C@@H](C)NC[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000534496746 328304732 /nfs/dbraw/zinc/30/47/32/328304732.db2.gz VAICCWUGKMOYHX-CABCVRRESA-N 1 3 292.492 3.791 20 0 CHADHO CCSc1ccc([C@@H](C)NC[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000534496746 328304733 /nfs/dbraw/zinc/30/47/33/328304733.db2.gz VAICCWUGKMOYHX-CABCVRRESA-N 1 3 292.492 3.791 20 0 CHADHO c1ccc([C@@H](CC2CC2)NC[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000531937764 328319707 /nfs/dbraw/zinc/31/97/07/328319707.db2.gz UDHUOACEFPSEIX-QFBILLFUSA-N 1 3 284.447 3.602 20 0 CHADHO c1ccc([C@@H](CC2CC2)NC[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000531937764 328319708 /nfs/dbraw/zinc/31/97/08/328319708.db2.gz UDHUOACEFPSEIX-QFBILLFUSA-N 1 3 284.447 3.602 20 0 CHADHO Clc1cccc2c1CC[C@H]2[NH2+]CCCN1CCCCC1 ZINC000531945033 328324079 /nfs/dbraw/zinc/32/40/79/328324079.db2.gz BWGUCFZVZKGSBZ-QGZVFWFLSA-N 1 3 292.854 3.793 20 0 CHADHO CCCc1ccc([C@H](C)N[C@@H](C)CC[NH+](C)C)cc1 ZINC000049553346 328371745 /nfs/dbraw/zinc/37/17/45/328371745.db2.gz KSSDKZPWEQCZAG-GJZGRUSLSA-N 1 3 262.441 3.630 20 0 CHADHO CC(C)[C@@H]([NH2+]CCCN(C(C)C)C(C)C)C1CC1 ZINC000531981007 328374182 /nfs/dbraw/zinc/37/41/82/328374182.db2.gz FIUGHDTYKMWPQT-MRXNPFEDSA-N 1 3 254.462 3.520 20 0 CHADHO C[N@@H+]1CCC[C@@H](CN[C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC000534973201 328372406 /nfs/dbraw/zinc/37/24/06/328372406.db2.gz BZPBISDWAUXOKP-SUMWQHHRSA-N 1 3 292.854 3.649 20 0 CHADHO C[N@H+]1CCC[C@@H](CN[C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC000534973201 328372407 /nfs/dbraw/zinc/37/24/07/328372407.db2.gz BZPBISDWAUXOKP-SUMWQHHRSA-N 1 3 292.854 3.649 20 0 CHADHO CC[C@H](N[C@H](C)C[C@H](C)[NH3+])c1ccc(Cl)s1 ZINC000422730322 330152306 /nfs/dbraw/zinc/15/23/06/330152306.db2.gz LZTIPJCZROWZSV-AEJSXWLSSA-N 1 3 260.834 3.568 20 0 CHADHO CC(C)[C@@H]1CC[C@H]([NH2+]C[C@H]2CCN(C(C)C)C2)C[C@@H]1C ZINC000584186658 327062758 /nfs/dbraw/zinc/06/27/58/327062758.db2.gz OZXWPWLTQFWENM-MHORFTMASA-N 1 3 280.500 3.767 20 0 CHADHO CCN1CCC[C@@H](C[NH2+]Cc2ccc(C3CCC3)cc2)C1 ZINC000559259460 327151424 /nfs/dbraw/zinc/15/14/24/327151424.db2.gz YNUMLLCOCLRQFP-KRWDZBQOSA-N 1 3 286.463 3.776 20 0 CHADHO FC(F)c1cccc(CN2CCC([C@H]3CCC[NH2+]3)CC2)c1 ZINC000131982003 327166907 /nfs/dbraw/zinc/16/69/07/327166907.db2.gz DFDNNWZGHLYIMW-MRXNPFEDSA-N 1 3 294.389 3.588 20 0 CHADHO CC(C)C[C@@H](CN1CC[C@@]2(CC[NH2+]C2)C1)c1ccccc1 ZINC000566230420 327248505 /nfs/dbraw/zinc/24/85/05/327248505.db2.gz QMRJEALFWLCNNA-RBUKOAKNSA-N 1 3 286.463 3.502 20 0 CHADHO CC(C)C[C@H](CN1CC[C@]2(CC[NH2+]C2)C1)c1ccccc1 ZINC000566230418 327248509 /nfs/dbraw/zinc/24/85/09/327248509.db2.gz QMRJEALFWLCNNA-MOPGFXCFSA-N 1 3 286.463 3.502 20 0 CHADHO Cc1cc(N2CCC([NH2+]CC3CC3)CC2)c2ccccc2n1 ZINC000262109010 327255072 /nfs/dbraw/zinc/25/50/72/327255072.db2.gz JOEVLXYLZDLSBC-UHFFFAOYSA-N 1 3 295.430 3.512 20 0 CHADHO CC1(C[NH2+]C2CCN(C3CCCC3)CC2)CCCCC1 ZINC000560907169 327350726 /nfs/dbraw/zinc/35/07/26/327350726.db2.gz DFPXIBMSLNMYCH-UHFFFAOYSA-N 1 3 278.484 3.953 20 0 CHADHO N[C@H]1CCC[C@H]([NH2+]CC2(c3cccs3)CCCCC2)C1 ZINC000566481226 327391966 /nfs/dbraw/zinc/39/19/66/327391966.db2.gz GBPCQKWWCXRDBI-GJZGRUSLSA-N 1 3 292.492 3.810 20 0 CHADHO [NH3+][C@H]1CCC[C@H](NCC2(c3cccs3)CCCCC2)C1 ZINC000566481226 327391968 /nfs/dbraw/zinc/39/19/68/327391968.db2.gz GBPCQKWWCXRDBI-GJZGRUSLSA-N 1 3 292.492 3.810 20 0 CHADHO Cc1ccccc1[C@H](N[C@@H]1CCC[C@H]([NH3+])C1)C(C)C ZINC000570649365 327608660 /nfs/dbraw/zinc/60/86/60/327608660.db2.gz OAILESBJNMWDJP-ZMSDIMECSA-N 1 3 260.425 3.552 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]C[C@@H](C)CN2CCCCC2)s1 ZINC000038041632 329354790 /nfs/dbraw/zinc/35/47/90/329354790.db2.gz YIRRRCYFSRXNMJ-HIFRSBDPSA-N 1 3 280.481 3.829 20 0 CHADHO CC[C@H]([NH2+]C[C@H](C)CN1CCCCC1)c1cccs1 ZINC000038041904 329354999 /nfs/dbraw/zinc/35/49/99/329354999.db2.gz FUZITBBRBCARQU-GJZGRUSLSA-N 1 3 280.481 3.911 20 0 CHADHO C[C@@H](NCC[C@H]1CC[NH2+]C1)c1cccc(Cl)c1Cl ZINC000420401221 329763894 /nfs/dbraw/zinc/76/38/94/329763894.db2.gz IWNGAUOJXUTBPH-GHMZBOCLSA-N 1 3 287.234 3.644 20 0 CHADHO CC(C)(CC[NH3+])NCc1ccc(Cl)c(C(F)(F)F)c1 ZINC000422561535 330149347 /nfs/dbraw/zinc/14/93/47/330149347.db2.gz LTQZVGWNROZHRB-UHFFFAOYSA-N 1 3 294.748 3.576 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@H](C)[C@@H]2CCC[NH2+]C2)cc1 ZINC000422693203 330150836 /nfs/dbraw/zinc/15/08/36/330150836.db2.gz LGYDFIFTVUUBRL-HDMKZQKVSA-N 1 3 274.452 3.849 20 0 CHADHO [NH3+][C@H]1CCCCC[C@H]1NCC1(c2ccc(Cl)cc2)CC1 ZINC000422704001 330151071 /nfs/dbraw/zinc/15/10/71/330151071.db2.gz OKKCLIDEBKUKMZ-JKSUJKDBSA-N 1 3 292.854 3.621 20 0 CHADHO C[C@@H](N[C@@H](C)CCC[NH3+])c1c(Cl)ccc(F)c1Cl ZINC000422706348 330151142 /nfs/dbraw/zinc/15/11/42/330151142.db2.gz DWXBXPYRGHMABY-DTWKUNHWSA-N 1 3 293.213 3.911 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H]1CCC[C@H](C(C)C)C1 ZINC000422712561 330151430 /nfs/dbraw/zinc/15/14/30/330151430.db2.gz IOCDNTOOJSOMOT-CWRNSKLLSA-N 1 3 289.467 3.714 20 0 CHADHO NC[C@H]1CCCC[C@@H]1[NH2+]CCCCCOC1CCCCC1 ZINC000422710140 330151564 /nfs/dbraw/zinc/15/15/64/330151564.db2.gz LAICYMDDYLZTPN-AEFFLSMTSA-N 1 3 296.499 3.613 20 0 CHADHO C[C@@H](CCCC[NH3+])N[C@@H](C)c1ccc(F)cc1Cl ZINC000422752092 330153330 /nfs/dbraw/zinc/15/33/30/330153330.db2.gz GWCBWUBPQZUVLZ-QWRGUYRKSA-N 1 3 272.795 3.647 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@@H](C)CCC(C)(C)C ZINC000422749883 330153463 /nfs/dbraw/zinc/15/34/63/330153463.db2.gz BHZYQFRUYOMGIK-QWHCGFSZSA-N 1 3 277.456 3.714 20 0 CHADHO NC[C@@H]1CCC[C@H]1[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000422756548 330153771 /nfs/dbraw/zinc/15/37/71/330153771.db2.gz LSKOTMUOBXJVRW-AZUAARDMSA-N 1 3 294.442 3.536 20 0 CHADHO Cc1ccc(CN[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC000422763957 330154087 /nfs/dbraw/zinc/15/40/87/330154087.db2.gz PDDBSMNDUCUHGR-RBUKOAKNSA-N 1 3 280.415 3.578 20 0 CHADHO Fc1ccc([C@@H](N[C@@H]2CCC[NH2+]CC2)C2CCCC2)cc1 ZINC000422775390 330154526 /nfs/dbraw/zinc/15/45/26/330154526.db2.gz BMFPKOCKNXDYBM-MSOLQXFVSA-N 1 3 290.426 3.789 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+][C@H](C)C[C@H](C)N ZINC000422776240 330154737 /nfs/dbraw/zinc/15/47/37/330154737.db2.gz CJABMMVFURGADC-ZMSDIMECSA-N 1 3 262.441 3.503 20 0 CHADHO CC[C@H](C)[C@@H]([NH2+]C1CCNCC1)c1ccc(Cl)cc1 ZINC000422788035 330155322 /nfs/dbraw/zinc/15/53/22/330155322.db2.gz VBJLXFQZFQWQKK-BLLLJJGKSA-N 1 3 280.843 3.769 20 0 CHADHO COc1cccc(-c2ccc(CN[C@H](C)C[C@H](C)[NH3+])cc2)c1 ZINC000422796648 330155676 /nfs/dbraw/zinc/15/56/76/330155676.db2.gz YVFJFRHVALDPIL-LSDHHAIUSA-N 1 3 298.430 3.578 20 0 CHADHO C1C[C@H]2CC[C@@H]([NH2+][C@H]3CCC[C@H]3[C@H]3CCCCN3)C[C@@H]2C1 ZINC000422792629 330155681 /nfs/dbraw/zinc/15/56/81/330155681.db2.gz RCOIGXUTGQJEQE-UESMBRTFSA-N 1 3 290.495 3.856 20 0 CHADHO CC(C)[C@H](C[NH2+][C@@H]1CCCC[C@H]1CN)c1ccccc1 ZINC000422808749 330155876 /nfs/dbraw/zinc/15/58/76/330155876.db2.gz LLKLJEOFLFFMFB-OKZBNKHCSA-N 1 3 274.452 3.533 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](c1ccc(F)cc1)C1CCCC1 ZINC000422789587 330157420 /nfs/dbraw/zinc/15/74/20/330157420.db2.gz UIZNLZHECHVKLH-GDZNZVCISA-N 1 3 278.415 3.772 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]CC1CCC(c2ccccc2)CC1 ZINC000422892384 330159133 /nfs/dbraw/zinc/15/91/33/330159133.db2.gz YEVXLSWZVGJTAS-LCMLCXGQSA-N 1 3 274.452 3.676 20 0 CHADHO Cc1cccc(C2(C[NH2+][C@H](C)C[C@H](C)N)CCCC2)c1 ZINC000422909423 330159626 /nfs/dbraw/zinc/15/96/26/330159626.db2.gz NZPBCNOQEDKEHO-JKSUJKDBSA-N 1 3 274.452 3.522 20 0 CHADHO Cc1cccc(C2(CN[C@H](C)C[C@H](C)[NH3+])CCCC2)c1 ZINC000422909423 330159628 /nfs/dbraw/zinc/15/96/28/330159628.db2.gz NZPBCNOQEDKEHO-JKSUJKDBSA-N 1 3 274.452 3.522 20 0 CHADHO CC[C@H](N[C@H](C)CCCC[NH3+])c1cc(F)ccc1F ZINC000422923637 330160605 /nfs/dbraw/zinc/16/06/05/330160605.db2.gz SEOIBZPXVWYSKK-ABAIWWIYSA-N 1 3 270.367 3.523 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C ZINC000422927643 330160986 /nfs/dbraw/zinc/16/09/86/330160986.db2.gz ZKRDKFFOYWLDBF-GWIBLVFBSA-N 1 3 280.843 3.753 20 0 CHADHO CCCc1ccc([C@H](NC2CC[NH2+]CC2)C(C)C)cc1 ZINC000422938501 330161656 /nfs/dbraw/zinc/16/16/56/330161656.db2.gz PTHCIDIHYSSDIT-GOSISDBHSA-N 1 3 274.452 3.678 20 0 CHADHO CCCc1ccc([C@H]([NH2+]C2CCNCC2)C(C)C)cc1 ZINC000422938501 330161657 /nfs/dbraw/zinc/16/16/57/330161657.db2.gz PTHCIDIHYSSDIT-GOSISDBHSA-N 1 3 274.452 3.678 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCC1(Sc2ccccc2)CCCC1 ZINC000422901385 330162140 /nfs/dbraw/zinc/16/21/40/330162140.db2.gz BXHBQMUVSINCHU-LSDHHAIUSA-N 1 3 292.492 3.807 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]CC1(Sc2ccccc2)CCCC1 ZINC000422901385 330162141 /nfs/dbraw/zinc/16/21/41/330162141.db2.gz BXHBQMUVSINCHU-LSDHHAIUSA-N 1 3 292.492 3.807 20 0 CHADHO [NH3+][C@@H]1CCCCC[C@@H]1NCC1(Sc2ccccc2)CC1 ZINC000422901445 330162251 /nfs/dbraw/zinc/16/22/51/330162251.db2.gz CARHZGPQJHIFTM-CVEARBPZSA-N 1 3 290.476 3.561 20 0 CHADHO CC(C)C[C@H](N[C@H](C)C[C@@H](C)[NH3+])c1cccs1 ZINC000422950264 330163798 /nfs/dbraw/zinc/16/37/98/330163798.db2.gz VOQKSMQPUJEONA-UPJWGTAASA-N 1 3 254.443 3.551 20 0 CHADHO C(=C/c1ccccc1)\CN[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000422972811 330164597 /nfs/dbraw/zinc/16/45/97/330164597.db2.gz AKFSUCSFSAISKM-DSJULSIBSA-N 1 3 292.426 3.783 20 0 CHADHO CC(C)c1ccc(C[C@H](C)NC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000423025275 330166071 /nfs/dbraw/zinc/16/60/71/330166071.db2.gz NVSBXIKBOWRFJG-DYJHLDHHSA-N 1 3 286.463 3.614 20 0 CHADHO CC(C)[C@H](CC(F)(F)F)[NH2+][C@H]1C[C@H](N)c2ccccc21 ZINC000423054260 330166198 /nfs/dbraw/zinc/16/61/98/330166198.db2.gz BOGZQRJGEIKHHS-IHRRRGAJSA-N 1 3 286.341 3.698 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCCNCC1)C1(c2ccccc2)CCCC1 ZINC000423045925 330167037 /nfs/dbraw/zinc/16/70/37/330167037.db2.gz CXMXIJNVCCMDEE-FUHWJXTLSA-N 1 3 286.463 3.619 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC[C@@H](C)CC(C)(C)C ZINC000423059672 330167777 /nfs/dbraw/zinc/16/77/77/330167777.db2.gz MMVLGVAGHJNTLH-KGLIPLIRSA-N 1 3 291.483 3.962 20 0 CHADHO c1ccc(-c2ccc3c(c2)[C@H]([NH2+]C2CCNCC2)CC3)cc1 ZINC000423064184 330168017 /nfs/dbraw/zinc/16/80/17/330168017.db2.gz QUVUQHLUXSHRHQ-HXUWFJFHSA-N 1 3 292.426 3.683 20 0 CHADHO C1CC12CCC([NH2+][C@H]1CCC[C@H]1[C@H]1CCCCN1)CC2 ZINC000423077064 330168469 /nfs/dbraw/zinc/16/84/69/330168469.db2.gz SHAZDHXTVDUMLW-BBWFWOEESA-N 1 3 276.468 3.610 20 0 CHADHO Cc1ccccc1[C@H](CC(F)(F)F)N[C@@H](C)CCC[NH3+] ZINC000423089073 330169024 /nfs/dbraw/zinc/16/90/24/330169024.db2.gz ROBIPKRABCADKC-JSGCOSHPSA-N 1 3 288.357 3.706 20 0 CHADHO [NH3+][C@H]1CCCCC[C@H]1N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423095427 330169548 /nfs/dbraw/zinc/16/95/48/330169548.db2.gz MBPDTCFRKAJCTQ-QSPRXWTASA-N 1 3 292.854 3.836 20 0 CHADHO C[C@H]1CCNCC[C@@H]1[NH2+][C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423100311 330170159 /nfs/dbraw/zinc/17/01/59/330170159.db2.gz VDAQLXCCIQAZMO-CSFVBSKPSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@H]1CC[NH2+]CC[C@@H]1N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423100311 330170161 /nfs/dbraw/zinc/17/01/61/330170161.db2.gz VDAQLXCCIQAZMO-CSFVBSKPSA-N 1 3 292.854 3.564 20 0 CHADHO Cc1ccccc1[C@H]1C[C@H](N[C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)C1 ZINC000423111957 330170838 /nfs/dbraw/zinc/17/08/38/330170838.db2.gz WZKCZGDHRMDRJS-YKXHTNLXSA-N 1 3 298.474 3.751 20 0 CHADHO [NH3+][C@@H]1C[C@H](NC[C@H](c2ccccc2)C2CC2)c2ccccc21 ZINC000423123511 330171356 /nfs/dbraw/zinc/17/13/56/330171356.db2.gz FCCQLJYHHWJEHF-AQNXPRMDSA-N 1 3 292.426 3.915 20 0 CHADHO c1ccc2c(c1)CC[C@@H]2CCN[C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000423149820 330172772 /nfs/dbraw/zinc/17/27/72/330172772.db2.gz XXGOBARHSGCOEV-VBSBHUPXSA-N 1 3 298.474 3.617 20 0 CHADHO c1ccc2c(c1)CC[C@@H]2CCN[C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000423149817 330172821 /nfs/dbraw/zinc/17/28/21/330172821.db2.gz XXGOBARHSGCOEV-AFYVEPGGSA-N 1 3 298.474 3.617 20 0 CHADHO NC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000423170960 330174426 /nfs/dbraw/zinc/17/44/26/330174426.db2.gz ZCFFOLYRRNUVEG-DIECFANBSA-N 1 3 292.854 3.693 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@@H]1C[C@H](C)C[C@H](c2ccccc2)C1 ZINC000423174190 330174736 /nfs/dbraw/zinc/17/47/36/330174736.db2.gz BOJKKOKHFOCZFC-CFVWQIKISA-N 1 3 274.452 3.674 20 0 CHADHO NC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000423177303 330175009 /nfs/dbraw/zinc/17/50/09/330175009.db2.gz HBSVXEHRKXKYCJ-OHFALNGGSA-N 1 3 292.854 3.693 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H]1CCC[C@@H]1C(C)(C)C ZINC000423194621 330176328 /nfs/dbraw/zinc/17/63/28/330176328.db2.gz WYLYRVOYKCLFFM-RRQGHBQHSA-N 1 3 289.467 3.714 20 0 CHADHO Clc1ccc([C@@H]2CC[C@H]([NH2+]C[C@H]3CCCNC3)C2)cc1 ZINC000423202649 330176797 /nfs/dbraw/zinc/17/67/97/330176797.db2.gz BINDCLIXHVZFKM-LXZKKBNFSA-N 1 3 292.854 3.565 20 0 CHADHO Clc1ccc([C@@H](CC2CC2)NC[C@H]2CCC[NH2+]C2)cc1 ZINC000423205614 330176992 /nfs/dbraw/zinc/17/69/92/330176992.db2.gz FEUJEEPQEKUUCF-WMLDXEAASA-N 1 3 292.854 3.770 20 0 CHADHO CCC[C@H](NC[C@@H]1CCC[NH2+]C1)c1ccc(Cl)cc1 ZINC000423209292 330177661 /nfs/dbraw/zinc/17/76/61/330177661.db2.gz IXSBKVUEMJDLNK-CJNGLKHVSA-N 1 3 280.843 3.770 20 0 CHADHO C[C@H](N[C@H]1CC[C@@H](C)c2ccsc21)[C@@H]1CCC[NH2+]C1 ZINC000423209967 330177723 /nfs/dbraw/zinc/17/77/23/330177723.db2.gz FQYDVOVESRWIJL-COMQUAJESA-N 1 3 278.465 3.664 20 0 CHADHO C[C@H]([NH2+][C@H]1CC[C@@H](C)c2ccsc21)[C@@H]1CCCNC1 ZINC000423209967 330177725 /nfs/dbraw/zinc/17/77/25/330177725.db2.gz FQYDVOVESRWIJL-COMQUAJESA-N 1 3 278.465 3.664 20 0 CHADHO C[C@H](N[C@H]1CCCc2c(Cl)cccc21)[C@H]1CCC[NH2+]C1 ZINC000423215680 330178599 /nfs/dbraw/zinc/17/85/99/330178599.db2.gz NJNHLWDHNSBFBE-DCGLDWPTSA-N 1 3 292.854 3.695 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)[C@H]1CCCNC1)[C@@H](C)c1ccc(Cl)cc1 ZINC000423219595 330179534 /nfs/dbraw/zinc/17/95/34/330179534.db2.gz UJZHWWZFJKJFNG-NYTXWWLZSA-N 1 3 294.870 3.810 20 0 CHADHO C[C@H](N)CC[NH2+][C@H]1CCC[C@@H](c2cccc(Cl)c2)C1 ZINC000423222640 330179773 /nfs/dbraw/zinc/17/97/73/330179773.db2.gz BYQQXPIOWAKZFS-BJJXKVORSA-N 1 3 280.843 3.693 20 0 CHADHO CC[C@@H](CSc1ccc(Cl)cc1)NCC[C@H](C)[NH3+] ZINC000423223743 330180182 /nfs/dbraw/zinc/18/01/82/330180182.db2.gz HLMJFLXLVYYCKR-AAEUAGOBSA-N 1 3 286.872 3.538 20 0 CHADHO C[C@H]([NH3+])CCN[C@H](c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000423227291 330180449 /nfs/dbraw/zinc/18/04/49/330180449.db2.gz VEOSDHXRQISSQH-XPTSAGLGSA-N 1 3 287.234 3.771 20 0 CHADHO C[C@@H](NCC[C@H](C)[NH3+])c1ccc(-c2ccc(F)cc2)s1 ZINC000423228790 330180490 /nfs/dbraw/zinc/18/04/90/330180490.db2.gz FEQVRVLGRSUXJH-NWDGAFQWSA-N 1 3 292.423 3.942 20 0 CHADHO C[NH2+]C[C@@H](C)CN[C@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423269169 330184499 /nfs/dbraw/zinc/18/44/99/330184499.db2.gz GWCQGOTWHKVWTM-MLGOLLRUSA-N 1 3 280.843 3.626 20 0 CHADHO C[NH2+]C[C@H](C)CN[C@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423269167 330184504 /nfs/dbraw/zinc/18/45/04/330184504.db2.gz GWCQGOTWHKVWTM-BLLLJJGKSA-N 1 3 280.843 3.626 20 0 CHADHO [NH3+]C[C@@H](N[C@@H]1CCCc2c3ccccc3sc21)C1CC1 ZINC000423276188 330185134 /nfs/dbraw/zinc/18/51/34/330185134.db2.gz MPJOECTZEPLEFE-HUUCEWRRSA-N 1 3 286.444 3.606 20 0 CHADHO CC(C)[C@@H](N)C[NH2+][C@@H](C)c1ccc(F)c2ccccc21 ZINC000423275435 330185143 /nfs/dbraw/zinc/18/51/43/330185143.db2.gz NFTCPJVIGCUNIT-SJCJKPOMSA-N 1 3 274.383 3.613 20 0 CHADHO CC[C@H]([NH2+]CC(C)(C)N)c1ccc2cc(OC)ccc2c1 ZINC000423286453 330186008 /nfs/dbraw/zinc/18/60/08/330186008.db2.gz HJZUKMMJQLEACL-KRWDZBQOSA-N 1 3 286.419 3.626 20 0 CHADHO CC(C)([NH3+])CN[C@H]1CCC[C@@H](c2cccc(Cl)c2)C1 ZINC000423286661 330186114 /nfs/dbraw/zinc/18/61/14/330186114.db2.gz IAJORBBHTIXZIZ-HIFRSBDPSA-N 1 3 280.843 3.693 20 0 CHADHO CC[C@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccc(OC)cc1 ZINC000423290558 330186856 /nfs/dbraw/zinc/18/68/56/330186856.db2.gz DMLXFYODQLGGFN-LIRRHRJNSA-N 1 3 298.430 3.956 20 0 CHADHO COc1ccsc1[C@H](C)NCc1ccc([C@H](C)[NH3+])cc1 ZINC000423291534 330187013 /nfs/dbraw/zinc/18/70/13/330187013.db2.gz ISUOFWWAGSTTAZ-RYUDHWBXSA-N 1 3 290.432 3.627 20 0 CHADHO Cc1ccccc1[C@@H](C)NCc1ccc([C@@H](C)[NH3+])cc1 ZINC000423292508 330187688 /nfs/dbraw/zinc/18/76/88/330187688.db2.gz NFMJUDUXRNXIII-HUUCEWRRSA-N 1 3 268.404 3.866 20 0 CHADHO COc1cccc([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000423292774 330187726 /nfs/dbraw/zinc/18/77/26/330187726.db2.gz OJFFOAAZTVYKFG-ZIAGYGMSSA-N 1 3 284.403 3.566 20 0 CHADHO CCC([NH3+])(CC)CN[C@H](C)[C@H](C)c1ccc(Cl)cc1 ZINC000423293701 330187916 /nfs/dbraw/zinc/18/79/16/330187916.db2.gz RZAKOJDFGAUVJK-QWHCGFSZSA-N 1 3 282.859 3.939 20 0 CHADHO Cc1cccc([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000423293977 330188021 /nfs/dbraw/zinc/18/80/21/330188021.db2.gz STEKPIHGFJNNLV-HUUCEWRRSA-N 1 3 268.404 3.866 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2ccccc2)cc1 ZINC000423296801 330188480 /nfs/dbraw/zinc/18/84/80/330188480.db2.gz ZWKIAKZAJXVZFI-KBPBESRZSA-N 1 3 254.377 3.557 20 0 CHADHO C[C@H](C[NH3+])CN[C@@H](CCc1ccccc1)c1ccccc1 ZINC000423297575 330188737 /nfs/dbraw/zinc/18/87/37/330188737.db2.gz KWQGGMIURRKVFC-APWZRJJASA-N 1 3 282.431 3.545 20 0 CHADHO CC[C@H]([NH2+]C[C@@H](N)C1CC1)c1ccc2cc(OC)ccc2c1 ZINC000423322667 330190803 /nfs/dbraw/zinc/19/08/03/330190803.db2.gz OCYWLUSFEYXLJO-MOPGFXCFSA-N 1 3 298.430 3.626 20 0 CHADHO Clc1ccc([C@@H]2CCCCC[C@@H]2[NH2+]CC2CNC2)cc1 ZINC000423336617 330191802 /nfs/dbraw/zinc/19/18/02/330191802.db2.gz XWLARWRSIGNFJW-IRXDYDNUSA-N 1 3 292.854 3.565 20 0 CHADHO Cc1cc(C)c([C@H](C)NC[C@@]2(C)CCC[NH2+]C2)cc1C ZINC000423344320 330192436 /nfs/dbraw/zinc/19/24/36/330192436.db2.gz XQACXLYFPYOWSW-WMZOPIPTSA-N 1 3 274.452 3.652 20 0 CHADHO Cc1cc(C)c([C@H](C)[NH2+]C[C@@]2(C)CCCNC2)cc1C ZINC000423344320 330192437 /nfs/dbraw/zinc/19/24/37/330192437.db2.gz XQACXLYFPYOWSW-WMZOPIPTSA-N 1 3 274.452 3.652 20 0 CHADHO C[C@H](NCC1=CC[NH2+]CC1)c1ccc(Cl)c(Cl)c1 ZINC000423349019 330192637 /nfs/dbraw/zinc/19/26/37/330192637.db2.gz VQQBXNITYJOKSL-JTQLQIEISA-N 1 3 285.218 3.564 20 0 CHADHO Cc1ccc([C@@H](C)NCc2ccc3c(c2)C[NH2+]C3)c(C)c1 ZINC000423353898 330193203 /nfs/dbraw/zinc/19/32/03/330193203.db2.gz FFYPBSMFSYTDPN-OAHLLOKOSA-N 1 3 280.415 3.757 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@H](N)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423359207 330193608 /nfs/dbraw/zinc/19/36/08/330193608.db2.gz CWBHFNBXLSMOKR-PJSNJIKXSA-N 1 3 298.883 3.753 20 0 CHADHO C[C@H]([NH2+][C@H]1CCN[C@H](C)C1)c1ccccc1C(C)(C)C ZINC000423362986 330193925 /nfs/dbraw/zinc/19/39/25/330193925.db2.gz AEFDIHZLLXPAIZ-ILXRZTDVSA-N 1 3 274.452 3.775 20 0 CHADHO CC[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccccc1 ZINC000423364387 330194416 /nfs/dbraw/zinc/19/44/16/330194416.db2.gz VVICATGUPMFXII-GOSISDBHSA-N 1 3 266.388 3.531 20 0 CHADHO C[C@@H]1CC[C@H](N[C@H]2CCC[C@H]([NH3+])C2)c2sccc21 ZINC000423365881 330194657 /nfs/dbraw/zinc/19/46/57/330194657.db2.gz KUYLTOAWDVBEJG-UHXUPSOCSA-N 1 3 264.438 3.546 20 0 CHADHO CC(C)C[C@H]([NH2+][C@H]1CCN[C@H](C)C1)c1cccs1 ZINC000423371025 330195013 /nfs/dbraw/zinc/19/50/13/330195013.db2.gz HGISZUGBOJJGJS-RDBSUJKOSA-N 1 3 266.454 3.565 20 0 CHADHO C[C@H]1C[C@@H](NCc2ccc3c(c2)C[NH2+]C3)c2ccccc21 ZINC000423368933 330195015 /nfs/dbraw/zinc/19/50/15/330195015.db2.gz DNDUWQQGFSMUSR-ORAYPTAESA-N 1 3 278.399 3.628 20 0 CHADHO CCCC[C@@H](C)[C@H](C)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423398248 330195893 /nfs/dbraw/zinc/19/58/93/330195893.db2.gz UGPZYZXIPVRODH-KGLIPLIRSA-N 1 3 260.425 3.594 20 0 CHADHO C[C@H]([NH2+][C@H]1CCN[C@H](C)C1)c1ccc(C(C)(C)C)cc1 ZINC000423401774 330196203 /nfs/dbraw/zinc/19/62/03/330196203.db2.gz XIQGPPKUMATZDQ-KEYYUXOJSA-N 1 3 274.452 3.775 20 0 CHADHO C[C@H](CCC(C)(C)C)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423402830 330196387 /nfs/dbraw/zinc/19/63/87/330196387.db2.gz WSDZPSVQLOOSAB-CYBMUJFWSA-N 1 3 260.425 3.594 20 0 CHADHO CC[C@H](Cc1ccc(C)cc1)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423406135 330196613 /nfs/dbraw/zinc/19/66/13/330196613.db2.gz YPKCXGSIJLRHNU-HXUWFJFHSA-N 1 3 294.442 3.709 20 0 CHADHO Fc1ccc([C@@H](NCc2ccc3c(c2)C[NH2+]C3)C2CC2)cc1 ZINC000423406608 330196953 /nfs/dbraw/zinc/19/69/53/330196953.db2.gz ZCKKCYNNJMLSJA-IBGZPJMESA-N 1 3 296.389 3.670 20 0 CHADHO CCC[C@H]([NH2+]Cc1ccc2c(c1)CNC2)C(C)(C)C ZINC000423385971 330199495 /nfs/dbraw/zinc/19/94/95/330199495.db2.gz LOTWSYSJYYHURY-INIZCTEOSA-N 1 3 260.425 3.594 20 0 CHADHO CC(C)Cc1cccc([C@H](C)[NH2+][C@H]2CCNC[C@@H]2C)c1 ZINC000423387137 330199882 /nfs/dbraw/zinc/19/98/82/330199882.db2.gz HPWDTKBOMUHBMJ-MPGHIAIKSA-N 1 3 274.452 3.534 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@H]2CCCC[C@@H]2c2ccccc2)C1 ZINC000423387356 330200061 /nfs/dbraw/zinc/20/00/61/330200061.db2.gz MMEJHBHULQORGR-XDNAFOTISA-N 1 3 272.436 3.572 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](N[C@@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000423388972 330200102 /nfs/dbraw/zinc/20/01/02/330200102.db2.gz NUVWEDFOJOTVEV-OWCLPIDISA-N 1 3 278.827 3.651 20 0 CHADHO Cc1ccc([C@H](N[C@@H]2CC[NH2+][C@@H](C)C2)C2CCC2)cc1 ZINC000423393568 330200569 /nfs/dbraw/zinc/20/05/69/330200569.db2.gz YUWXGCOWVZNOPI-BMGDILEWSA-N 1 3 272.436 3.566 20 0 CHADHO Cc1ccc([C@H]([NH2+][C@@H]2CCN[C@@H](C)C2)C2CCC2)cc1 ZINC000423393568 330200571 /nfs/dbraw/zinc/20/05/71/330200571.db2.gz YUWXGCOWVZNOPI-BMGDILEWSA-N 1 3 272.436 3.566 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@H]2CCC(C)(C)c3ccccc32)CCN1 ZINC000423394445 330200662 /nfs/dbraw/zinc/20/06/62/330200662.db2.gz ZRMZNIREDFSCGN-KEYYUXOJSA-N 1 3 272.436 3.529 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@H](c3cccc(Cl)c3)C2)CCN1 ZINC000423394430 330200743 /nfs/dbraw/zinc/20/07/43/330200743.db2.gz ZQWOHNUBJHYGFY-NQZOLGFYSA-N 1 3 292.854 3.706 20 0 CHADHO C[C@H](N)[C@H](C)[NH2+][C@@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000423432749 330201113 /nfs/dbraw/zinc/20/11/13/330201113.db2.gz BMJZCLRDJCALFT-HUBLWGQQSA-N 1 3 266.404 3.628 20 0 CHADHO C[C@@H](N[C@@H](C)CCC[NH3+])c1csc(-c2ccccc2)n1 ZINC000423446311 330202434 /nfs/dbraw/zinc/20/24/34/330202434.db2.gz CMRNIIDZHGQJNH-QWHCGFSZSA-N 1 3 289.448 3.588 20 0 CHADHO CCC[C@H]([NH2+][C@@H](C)[C@@H](C)N)c1cccc(C(F)(F)F)c1 ZINC000423451876 330202885 /nfs/dbraw/zinc/20/28/85/330202885.db2.gz VQBVNQTYWMPJNL-SUNKGSAMSA-N 1 3 288.357 3.872 20 0 CHADHO C[C@H](N)[C@H](C)[NH2+][C@@H](C)c1ccc(-c2ccc(F)cc2)s1 ZINC000423449786 330202899 /nfs/dbraw/zinc/20/28/99/330202899.db2.gz SDELTIGUQTVCPK-SRVKXCTJSA-N 1 3 292.423 3.941 20 0 CHADHO C[C@H](CCC[NH3+])N[C@H](C)c1cc(Cl)sc1Cl ZINC000423465510 330204418 /nfs/dbraw/zinc/20/44/18/330204418.db2.gz WOBWCXNXMWQYAU-HTQZYQBOSA-N 1 3 281.252 3.833 20 0 CHADHO C[C@@H](CCC[NH3+])N[C@@H](C)c1cc(Cl)sc1Cl ZINC000423465515 330204442 /nfs/dbraw/zinc/20/44/42/330204442.db2.gz WOBWCXNXMWQYAU-YUMQZZPRSA-N 1 3 281.252 3.833 20 0 CHADHO C[C@H](N)[C@H](C)[NH2+][C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423471635 330205210 /nfs/dbraw/zinc/20/52/10/330205210.db2.gz PSXHCDIXZMDBLC-PGUXBMHVSA-N 1 3 266.816 3.507 20 0 CHADHO C[C@H](N[C@@H]1CC[C@H](C[NH3+])C1)c1ccc(Cl)cc1Cl ZINC000423485287 330206807 /nfs/dbraw/zinc/20/68/07/330206807.db2.gz AZJXGJWJPLALGN-JBLDHEPKSA-N 1 3 287.234 3.771 20 0 CHADHO C[C@H](N[C@H](CCC[NH3+])c1ccccc1)c1cccc(F)c1 ZINC000423496397 330207897 /nfs/dbraw/zinc/20/78/97/330207897.db2.gz DPRXIKGKGQETTK-KBXCAEBGSA-N 1 3 286.394 3.957 20 0 CHADHO C[C@H](N[C@@H]1CC[C@H](C[NH3+])C1)c1cc(Cl)ccc1Cl ZINC000423496347 330207970 /nfs/dbraw/zinc/20/79/70/330207970.db2.gz WLVXABNSBICYCY-JBLDHEPKSA-N 1 3 287.234 3.771 20 0 CHADHO C[C@H](N[C@@H](CCC[NH3+])c1ccccc1)c1ccsc1 ZINC000423498300 330208195 /nfs/dbraw/zinc/20/81/95/330208195.db2.gz HXSFSUSZPIRMGW-BBRMVZONSA-N 1 3 274.433 3.879 20 0 CHADHO C[C@H]([NH2+]CCCNC1CC1)c1cccc(-c2ccncc2)c1 ZINC000423524707 330209993 /nfs/dbraw/zinc/20/99/93/330209993.db2.gz JXAXRLBBPXUTIY-HNNXBMFYSA-N 1 3 295.430 3.541 20 0 CHADHO C[C@H](NCCC1=CC[NH2+]CC1)c1cccc(Cl)c1Cl ZINC000423542891 330211106 /nfs/dbraw/zinc/21/11/06/330211106.db2.gz BKBVIGWSWPALRM-NSHDSACASA-N 1 3 299.245 3.954 20 0 CHADHO C[C@@H](NCCC1=CC[NH2+]CC1)c1cccc(Cl)c1Cl ZINC000423542890 330211126 /nfs/dbraw/zinc/21/11/26/330211126.db2.gz BKBVIGWSWPALRM-LLVKDONJSA-N 1 3 299.245 3.954 20 0 CHADHO Clc1ccc([C@@H]2CC[C@@H]([NH2+]CCCNC3CC3)C2)cc1 ZINC000423542841 330211134 /nfs/dbraw/zinc/21/11/34/330211134.db2.gz BDVKPMYTMNBUGD-RHSMWYFYSA-N 1 3 292.854 3.708 20 0 CHADHO CC(C)C[C@H](C)[NH2+][C@@H](C)c1cccc(OCCN(C)C)c1 ZINC000536839116 330232347 /nfs/dbraw/zinc/23/23/47/330232347.db2.gz NGPISJWKRVFYHW-HOTGVXAUSA-N 1 3 292.467 3.712 20 0 CHADHO CCC[C@H](C)[C@H](CC)[NH2+]CCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000536859119 330252634 /nfs/dbraw/zinc/25/26/34/330252634.db2.gz UTUZSIUAURSIAI-MLHJIOFPSA-N 1 3 298.515 3.680 20 0 CHADHO C([NH2+]C1CCN(C2CCCCC2)CC1)[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000527732628 330278337 /nfs/dbraw/zinc/27/83/37/330278337.db2.gz CTOBBVLOUFUACI-IXDOHACOSA-N 1 3 290.495 3.809 20 0 CHADHO C[C@@H]1CCCC[C@@H]1N1CCC([NH2+]CC2CC=CC2)CC1 ZINC000527947299 330294335 /nfs/dbraw/zinc/29/43/35/330294335.db2.gz YAZDJDHGQZOWKM-QAPCUYQASA-N 1 3 276.468 3.585 20 0 CHADHO CCN(C)C[C@@H]1CC[N@@H+]([C@@H](C)c2c(C)cc(C)cc2C)C1 ZINC000533011143 330324088 /nfs/dbraw/zinc/32/40/88/330324088.db2.gz TWAFCQHHZPFREM-ROUUACIJSA-N 1 3 288.479 3.946 20 0 CHADHO CCN(C)C[C@@H]1CC[N@H+]([C@@H](C)c2c(C)cc(C)cc2C)C1 ZINC000533011143 330324089 /nfs/dbraw/zinc/32/40/89/330324089.db2.gz TWAFCQHHZPFREM-ROUUACIJSA-N 1 3 288.479 3.946 20 0 CHADHO CC[N@H+](C)C[C@@H]1CCN([C@@H](C)c2c(C)cc(C)cc2C)C1 ZINC000533011143 330324090 /nfs/dbraw/zinc/32/40/90/330324090.db2.gz TWAFCQHHZPFREM-ROUUACIJSA-N 1 3 288.479 3.946 20 0 CHADHO CC[N@@H+](C)C[C@@H]1CCN([C@@H](C)c2c(C)cc(C)cc2C)C1 ZINC000533011143 330324091 /nfs/dbraw/zinc/32/40/91/330324091.db2.gz TWAFCQHHZPFREM-ROUUACIJSA-N 1 3 288.479 3.946 20 0 CHADHO CN1CC=C(C[NH2+][C@@H](C2CCC2)C2CCCCC2)CC1 ZINC000424285665 330334115 /nfs/dbraw/zinc/33/41/15/330334115.db2.gz PEXDSRZQOSVVIN-GOSISDBHSA-N 1 3 276.468 3.587 20 0 CHADHO CC[C@H]1CCC[C@@H]([NH2+]CCCN2CCC(C)CC2)C1 ZINC000071107114 330351127 /nfs/dbraw/zinc/35/11/27/330351127.db2.gz IRMCTJNSMZXMSC-DLBZAZTESA-N 1 3 266.473 3.667 20 0 CHADHO CC(C)[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1ccccc1 ZINC000537016716 330379316 /nfs/dbraw/zinc/37/93/16/330379316.db2.gz SQZGFGJAFXVMSM-KURKYZTESA-N 1 3 274.452 3.846 20 0 CHADHO CC(C)[C@H](N[C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccccc1 ZINC000537016716 330379317 /nfs/dbraw/zinc/37/93/17/330379317.db2.gz SQZGFGJAFXVMSM-KURKYZTESA-N 1 3 274.452 3.846 20 0 CHADHO C[C@H](N[C@H]1CCC[C@@H]1C[NH3+])c1ccc(Cl)c(Cl)c1 ZINC000089147702 330380940 /nfs/dbraw/zinc/38/09/40/330380940.db2.gz FFHAAQCNAXYGOX-PXWWUCIGSA-N 1 3 287.234 3.771 20 0 CHADHO CC1(C)CCC[C@H]([NH2+]C2CCN(c3ccncc3)CC2)C1 ZINC000149582404 330575676 /nfs/dbraw/zinc/57/56/76/330575676.db2.gz CXSRQRXCPWMDQQ-INIZCTEOSA-N 1 3 287.451 3.609 20 0 CHADHO CC[C@H](COC)NC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449162824 330902578 /nfs/dbraw/zinc/90/25/78/330902578.db2.gz KDCXXTHNSYYJLR-OAHLLOKOSA-N 1 3 298.515 3.680 20 0 CHADHO C[C@@H]1CC[C@@H](NC[C@H]2CC[N@@H+](C3CC3)C2)c2sccc21 ZINC000453076625 331086924 /nfs/dbraw/zinc/08/69/24/331086924.db2.gz JIVCWDKBTGFLFR-XJKCOSOUSA-N 1 3 290.476 3.760 20 0 CHADHO C[C@@H]1CC[C@@H](NC[C@H]2CC[N@H+](C3CC3)C2)c2sccc21 ZINC000453076625 331086925 /nfs/dbraw/zinc/08/69/25/331086925.db2.gz JIVCWDKBTGFLFR-XJKCOSOUSA-N 1 3 290.476 3.760 20 0 CHADHO CC[C@H](NCc1cccc(C[N@H+](C)CC)c1)c1ccncc1 ZINC000453109222 331089889 /nfs/dbraw/zinc/08/98/89/331089889.db2.gz OZBJIXYUJPDBMY-IBGZPJMESA-N 1 3 297.446 3.774 20 0 CHADHO CC[C@H](NCc1cccc(C[N@@H+](C)CC)c1)c1ccncc1 ZINC000453109222 331089890 /nfs/dbraw/zinc/08/98/90/331089890.db2.gz OZBJIXYUJPDBMY-IBGZPJMESA-N 1 3 297.446 3.774 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@H]2NC1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000453335267 331118293 /nfs/dbraw/zinc/11/82/93/331118293.db2.gz DFVUOJPOEMVNLG-RGPMPMONSA-N 1 3 298.474 3.896 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@H]2NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000453335267 331118294 /nfs/dbraw/zinc/11/82/94/331118294.db2.gz DFVUOJPOEMVNLG-RGPMPMONSA-N 1 3 298.474 3.896 20 0 CHADHO C[C@@H]1CC[C@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2sccc21 ZINC000453347662 331120140 /nfs/dbraw/zinc/12/01/40/331120140.db2.gz KXMBHSRZKYTBSX-NOTZBRRKSA-N 1 3 290.476 3.901 20 0 CHADHO C[C@@H]1CC[C@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2sccc21 ZINC000453347662 331120141 /nfs/dbraw/zinc/12/01/41/331120141.db2.gz KXMBHSRZKYTBSX-NOTZBRRKSA-N 1 3 290.476 3.901 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCN(Cc3ccccc3)C2)o1 ZINC000195132014 331137990 /nfs/dbraw/zinc/13/79/90/331137990.db2.gz KWKDOKUJPGJKNM-FUHWJXTLSA-N 1 3 298.430 3.761 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCN(Cc3ccccc3)C2)o1 ZINC000195132006 331138001 /nfs/dbraw/zinc/13/80/01/331138001.db2.gz KWKDOKUJPGJKNM-SJLPKXTDSA-N 1 3 298.430 3.761 20 0 CHADHO C[NH+](C)CCC1CCN(CCc2cccc(Cl)c2)CC1 ZINC000459316186 331275906 /nfs/dbraw/zinc/27/59/06/331275906.db2.gz AKVCKZYAHBQJEO-UHFFFAOYSA-N 1 3 294.870 3.546 20 0 CHADHO CCC[C@H]([NH2+]C1CCN(c2ccncc2)CC1)C(C)(C)C ZINC000459567748 331288209 /nfs/dbraw/zinc/28/82/09/331288209.db2.gz AKADNKJDCIZQLC-KRWDZBQOSA-N 1 3 289.467 3.855 20 0 CHADHO C[N@@H+]1CCC[C@H](CCNCc2ccc(-c3ccccc3)o2)C1 ZINC000459725171 331295958 /nfs/dbraw/zinc/29/59/58/331295958.db2.gz FQIOBJWNRXQDQK-MRXNPFEDSA-N 1 3 298.430 3.768 20 0 CHADHO C[N@H+]1CCC[C@H](CCNCc2ccc(-c3ccccc3)o2)C1 ZINC000459725171 331295959 /nfs/dbraw/zinc/29/59/59/331295959.db2.gz FQIOBJWNRXQDQK-MRXNPFEDSA-N 1 3 298.430 3.768 20 0 CHADHO CN1CCC[C@H]1CC[NH2+][C@H]1CCCCC12CCCC2 ZINC000463444237 331347590 /nfs/dbraw/zinc/34/75/90/331347590.db2.gz MEDCLFYVEXVJLX-HOTGVXAUSA-N 1 3 264.457 3.563 20 0 CHADHO C[C@@H]1CCC[C@H](C[NH2+]C2CCN(C(C)(C)C)CC2)[C@@H]1C ZINC000481988390 331820326 /nfs/dbraw/zinc/82/03/26/331820326.db2.gz FPCILKNWZGMYKM-BZUAXINKSA-N 1 3 280.500 3.911 20 0 CHADHO CC(C)[C@H](C)C[NH2+][C@H](C)c1ccc(OCCN(C)C)cc1 ZINC000484174799 331894257 /nfs/dbraw/zinc/89/42/57/331894257.db2.gz ZEBPFFUUSDXOIR-HZPDHXFCSA-N 1 3 292.467 3.570 20 0 CHADHO C[C@@H]1CN(CCC[N@@H+]2C[C@@H](C)CC2(C)C)C(C)(C)C1 ZINC000489356505 332048483 /nfs/dbraw/zinc/04/84/83/332048483.db2.gz FQMDQIMUXBEEPO-GJZGRUSLSA-N 1 3 266.473 3.617 20 0 CHADHO C[C@@H]1CN(CCC[N@H+]2C[C@@H](C)CC2(C)C)C(C)(C)C1 ZINC000489356505 332048484 /nfs/dbraw/zinc/04/84/84/332048484.db2.gz FQMDQIMUXBEEPO-GJZGRUSLSA-N 1 3 266.473 3.617 20 0 CHADHO NCCC[N@@H+](Cc1ccccc1)C[C@@H]1CCCC(F)(F)C1 ZINC000336658790 335109831 /nfs/dbraw/zinc/10/98/31/335109831.db2.gz AEQQWERXSQNWJB-MRXNPFEDSA-N 1 3 296.405 3.663 20 0 CHADHO NCCC[N@H+](Cc1ccccc1)C[C@@H]1CCCC(F)(F)C1 ZINC000336658790 335109832 /nfs/dbraw/zinc/10/98/32/335109832.db2.gz AEQQWERXSQNWJB-MRXNPFEDSA-N 1 3 296.405 3.663 20 0 CHADHO [NH3+]CCCN(Cc1ccccc1)C[C@@H]1CCCC(F)(F)C1 ZINC000336658790 335109834 /nfs/dbraw/zinc/10/98/34/335109834.db2.gz AEQQWERXSQNWJB-MRXNPFEDSA-N 1 3 296.405 3.663 20 0 CHADHO C[C@@H]1CCCC[C@H]1[NH+]1CCC(N[C@H]2CCCSC2)CC1 ZINC000513336325 333014608 /nfs/dbraw/zinc/01/46/08/333014608.db2.gz WJTBVDKSFSFIOY-HYVNUMGLSA-N 1 3 296.524 3.515 20 0 CHADHO C[C@@H]1CCCC[C@H]1N1CCC([NH2+][C@H]2CCCSC2)CC1 ZINC000513336325 333014609 /nfs/dbraw/zinc/01/46/09/333014609.db2.gz WJTBVDKSFSFIOY-HYVNUMGLSA-N 1 3 296.524 3.515 20 0 CHADHO C[N@@H+]1CC[C@H](NCc2ccc3ccccc3c2)[C@@H]2CCC[C@H]21 ZINC000513668372 333030904 /nfs/dbraw/zinc/03/09/04/333030904.db2.gz XNSADEMSFIQZFF-SLFFLAALSA-N 1 3 294.442 3.802 20 0 CHADHO C[N@H+]1CC[C@H](NCc2ccc3ccccc3c2)[C@@H]2CCC[C@H]21 ZINC000513668372 333030905 /nfs/dbraw/zinc/03/09/05/333030905.db2.gz XNSADEMSFIQZFF-SLFFLAALSA-N 1 3 294.442 3.802 20 0 CHADHO CC(C)(CN[C@@H]1C[C@@H]([NH3+])c2ccccc21)C1=CCCC1 ZINC000308771320 333038628 /nfs/dbraw/zinc/03/86/28/333038628.db2.gz SSMDDBHCTHQBNU-IAGOWNOFSA-N 1 3 270.420 3.857 20 0 CHADHO CC[C@@H](C)C[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000309878673 333050816 /nfs/dbraw/zinc/05/08/16/333050816.db2.gz VDLVGKRSNXWFRE-MJGOQNOKSA-N 1 3 288.479 3.924 20 0 CHADHO CC1(C)C([NH2+]C2CCN(C3CCCCC3)CC2)C1(C)C ZINC000520893047 333107396 /nfs/dbraw/zinc/10/73/96/333107396.db2.gz NWNIBHIYWJNULB-UHFFFAOYSA-N 1 3 278.484 3.808 20 0 CHADHO CC1(C)C(NC2CC[NH+](C3CCCCC3)CC2)C1(C)C ZINC000520893047 333107398 /nfs/dbraw/zinc/10/73/98/333107398.db2.gz NWNIBHIYWJNULB-UHFFFAOYSA-N 1 3 278.484 3.808 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+](C[C@@H]2CC(C)=C[C@@H](C)C2)C1 ZINC000520904362 333107534 /nfs/dbraw/zinc/10/75/34/333107534.db2.gz IFKGARGEQJPPAS-NJAFHUGGSA-N 1 3 278.484 3.643 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+](C[C@@H]2CC(C)=C[C@@H](C)C2)C1 ZINC000520904362 333107536 /nfs/dbraw/zinc/10/75/36/333107536.db2.gz IFKGARGEQJPPAS-NJAFHUGGSA-N 1 3 278.484 3.643 20 0 CHADHO CCCC[C@H](CCC)[NH2+]C1CCN(c2ccncc2)CC1 ZINC000226001249 333245167 /nfs/dbraw/zinc/24/51/67/333245167.db2.gz AUSABYQWVFTYQY-INIZCTEOSA-N 1 3 289.467 3.999 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](N[C@H](c2cccs2)C2CCCC2)C1 ZINC000227474838 333283393 /nfs/dbraw/zinc/28/33/93/333283393.db2.gz MEGUKERRJXGUAX-YCPHGPKFSA-N 1 3 278.465 3.839 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](C)c2cc3c(s2)CCCC3)C1 ZINC000250227640 333303600 /nfs/dbraw/zinc/30/36/00/333303600.db2.gz FRSUAOLFQDGFSB-KGLIPLIRSA-N 1 3 292.492 3.619 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](C)c2cc3c(s2)CCCC3)C1 ZINC000250227640 333303602 /nfs/dbraw/zinc/30/36/02/333303602.db2.gz FRSUAOLFQDGFSB-KGLIPLIRSA-N 1 3 292.492 3.619 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](C)c2cc3c(s2)CCCC3)C1 ZINC000250227640 333303603 /nfs/dbraw/zinc/30/36/03/333303603.db2.gz FRSUAOLFQDGFSB-KGLIPLIRSA-N 1 3 292.492 3.619 20 0 CHADHO CC1CCN(C[C@@H]2CCC[N@H+](CC3CCCC3)C2)CC1 ZINC000523656994 333335257 /nfs/dbraw/zinc/33/52/57/333335257.db2.gz NEKAMAWRMFHZSC-SFHVURJKSA-N 1 3 278.484 3.621 20 0 CHADHO CC1CCN(C[C@@H]2CCC[N@@H+](CC3CCCC3)C2)CC1 ZINC000523656994 333335259 /nfs/dbraw/zinc/33/52/59/333335259.db2.gz NEKAMAWRMFHZSC-SFHVURJKSA-N 1 3 278.484 3.621 20 0 CHADHO C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(CC2CCCC2)C1 ZINC000524356421 333360625 /nfs/dbraw/zinc/36/06/25/333360625.db2.gz OBNCLYCAXKJPHS-AEFFLSMTSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(CC2CCCC2)C1 ZINC000524356421 333360626 /nfs/dbraw/zinc/36/06/26/333360626.db2.gz OBNCLYCAXKJPHS-AEFFLSMTSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@@H]1CCCCN1C[C@H]1CCC[N@H+](CC2CCCC2)C1 ZINC000524356421 333360627 /nfs/dbraw/zinc/36/06/27/333360627.db2.gz OBNCLYCAXKJPHS-AEFFLSMTSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@@H]1CCCCN1C[C@H]1CCC[N@@H+](CC2CCCC2)C1 ZINC000524356421 333360628 /nfs/dbraw/zinc/36/06/28/333360628.db2.gz OBNCLYCAXKJPHS-AEFFLSMTSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@@H](C[NH2+]Cc1cccc(CN(C)C)c1)Cc1ccccc1 ZINC000541588897 333782606 /nfs/dbraw/zinc/78/26/06/333782606.db2.gz ZUSKHZMEWUOMHR-QGZVFWFLSA-N 1 3 296.458 3.717 20 0 CHADHO FC(F)c1ccc(C[NH2+]C2CCN(CC3CC3)CC2)cc1 ZINC000546615282 334040680 /nfs/dbraw/zinc/04/06/80/334040680.db2.gz XOKSKXGRHAZAIM-UHFFFAOYSA-N 1 3 294.389 3.588 20 0 CHADHO Cc1cc(Cl)cc(C[NH2+][C@H]2CCC[C@H](N(C)C)C2)c1 ZINC000549763860 334204195 /nfs/dbraw/zinc/20/41/95/334204195.db2.gz NYYKXUTYIPWZHN-HOTGVXAUSA-N 1 3 280.843 3.611 20 0 CHADHO Cc1cc(Cl)cc(C[NH2+][C@@H]2CCC[C@H](N(C)C)C2)c1 ZINC000549763858 334204198 /nfs/dbraw/zinc/20/41/98/334204198.db2.gz NYYKXUTYIPWZHN-CVEARBPZSA-N 1 3 280.843 3.611 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H](CC)c2cccs2)C1 ZINC000246992336 334273534 /nfs/dbraw/zinc/27/35/34/334273534.db2.gz KGQQACVVVRFEQX-ZIAGYGMSSA-N 1 3 266.454 3.521 20 0 CHADHO C[C@H](NC[C@@H]1CCC[N@H+](C)C1)c1cccc(C2CC2)c1 ZINC000551050626 334237223 /nfs/dbraw/zinc/23/72/23/334237223.db2.gz JKAHUXPTOMLHHN-GJZGRUSLSA-N 1 3 272.436 3.556 20 0 CHADHO C[C@H](NC[C@@H]1CCC[N@@H+](C)C1)c1cccc(C2CC2)c1 ZINC000551050626 334237224 /nfs/dbraw/zinc/23/72/24/334237224.db2.gz JKAHUXPTOMLHHN-GJZGRUSLSA-N 1 3 272.436 3.556 20 0 CHADHO C[NH+](C)[C@@H]1CCC[C@H](N[C@H](c2ccccc2)C2CC2)C1 ZINC000246168074 334237946 /nfs/dbraw/zinc/23/79/46/334237946.db2.gz VBVOAJBPUYKOGA-RCCFBDPRSA-N 1 3 272.436 3.600 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@H](c2ccccc2)C2CC2)C1 ZINC000246168074 334237947 /nfs/dbraw/zinc/23/79/47/334237947.db2.gz VBVOAJBPUYKOGA-RCCFBDPRSA-N 1 3 272.436 3.600 20 0 CHADHO C[N@@H+]1CC[C@H](NCc2cccc3ccccc32)[C@@H]2CCC[C@H]21 ZINC000552248726 334308510 /nfs/dbraw/zinc/30/85/10/334308510.db2.gz QWCKWZYFQGGAGQ-SLFFLAALSA-N 1 3 294.442 3.802 20 0 CHADHO C[N@H+]1CC[C@H](NCc2cccc3ccccc32)[C@@H]2CCC[C@H]21 ZINC000552248726 334308512 /nfs/dbraw/zinc/30/85/12/334308512.db2.gz QWCKWZYFQGGAGQ-SLFFLAALSA-N 1 3 294.442 3.802 20 0 CHADHO C[C@@H]1CCCc2ccccc2[C@@H]1N[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000248749132 334315856 /nfs/dbraw/zinc/31/58/56/334315856.db2.gz FRBTUEWMQXWMNC-HGKSCXNLSA-N 1 3 298.474 3.917 20 0 CHADHO C[C@@H]1CCCc2ccccc2[C@@H]1N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000248749132 334315858 /nfs/dbraw/zinc/31/58/58/334315858.db2.gz FRBTUEWMQXWMNC-HGKSCXNLSA-N 1 3 298.474 3.917 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](C)c2ccc3ccccc3c2)C1 ZINC000249382733 334332873 /nfs/dbraw/zinc/33/28/73/334332873.db2.gz UIGCVVUXCZETGX-HZPDHXFCSA-N 1 3 282.431 3.832 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](C)c2ccc3ccccc3c2)C1 ZINC000249382733 334332875 /nfs/dbraw/zinc/33/28/75/334332875.db2.gz UIGCVVUXCZETGX-HZPDHXFCSA-N 1 3 282.431 3.832 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](C)c2ccc3ccccc3c2)C1 ZINC000249382733 334332876 /nfs/dbraw/zinc/33/28/76/334332876.db2.gz UIGCVVUXCZETGX-HZPDHXFCSA-N 1 3 282.431 3.832 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](C)c2cccc3ccccc32)C1 ZINC000249381940 334332880 /nfs/dbraw/zinc/33/28/80/334332880.db2.gz SFIMVMBBGGQFLF-HZPDHXFCSA-N 1 3 282.431 3.832 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](C)c2cccc3ccccc32)C1 ZINC000249381940 334332882 /nfs/dbraw/zinc/33/28/82/334332882.db2.gz SFIMVMBBGGQFLF-HZPDHXFCSA-N 1 3 282.431 3.832 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](C)c2cccc3ccccc32)C1 ZINC000249381940 334332883 /nfs/dbraw/zinc/33/28/83/334332883.db2.gz SFIMVMBBGGQFLF-HZPDHXFCSA-N 1 3 282.431 3.832 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](C)c2oc3ccccc3c2C)C1 ZINC000249379517 334332941 /nfs/dbraw/zinc/33/29/41/334332941.db2.gz PHFRVMKEHJVFJS-CABCVRRESA-N 1 3 286.419 3.734 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](C)c2oc3ccccc3c2C)C1 ZINC000249379521 334332961 /nfs/dbraw/zinc/33/29/61/334332961.db2.gz PHFRVMKEHJVFJS-HUUCEWRRSA-N 1 3 286.419 3.734 20 0 CHADHO CC(C)(CN[C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1)c1cccs1 ZINC000250693705 334348654 /nfs/dbraw/zinc/34/86/54/334348654.db2.gz NQJGNELQOXSAPI-RRFJBIMHSA-N 1 3 292.492 3.536 20 0 CHADHO Cc1ccc([C@@H](C)[NH2+]CCCN2CCCC[C@H]2C)s1 ZINC000251235118 334358547 /nfs/dbraw/zinc/35/85/47/334358547.db2.gz NZAXWRHAJZKZCT-UKRRQHHQSA-N 1 3 280.481 3.972 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCN2CCC[C@H]2C1)C1CCCCC1 ZINC000251296225 334359570 /nfs/dbraw/zinc/35/95/70/334359570.db2.gz AQMYUEGIVPUNSN-IKGGRYGDSA-N 1 3 264.457 3.562 20 0 CHADHO C[C@@H]1CCC[C@H]([NH2+]C2CC(C)(C)NC(C)(C)C2)[C@H]1C ZINC000251659995 334366266 /nfs/dbraw/zinc/36/62/66/334366266.db2.gz FZCGOMNBVSJLRZ-IPYPFGDCSA-N 1 3 266.473 3.710 20 0 CHADHO CSc1ccc([C@H](C)N[C@H]2CCCC[C@H]2C[NH3+])cc1 ZINC000251781741 334369564 /nfs/dbraw/zinc/36/95/64/334369564.db2.gz SWKWEWISECVSHX-NOLJZWGESA-N 1 3 278.465 3.577 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H]2CCCC[C@H]2c2ccccc2)C1 ZINC000252438602 334380002 /nfs/dbraw/zinc/38/00/02/334380002.db2.gz DPTKTCXLTPRJLI-NEWSRXKRSA-N 1 3 286.463 3.644 20 0 CHADHO CCC[C@H](NCCC1CC[NH+](CC)CC1)c1ccccn1 ZINC000159228216 334856106 /nfs/dbraw/zinc/85/61/06/334856106.db2.gz VEMXHEVNQKGHSV-KRWDZBQOSA-N 1 3 289.467 3.634 20 0 CHADHO Cc1cccc([C@H](C)NCc2ccc(C[NH3+])cc2)c1C ZINC000576399540 335198878 /nfs/dbraw/zinc/19/88/78/335198878.db2.gz RPLMJCZABGFBGO-HNNXBMFYSA-N 1 3 268.404 3.613 20 0 CHADHO CCc1ccc([C@H](CC)[NH2+]CC2=CCN(C)CC2)cc1 ZINC000344295536 335246602 /nfs/dbraw/zinc/24/66/02/335246602.db2.gz UCPVJACJQFJIMY-SFHVURJKSA-N 1 3 272.436 3.552 20 0 CHADHO N[C@H]1CCC[C@H]([NH2+]C2(Cc3ccc(Cl)cc3)CCC2)C1 ZINC000577232256 335327779 /nfs/dbraw/zinc/32/77/79/335327779.db2.gz YCMSTZVPJQPFKW-HOTGVXAUSA-N 1 3 292.854 3.665 20 0 CHADHO [NH3+][C@H]1CCC[C@H](NC2(Cc3ccc(Cl)cc3)CCC2)C1 ZINC000577232256 335327780 /nfs/dbraw/zinc/32/77/80/335327780.db2.gz YCMSTZVPJQPFKW-HOTGVXAUSA-N 1 3 292.854 3.665 20 0 CHADHO CC(C)[C@H]1C[C@@H](N[C@@H](C)[C@@H]2CCC[NH2+]C2)c2ccccc21 ZINC000577274101 335333168 /nfs/dbraw/zinc/33/31/68/335333168.db2.gz BRWQXPMFISCLDO-OSGQAZFXSA-N 1 3 286.463 3.849 20 0 CHADHO CC(C)CC[C@H]([NH2+]CC1=CCN(C)CC1)C(C)(C)C ZINC000581451985 336079704 /nfs/dbraw/zinc/07/97/04/336079704.db2.gz BORMPDUNHWPTPL-INIZCTEOSA-N 1 3 266.473 3.689 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)NCc1cccc(C)c1F ZINC000384482220 336124914 /nfs/dbraw/zinc/12/49/14/336124914.db2.gz ZBVYLBZPHMYSLL-OAHLLOKOSA-N 1 3 280.431 3.734 20 0 CHADHO CSCC1CCC([NH2+]C[C@H](C)CN2CCCCC2)CC1 ZINC000385648489 336153347 /nfs/dbraw/zinc/15/33/47/336153347.db2.gz JLPZJJOCCKBSER-GTPINHCMSA-N 1 3 298.540 3.620 20 0 CHADHO C/C(=C\c1ccccc1)C[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000263819856 518443662 /nfs/dbraw/zinc/44/36/62/518443662.db2.gz PSVOKGNEHWFVGO-JQIJEIRASA-N 1 3 286.463 3.942 20 0 CHADHO CC(C)(CN[C@H]1C[C@@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000157410573 519271142 /nfs/dbraw/zinc/27/11/42/519271142.db2.gz LGKSKJJUMUAKSC-MSOLQXFVSA-N 1 3 280.415 3.699 20 0 CHADHO CC(C)Oc1cccc([C@H](C)N[C@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC000130111470 519783723 /nfs/dbraw/zinc/78/37/23/519783723.db2.gz KNMSIVAUNCBAMG-VYDXJSESSA-N 1 3 290.451 3.607 20 0 CHADHO CC(C)Oc1cccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@H](C)C2)c1 ZINC000130111470 519783724 /nfs/dbraw/zinc/78/37/24/519783724.db2.gz KNMSIVAUNCBAMG-VYDXJSESSA-N 1 3 290.451 3.607 20 0 CHADHO CC1(C)CCCC[C@@H]1N[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000227542149 520315520 /nfs/dbraw/zinc/31/55/20/520315520.db2.gz BQNPBNOECIPLFH-OAGGEKHMSA-N 1 3 258.409 3.690 20 0 CHADHO CCC[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC000037062480 520772117 /nfs/dbraw/zinc/77/21/17/520772117.db2.gz LXDGQVIVYCZIGQ-HQSKLWIPSA-N 1 3 272.436 3.743 20 0 CHADHO CCC[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC000037062480 520772126 /nfs/dbraw/zinc/77/21/26/520772126.db2.gz LXDGQVIVYCZIGQ-HQSKLWIPSA-N 1 3 272.436 3.743 20 0 CHADHO CC[NH+]1CCC(N[C@H](C)c2ccc(SC)cc2)CC1 ZINC000036994311 521581415 /nfs/dbraw/zinc/58/14/15/521581415.db2.gz JXTLDIUNVBVUID-CYBMUJFWSA-N 1 3 278.465 3.543 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)c2oc3ccccc3c2C)C1 ZINC000037644449 521717896 /nfs/dbraw/zinc/71/78/96/521717896.db2.gz PHFRVMKEHJVFJS-LSDHHAIUSA-N 1 3 286.419 3.734 20 0 CHADHO CC[C@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(C)cc1 ZINC000037649153 522633274 /nfs/dbraw/zinc/63/32/74/522633274.db2.gz FCBQOFFGWZJELH-QAPCUYQASA-N 1 3 272.436 3.520 20 0 CHADHO CC[C@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc(C)cc1 ZINC000037649153 522633281 /nfs/dbraw/zinc/63/32/81/522633281.db2.gz FCBQOFFGWZJELH-QAPCUYQASA-N 1 3 272.436 3.520 20 0 CHADHO CC[C@@H]([NH2+]CC1(SC)CCN(C)CC1)c1cccs1 ZINC000353612597 522820721 /nfs/dbraw/zinc/82/07/21/522820721.db2.gz SLIVQQBKUHKFNM-CYBMUJFWSA-N 1 3 298.521 3.616 20 0 CHADHO CC[C@H]1CCCC[C@H]1[NH2+]C1CCN(c2ccncc2)CC1 ZINC000037031396 523061668 /nfs/dbraw/zinc/06/16/68/523061668.db2.gz YJGGPEJQJPMQCQ-MAUKXSAKSA-N 1 3 287.451 3.609 20 0 CHADHO C[C@@H](CCN(C)C)[NH2+][C@@H]1C[C@H](C)Sc2sccc21 ZINC000130478751 524479279 /nfs/dbraw/zinc/47/92/79/524479279.db2.gz YUKUVOMLLIZUBX-GMXVVIOVSA-N 1 3 284.494 3.603 20 0 CHADHO Cc1cc(N2CCC([NH2+]C(C)C)CC2)c2ccccc2n1 ZINC000264938147 525056331 /nfs/dbraw/zinc/05/63/31/525056331.db2.gz HGAANHHZOGVRQT-UHFFFAOYSA-N 1 3 283.419 3.510 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]CC1=CCN(C)CC1 ZINC000280310613 526053348 /nfs/dbraw/zinc/05/33/48/526053348.db2.gz ORONSHGJNBYESD-KBPBESRZSA-N 1 3 292.854 3.684 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]2[NH2+][C@H]2CCN3CCC[C@H]3C2)cc1 ZINC000278450925 526491332 /nfs/dbraw/zinc/49/13/32/526491332.db2.gz LLSWZHQRDQURBB-CADBVGFASA-N 1 3 284.447 3.539 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]2N[C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000278450925 526491333 /nfs/dbraw/zinc/49/13/33/526491333.db2.gz LLSWZHQRDQURBB-CADBVGFASA-N 1 3 284.447 3.539 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]2N[C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000278450925 526491336 /nfs/dbraw/zinc/49/13/36/526491336.db2.gz LLSWZHQRDQURBB-CADBVGFASA-N 1 3 284.447 3.539 20 0 CHADHO N[C@H]1C[C@@H]([NH2+]CCSc2ccccc2)c2ccccc21 ZINC000157408948 527419954 /nfs/dbraw/zinc/41/99/54/527419954.db2.gz HZWZQBFQCFIVST-DLBZAZTESA-N 1 3 284.428 3.513 20 0 CHADHO CCN1CC[C@H]([N@H+](C)Cc2ccc3ccccc3n2)C[C@@H]1C ZINC000353749443 527835013 /nfs/dbraw/zinc/83/50/13/527835013.db2.gz KYYQWUJWBFSMNV-YJBOKZPZSA-N 1 3 297.446 3.539 20 0 CHADHO CCN1CC[C@H]([N@@H+](C)Cc2ccc3ccccc3n2)C[C@@H]1C ZINC000353749443 527835018 /nfs/dbraw/zinc/83/50/18/527835018.db2.gz KYYQWUJWBFSMNV-YJBOKZPZSA-N 1 3 297.446 3.539 20 0 CHADHO CC[N@@H+]1CC[C@H](N[C@H]2CCCc3ccc(C)cc32)[C@@H](C)C1 ZINC000352611844 527889219 /nfs/dbraw/zinc/88/92/19/527889219.db2.gz KNWOXNDLGGOMIV-SNRMKQJTSA-N 1 3 286.463 3.692 20 0 CHADHO CC[N@H+]1CC[C@H](N[C@H]2CCCc3ccc(C)cc32)[C@@H](C)C1 ZINC000352611844 527889223 /nfs/dbraw/zinc/88/92/23/527889223.db2.gz KNWOXNDLGGOMIV-SNRMKQJTSA-N 1 3 286.463 3.692 20 0 CHADHO CC(C)CN1CCC([NH2+]Cc2ccc3occc3c2)CC1 ZINC000352767018 527963994 /nfs/dbraw/zinc/96/39/94/527963994.db2.gz AZYSTJHBJLOEKG-UHFFFAOYSA-N 1 3 286.419 3.643 20 0 CHADHO CCSc1ccccc1[C@H](C)NCC1=CC[N@H+](C)CC1 ZINC000344302022 529257564 /nfs/dbraw/zinc/25/75/64/529257564.db2.gz SGKJYZJGLCMNSH-AWEZNQCLSA-N 1 3 290.476 3.711 20 0 CHADHO CCSc1ccccc1[C@H](C)NCC1=CC[N@@H+](C)CC1 ZINC000344302022 529257565 /nfs/dbraw/zinc/25/75/65/529257565.db2.gz SGKJYZJGLCMNSH-AWEZNQCLSA-N 1 3 290.476 3.711 20 0 CHADHO C(CC1CCCCCC1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246241390 1131426963 /nfs/dbraw/zinc/42/69/63/1131426963.db2.gz WVLPWKSOAYYSRU-FVQHAEBGSA-N 1 3 264.457 3.610 20 0 CHADHO C[C@H](N[C@@H]1CCC[NH2+]CC1)c1ccc(C(C)(C)C)cc1 ZINC000133627269 1125481331 /nfs/dbraw/zinc/48/13/31/1125481331.db2.gz QHQKWHUOPINZNR-WMLDXEAASA-N 1 3 274.452 3.777 20 0 CHADHO CSCCCCCC[NH2+][C@@H]1CCNC[C@H]1C1CCCC1 ZINC000925637735 1120501419 /nfs/dbraw/zinc/50/14/19/1120501419.db2.gz QVZHUDRTXOYSHP-DLBZAZTESA-N 1 3 298.540 3.668 20 0 CHADHO CC[C@H](C)[C@@H](C)[N@H+]1CCC[C@@H](CN2CCC(C)CC2)C1 ZINC001190652315 1122550389 /nfs/dbraw/zinc/55/03/89/1122550389.db2.gz ZOHACQNJSADUPV-KSZLIROESA-N 1 3 280.500 3.865 20 0 CHADHO C[C@@H]1C[C@H]([NH3+])CCN1CCCSc1ccccc1Cl ZINC000516659729 1122618257 /nfs/dbraw/zinc/61/82/57/1122618257.db2.gz CJCANLLJGJSKOZ-CHWSQXEVSA-N 1 3 298.883 3.634 20 0 CHADHO CCCN1C[C@@H]2C[N@@H+](C[C@@H](C)CCC=C(C)C)C[C@@H]2C1 ZINC001201496811 1123110631 /nfs/dbraw/zinc/11/06/31/1123110631.db2.gz RTZCVKFNVUUWGM-OKZBNKHCSA-N 1 3 278.484 3.643 20 0 CHADHO CCCN1C[C@@H]2C[N@H+](C[C@@H](C)CCC=C(C)C)C[C@@H]2C1 ZINC001201496811 1123110633 /nfs/dbraw/zinc/11/06/33/1123110633.db2.gz RTZCVKFNVUUWGM-OKZBNKHCSA-N 1 3 278.484 3.643 20 0 CHADHO CCC[C@@H](C)C[N@@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001201550293 1123117819 /nfs/dbraw/zinc/11/78/19/1123117819.db2.gz IEXKBTYYXHEHEA-IAGOWNOFSA-N 1 3 266.473 3.763 20 0 CHADHO CCC[C@@H](C)C[N@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001201550293 1123117822 /nfs/dbraw/zinc/11/78/22/1123117822.db2.gz IEXKBTYYXHEHEA-IAGOWNOFSA-N 1 3 266.473 3.763 20 0 CHADHO CCC[C@H](C)C[N@@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001201550291 1123118048 /nfs/dbraw/zinc/11/80/48/1123118048.db2.gz IEXKBTYYXHEHEA-DLBZAZTESA-N 1 3 266.473 3.763 20 0 CHADHO CCC[C@H](C)C[N@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001201550291 1123118049 /nfs/dbraw/zinc/11/80/49/1123118049.db2.gz IEXKBTYYXHEHEA-DLBZAZTESA-N 1 3 266.473 3.763 20 0 CHADHO C[C@@H]1CCC[C@@H](CC[N@@H+]2CCC[C@H](N(C)C)CC2)C1 ZINC000429531812 1123557782 /nfs/dbraw/zinc/55/77/82/1123557782.db2.gz WRDALCDVBXFXBG-IKGGRYGDSA-N 1 3 266.473 3.619 20 0 CHADHO C[C@@H]1CCC[C@@H](CC[N@H+]2CCC[C@H](N(C)C)CC2)C1 ZINC000429531812 1123557787 /nfs/dbraw/zinc/55/77/87/1123557787.db2.gz WRDALCDVBXFXBG-IKGGRYGDSA-N 1 3 266.473 3.619 20 0 CHADHO CC[C@@H](COC)NC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449162823 1124662886 /nfs/dbraw/zinc/66/28/86/1124662886.db2.gz KDCXXTHNSYYJLR-HNNXBMFYSA-N 1 3 298.515 3.680 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]C2CCC(C(C)(C)C)CC2)C1 ZINC000040620939 1125388818 /nfs/dbraw/zinc/38/88/18/1125388818.db2.gz GLDYCLXTOZNOIF-KLAILNCOSA-N 1 3 280.500 3.911 20 0 CHADHO CC[C@@H](C)C[C@H](CC)NC[C@]1(CC2CC2)CCC[NH2+]1 ZINC001246463063 1131511518 /nfs/dbraw/zinc/51/15/18/1131511518.db2.gz VJIZKHFTZDEWCU-HYVNUMGLSA-N 1 3 266.473 3.713 20 0 CHADHO CN1C(C)(C)CC([N@@H+]2CC[C@H](C(F)(F)F)C2)CC1(C)C ZINC001171639613 1132080157 /nfs/dbraw/zinc/08/01/57/1132080157.db2.gz QICRJMLVHRVLBM-NSHDSACASA-N 1 3 292.389 3.522 20 0 CHADHO CN1C(C)(C)CC([N@H+]2CC[C@H](C(F)(F)F)C2)CC1(C)C ZINC001171639613 1132080167 /nfs/dbraw/zinc/08/01/67/1132080167.db2.gz QICRJMLVHRVLBM-NSHDSACASA-N 1 3 292.389 3.522 20 0 CHADHO Cc1ccc([C@@H](C)C[NH2+]C2CCN(CC(C)C)CC2)cc1 ZINC000152000068 1125636067 /nfs/dbraw/zinc/63/60/67/1125636067.db2.gz KSAVMQOIEOIEPV-KRWDZBQOSA-N 1 3 288.479 3.809 20 0 CHADHO Cc1ccccc1-c1cccc(CN2CC[C@](C)(C[NH3+])C2)c1 ZINC000261879732 1125745815 /nfs/dbraw/zinc/74/58/15/1125745815.db2.gz UMWPBNPUWGVXPU-HXUWFJFHSA-N 1 3 294.442 3.833 20 0 CHADHO Cc1ccccc1-c1cccc(CN2CC[C@@](C)(C[NH3+])C2)c1 ZINC000261879731 1125746122 /nfs/dbraw/zinc/74/61/22/1125746122.db2.gz UMWPBNPUWGVXPU-FQEVSTJZSA-N 1 3 294.442 3.833 20 0 CHADHO Cc1ccccc1[C@H](C(C)C)N(C)C[C@@]1(C)CC[NH2+]C1 ZINC000261994344 1125748736 /nfs/dbraw/zinc/74/87/36/1125748736.db2.gz KPJNOLFIMGJWAZ-ROUUACIJSA-N 1 3 274.452 3.624 20 0 CHADHO CCCN(Cc1ccc(C(F)F)cc1)C1CC[NH2+]CC1 ZINC000262016207 1125751198 /nfs/dbraw/zinc/75/11/98/1125751198.db2.gz VRSSWRQKOITALB-UHFFFAOYSA-N 1 3 282.378 3.588 20 0 CHADHO CCC[N@H+](Cc1ccc(C(F)F)cc1)C1CCNCC1 ZINC000262016207 1125751204 /nfs/dbraw/zinc/75/12/04/1125751204.db2.gz VRSSWRQKOITALB-UHFFFAOYSA-N 1 3 282.378 3.588 20 0 CHADHO CCC[N@@H+](Cc1ccc(C(F)F)cc1)C1CCNCC1 ZINC000262016207 1125751210 /nfs/dbraw/zinc/75/12/10/1125751210.db2.gz VRSSWRQKOITALB-UHFFFAOYSA-N 1 3 282.378 3.588 20 0 CHADHO CCSc1ccc([C@@H](C)[NH2+]C[C@@H]2CCN(CC)C2)cc1 ZINC000533785287 1125781645 /nfs/dbraw/zinc/78/16/45/1125781645.db2.gz RBHPTSYPZMIXRX-CABCVRRESA-N 1 3 292.492 3.791 20 0 CHADHO C[NH+](C)CC[C@@H](N[C@H]1CCc2cc(F)ccc21)C(C)(C)C ZINC000483175384 1126770998 /nfs/dbraw/zinc/77/09/98/1126770998.db2.gz ICWCYXJIJZJTIS-DLBZAZTESA-N 1 3 292.442 3.769 20 0 CHADHO C[C@@H](CCCC(F)(F)F)[NH2+]CCCN1CCCC[C@@H]1C ZINC000163195101 1126800257 /nfs/dbraw/zinc/80/02/57/1126800257.db2.gz RRTVLBURTXTRGY-KBPBESRZSA-N 1 3 294.405 3.962 20 0 CHADHO Cc1cccc([C@H](C)[NH2+][C@H]2CCC[C@@H](N(C)C)C2)c1C ZINC000484482070 1126820935 /nfs/dbraw/zinc/82/09/35/1126820935.db2.gz BJHZATBGENROBM-YESZJQIVSA-N 1 3 274.452 3.827 20 0 CHADHO Cc1ccc(C)c([C@H](C)[NH2+][C@H]2CCC[C@H](N(C)C)C2)c1 ZINC000484482999 1126821055 /nfs/dbraw/zinc/82/10/55/1126821055.db2.gz GAKUNFOUFMYQEL-ULQDDVLXSA-N 1 3 274.452 3.827 20 0 CHADHO Cc1cc([C@H](C)[NH2+][C@@H]2CCC[C@H](N(C)C)C2)cc(C)c1F ZINC000484473171 1126820487 /nfs/dbraw/zinc/82/04/87/1126820487.db2.gz LVXRCOBJDATHQG-UAGQMJEPSA-N 1 3 292.442 3.966 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1cc2c(s1)CCC2 ZINC000484504839 1126823178 /nfs/dbraw/zinc/82/31/78/1126823178.db2.gz QXHBPJZNGNSFAP-NWANDNLSSA-N 1 3 292.492 3.760 20 0 CHADHO C[C@H]([NH2+][C@@H](CCN(C)C)C(C)(C)C)c1ccc(Cl)nc1 ZINC000179127580 1126824199 /nfs/dbraw/zinc/82/41/99/1126824199.db2.gz AVTQNUMXYZSXLP-JSGCOSHPSA-N 1 3 297.874 3.752 20 0 CHADHO CC(C)[C@H](CNC[C@@H]([NH3+])CCC(C)(C)C)c1cccnc1 ZINC000904363540 1126850086 /nfs/dbraw/zinc/85/00/86/1126850086.db2.gz IBQDZMFYNMQCQS-IRXDYDNUSA-N 1 3 291.483 3.564 20 0 CHADHO Cc1c(C)c(C)c(CN2CCC(C)([NH3+])CC2)c(C)c1C ZINC001235749828 1130776874 /nfs/dbraw/zinc/77/68/74/1130776874.db2.gz XMPDBMVHUHETMD-UHFFFAOYSA-N 1 3 274.452 3.542 20 0 CHADHO CCC[C@H](NC1CC[NH+](C2CC2)CC1)c1ccsc1 ZINC000191190505 1126948661 /nfs/dbraw/zinc/94/86/61/1126948661.db2.gz RPUDNZWKBFGYEB-INIZCTEOSA-N 1 3 278.465 3.806 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1)[C@H]1CC1(C)C ZINC000487555991 1127034792 /nfs/dbraw/zinc/03/47/92/1127034792.db2.gz UGHZOXAMOCWCRO-QSJFSLAZSA-N 1 3 278.484 3.664 20 0 CHADHO CCN(Cc1ccsc1)Cc1ccc(C[NH+](C)C)cc1 ZINC000348963945 1127135775 /nfs/dbraw/zinc/13/57/75/1127135775.db2.gz KJCAOOGWPNHXBA-UHFFFAOYSA-N 1 3 288.460 3.832 20 0 CHADHO c1csc([C@H]2CCCN2C2CC[NH+](CC3CC3)CC2)c1 ZINC001168379415 1127163014 /nfs/dbraw/zinc/16/30/14/1127163014.db2.gz JVCSAFLDPIDAQJ-MRXNPFEDSA-N 1 3 290.476 3.759 20 0 CHADHO CCC[N@@H+]1CCC[C@H]1CN[C@H](CC)c1ccc(OC)cc1 ZINC000353973019 1127282647 /nfs/dbraw/zinc/28/26/47/1127282647.db2.gz PCXYSGREXDIMJX-FUHWJXTLSA-N 1 3 290.451 3.610 20 0 CHADHO CCC[N@H+]1CCC[C@H]1CN[C@H](CC)c1ccc(OC)cc1 ZINC000353973019 1127282650 /nfs/dbraw/zinc/28/26/50/1127282650.db2.gz PCXYSGREXDIMJX-FUHWJXTLSA-N 1 3 290.451 3.610 20 0 CHADHO Clc1cccc2c1CC[C@H]2NC1CC[NH+](C2CC2)CC1 ZINC000359666788 1127472189 /nfs/dbraw/zinc/47/21/89/1127472189.db2.gz XXMASWXFFPOAPV-QGZVFWFLSA-N 1 3 290.838 3.544 20 0 CHADHO Clc1cccc2c1CC[C@@H]2NC1CC[NH+](C2CC2)CC1 ZINC000359666787 1127472412 /nfs/dbraw/zinc/47/24/12/1127472412.db2.gz XXMASWXFFPOAPV-KRWDZBQOSA-N 1 3 290.838 3.544 20 0 CHADHO CCC[NH+](CCC)Cc1cc(F)cc(CN(C)C)c1 ZINC001232144265 1127622597 /nfs/dbraw/zinc/62/25/97/1127622597.db2.gz LIBHDFVEJBJLFZ-UHFFFAOYSA-N 1 3 266.404 3.509 20 0 CHADHO Cc1cccc([C@H](C)NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1C ZINC000296040999 1127661257 /nfs/dbraw/zinc/66/12/57/1127661257.db2.gz UJWPYCHASYRCGE-XYTVBORESA-N 1 3 272.436 3.579 20 0 CHADHO Cc1cccc([C@H](C)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1C ZINC000296040999 1127661260 /nfs/dbraw/zinc/66/12/60/1127661260.db2.gz UJWPYCHASYRCGE-XYTVBORESA-N 1 3 272.436 3.579 20 0 CHADHO CCC1CCN(CC(C)C[NH+]2CCC(CC)CC2)CC1 ZINC000605575626 1127743696 /nfs/dbraw/zinc/74/36/96/1127743696.db2.gz LMFLUANRNLNMOG-UHFFFAOYSA-N 1 3 280.500 3.867 20 0 CHADHO CC(C)(C)N1CCC([NH2+]C2(c3ccccc3)CC2)CC1 ZINC000539624157 1127933555 /nfs/dbraw/zinc/93/35/55/1127933555.db2.gz GRYDVPGZISMDBC-UHFFFAOYSA-N 1 3 272.436 3.528 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2CC[C@@H](C)C[C@H]2CC)C1 ZINC000539857711 1127947892 /nfs/dbraw/zinc/94/78/92/1127947892.db2.gz BNBSQLUDRLYHKG-QBPKDAKJSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@H](C[NH2+][C@H]1C[C@H](C)C[C@H](C)C1)CN1CCCCC1 ZINC000252137699 1127956438 /nfs/dbraw/zinc/95/64/38/1127956438.db2.gz MTBHSBFWTYXUQG-TWMKSMIVSA-N 1 3 266.473 3.523 20 0 CHADHO CCC(C)(C)c1ccc(CN[C@H]2CC[N@H+](C)C[C@H]2C)cc1 ZINC000540153087 1127964972 /nfs/dbraw/zinc/96/49/72/1127964972.db2.gz DTVBQEIJHIQFOQ-QAPCUYQASA-N 1 3 288.479 3.804 20 0 CHADHO CCC(C)(C)c1ccc(CN[C@H]2CC[N@@H+](C)C[C@H]2C)cc1 ZINC000540153087 1127964977 /nfs/dbraw/zinc/96/49/77/1127964977.db2.gz DTVBQEIJHIQFOQ-QAPCUYQASA-N 1 3 288.479 3.804 20 0 CHADHO CC[C@H](CN[C@@H]1C[C@H]([NH3+])c2ccccc21)CC(F)(F)F ZINC000402674558 1128022863 /nfs/dbraw/zinc/02/28/63/1128022863.db2.gz PFBOBAVVYCZLNT-LEWSCRJBSA-N 1 3 286.341 3.699 20 0 CHADHO CC(C)CCN1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000303511183 1128070561 /nfs/dbraw/zinc/07/05/61/1128070561.db2.gz BLMMMZXKTCHWJA-IAGOWNOFSA-N 1 3 266.473 3.619 20 0 CHADHO CC(C)CCN1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000303511183 1128070565 /nfs/dbraw/zinc/07/05/65/1128070565.db2.gz BLMMMZXKTCHWJA-IAGOWNOFSA-N 1 3 266.473 3.619 20 0 CHADHO CCC[C@H](CC)[N@@H+](Cc1ccccc1)C[C@@H](C)CN ZINC001257250891 1128091845 /nfs/dbraw/zinc/09/18/45/1128091845.db2.gz WTROBMQECBJQHJ-RDJZCZTQSA-N 1 3 262.441 3.662 20 0 CHADHO CCC[C@H](CC)[N@H+](Cc1ccccc1)C[C@@H](C)CN ZINC001257250891 1128091848 /nfs/dbraw/zinc/09/18/48/1128091848.db2.gz WTROBMQECBJQHJ-RDJZCZTQSA-N 1 3 262.441 3.662 20 0 CHADHO CC(C)(C)[C@@H]([NH2+]C1CCN(C2CCCC2)CC1)C1CC1 ZINC000925222428 1128125850 /nfs/dbraw/zinc/12/58/50/1128125850.db2.gz VSSLVIYHQDVMGI-KRWDZBQOSA-N 1 3 278.484 3.808 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H](C)C2CCCCCC2)C1 ZINC000542476777 1128162516 /nfs/dbraw/zinc/16/25/16/1128162516.db2.gz CCKWKVMHEGCAJF-JKSUJKDBSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@@H]1C[C@H](C)CN(CCC[NH2+]C2CCCCCC2)C1 ZINC000559870898 1128238832 /nfs/dbraw/zinc/23/88/32/1128238832.db2.gz PBUDEJHUWUSNGQ-IYBDPMFKSA-N 1 3 266.473 3.667 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H]2C[C@@H](C(C)C)c3ccccc32)C1 ZINC000562592602 1128412534 /nfs/dbraw/zinc/41/25/34/1128412534.db2.gz MPCOGOKXUXGMCB-AYOQOUSVSA-N 1 3 286.463 3.802 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H]2C[C@@H](C(C)C)c3ccccc32)C1 ZINC000562592602 1128412538 /nfs/dbraw/zinc/41/25/38/1128412538.db2.gz MPCOGOKXUXGMCB-AYOQOUSVSA-N 1 3 286.463 3.802 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H]2C[C@@H](C(C)C)c3ccccc32)C1 ZINC000562592602 1128412540 /nfs/dbraw/zinc/41/25/40/1128412540.db2.gz MPCOGOKXUXGMCB-AYOQOUSVSA-N 1 3 286.463 3.802 20 0 CHADHO CCC[C@H](C[NH2+]C[C@@H]1CCN(C(C)C)C1)c1ccccc1 ZINC000561612782 1128341231 /nfs/dbraw/zinc/34/12/31/1128341231.db2.gz QNCPCJPSLXSWOE-PKOBYXMFSA-N 1 3 288.479 3.890 20 0 CHADHO CCCCCCc1ccc(CN2C[C@H](C)[C@H](C[NH3+])C2)s1 ZINC001205156243 1128341810 /nfs/dbraw/zinc/34/18/10/1128341810.db2.gz VECXVSPHEVJAGV-LSDHHAIUSA-N 1 3 294.508 3.898 20 0 CHADHO CCCC[C@@H](CC)N1CCC([NH+](CC)CC)CC1 ZINC001257422174 1128353398 /nfs/dbraw/zinc/35/33/98/1128353398.db2.gz DUPZGYOHDZZTHC-OAHLLOKOSA-N 1 3 254.462 3.761 20 0 CHADHO CN(C)[C@H]1CCC[N@H+](C[C@@H]2CCCC(C)(C)C2)CC1 ZINC000562417900 1128401436 /nfs/dbraw/zinc/40/14/36/1128401436.db2.gz SXALCOLOPQEAPK-CVEARBPZSA-N 1 3 266.473 3.619 20 0 CHADHO CN(C)[C@H]1CCC[N@@H+](C[C@@H]2CCCC(C)(C)C2)CC1 ZINC000562417900 1128401437 /nfs/dbraw/zinc/40/14/37/1128401437.db2.gz SXALCOLOPQEAPK-CVEARBPZSA-N 1 3 266.473 3.619 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@H+](C)C[C@H]1CCCNC1 ZINC001235952429 1128410571 /nfs/dbraw/zinc/41/05/71/1128410571.db2.gz XQNZIJOVSYBHRL-IRXDYDNUSA-N 1 3 298.515 3.539 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@@H+](C)C[C@H]1CCCNC1 ZINC001235952429 1128410573 /nfs/dbraw/zinc/41/05/73/1128410573.db2.gz XQNZIJOVSYBHRL-IRXDYDNUSA-N 1 3 298.515 3.539 20 0 CHADHO C[C@H]1C[C@H](N(C)Cc2ccc3ccccc3c2)CC[N@@H+]1C ZINC000123342881 1128410891 /nfs/dbraw/zinc/41/08/91/1128410891.db2.gz VDUVNDUAWYGGFI-HNAYVOBHSA-N 1 3 282.431 3.754 20 0 CHADHO C[C@H]1C[C@H](N(C)Cc2ccc3ccccc3c2)CC[N@H+]1C ZINC000123342881 1128410893 /nfs/dbraw/zinc/41/08/93/1128410893.db2.gz VDUVNDUAWYGGFI-HNAYVOBHSA-N 1 3 282.431 3.754 20 0 CHADHO Cc1c2ccccc2oc1[C@H](C)[NH2+]CC(C)(C)CN(C)C ZINC000037197127 1128421429 /nfs/dbraw/zinc/42/14/29/1128421429.db2.gz NLFIGPUQQGATNO-AWEZNQCLSA-N 1 3 288.435 3.980 20 0 CHADHO CC(C)c1ccc([C@H](C)NC[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000037649523 1128434674 /nfs/dbraw/zinc/43/46/74/1128434674.db2.gz PSYXUHPSSFFXPK-HOTGVXAUSA-N 1 3 286.463 3.945 20 0 CHADHO CC(C)c1ccc([C@H](C)NC[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000037649523 1128434676 /nfs/dbraw/zinc/43/46/76/1128434676.db2.gz PSYXUHPSSFFXPK-HOTGVXAUSA-N 1 3 286.463 3.945 20 0 CHADHO Cc1ccc(C)c([C@H](C)NC[C@@H](C)C[NH+]2CCCC2)c1 ZINC000062078162 1128437188 /nfs/dbraw/zinc/43/71/88/1128437188.db2.gz SKTPGEANPDZJIW-WBVHZDCISA-N 1 3 274.452 3.686 20 0 CHADHO CC1CCN(CCC[NH2+][C@@H]2CCc3cc(F)ccc32)CC1 ZINC000128589172 1128506018 /nfs/dbraw/zinc/50/60/18/1128506018.db2.gz NOCRBLMUNOMKLZ-GOSISDBHSA-N 1 3 290.426 3.525 20 0 CHADHO NC[C@@H]1CCC[N@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC000564968973 1128517678 /nfs/dbraw/zinc/51/76/78/1128517678.db2.gz NNYWDLFYMPTURL-HFCFLWKCSA-N 1 3 286.463 3.631 20 0 CHADHO NC[C@@H]1CCC[N@@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC000564968973 1128517682 /nfs/dbraw/zinc/51/76/82/1128517682.db2.gz NNYWDLFYMPTURL-HFCFLWKCSA-N 1 3 286.463 3.631 20 0 CHADHO COc1cc(C)ccc1[C@H](C)NCc1ccc([C@@H](C)[NH3+])cc1 ZINC000565710355 1128531084 /nfs/dbraw/zinc/53/10/84/1128531084.db2.gz ITSLVMMYEHDXBT-CABCVRRESA-N 1 3 298.430 3.874 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCc2cc(F)ccc21)CN1CCCCC1 ZINC000129198445 1128534606 /nfs/dbraw/zinc/53/46/06/1128534606.db2.gz YNOWLPNZNQNLSS-RDTXWAMCSA-N 1 3 290.426 3.525 20 0 CHADHO C[C@@H]1CCC[C@H](N2CCC([NH2+][C@@H]3CCC[C@@H](F)C3)CC2)C1 ZINC000567048017 1128556498 /nfs/dbraw/zinc/55/64/98/1128556498.db2.gz HCJLOTMEFCAOKZ-AHCXZYCDSA-N 1 3 296.474 3.900 20 0 CHADHO [NH3+]C[C@H](N[C@H]1CCCc2c3ccccc3[nH]c21)C1CCCC1 ZINC000567724432 1128570094 /nfs/dbraw/zinc/57/00/94/1128570094.db2.gz PMUZOHNEDLGBTK-ROUUACIJSA-N 1 3 297.446 3.652 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC(C)(C)C1)[C@H]1CCCN(C2CCC2)C1 ZINC000568137407 1128578453 /nfs/dbraw/zinc/57/84/53/1128578453.db2.gz AXTWFTLUTGVJQA-JYJNAYRXSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@H]1C[C@H](N)CC[N@@H+]1CC1CCC(c2ccccc2)CC1 ZINC000569706873 1128607801 /nfs/dbraw/zinc/60/78/01/1128607801.db2.gz UPIRSMBHBUIMQS-NHFHULPWSA-N 1 3 286.463 3.772 20 0 CHADHO C[C@H]1C[C@H](N)CC[N@H+]1CC1CCC(c2ccccc2)CC1 ZINC000569706873 1128607804 /nfs/dbraw/zinc/60/78/04/1128607804.db2.gz UPIRSMBHBUIMQS-NHFHULPWSA-N 1 3 286.463 3.772 20 0 CHADHO CC(C)c1ccc(C[N@@H+]2CCC[C@@H]3CN(C)CC[C@@H]32)cc1 ZINC000570320066 1128621541 /nfs/dbraw/zinc/62/15/41/1128621541.db2.gz YCUDVRHGEFXMQP-MOPGFXCFSA-N 1 3 286.463 3.726 20 0 CHADHO CC(C)c1ccc(C[N@H+]2CCC[C@@H]3CN(C)CC[C@@H]32)cc1 ZINC000570320066 1128621542 /nfs/dbraw/zinc/62/15/42/1128621542.db2.gz YCUDVRHGEFXMQP-MOPGFXCFSA-N 1 3 286.463 3.726 20 0 CHADHO CC(C)c1ccc(CN2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)cc1 ZINC000570320066 1128621543 /nfs/dbraw/zinc/62/15/43/1128621543.db2.gz YCUDVRHGEFXMQP-MOPGFXCFSA-N 1 3 286.463 3.726 20 0 CHADHO CC(C)c1ccc(CN2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)cc1 ZINC000570320066 1128621544 /nfs/dbraw/zinc/62/15/44/1128621544.db2.gz YCUDVRHGEFXMQP-MOPGFXCFSA-N 1 3 286.463 3.726 20 0 CHADHO CCc1cccc2c(CN(C)C3CC[NH+](CC)CC3)c[nH]c21 ZINC001138361248 1128632026 /nfs/dbraw/zinc/63/20/26/1128632026.db2.gz JYGOVMHYIODCRX-UHFFFAOYSA-N 1 3 299.462 3.646 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]C[C@@H](C)CC2CCCCC2)C1 ZINC000578401318 1128716829 /nfs/dbraw/zinc/71/68/29/1128716829.db2.gz GHWWMBRYIOEQRG-FUHWJXTLSA-N 1 3 280.500 3.913 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@H]2CCCCC23CCCC3)C1 ZINC000578650186 1128724955 /nfs/dbraw/zinc/72/49/55/1128724955.db2.gz GSZOFDCRRDRDQM-SJORKVTESA-N 1 3 278.484 3.811 20 0 CHADHO CCN(CC)CCC[N@H+](C)C(C)(C)c1ccccc1 ZINC000671246036 1117784299 /nfs/dbraw/zinc/78/42/99/1117784299.db2.gz NGUFZRWOWQWHGV-UHFFFAOYSA-N 1 3 262.441 3.585 20 0 CHADHO CCN(CC)CCC[N@@H+](C)C(C)(C)c1ccccc1 ZINC000671246036 1117784304 /nfs/dbraw/zinc/78/43/04/1117784304.db2.gz NGUFZRWOWQWHGV-UHFFFAOYSA-N 1 3 262.441 3.585 20 0 CHADHO CC(C)[C@H]1CC[C@@H](C)C[C@H]1[NH2+][C@@H]1CCNC2(CCC2)C1 ZINC000643546234 1117792594 /nfs/dbraw/zinc/79/25/94/1117792594.db2.gz KSAAYOISRASYLG-QBPKDAKJSA-N 1 3 278.484 3.712 20 0 CHADHO CC(C)CC[C@@H]1CC[C@H]([NH2+][C@H]2CCNC3(CCC3)C2)C1 ZINC000643548132 1117797994 /nfs/dbraw/zinc/79/79/94/1117797994.db2.gz MWTDKUGGECSQDJ-IKGGRYGDSA-N 1 3 278.484 3.856 20 0 CHADHO C[C@@H]([NH2+][C@H]1CCNC2(CCC2)C1)C1CCCCCC1 ZINC000643547455 1117798307 /nfs/dbraw/zinc/79/83/07/1117798307.db2.gz FSQJKSPFZKHXTH-ZBFHGGJFSA-N 1 3 264.457 3.610 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@H]2N[C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643547951 1117799287 /nfs/dbraw/zinc/79/92/87/1117799287.db2.gz LDGPQVAVFLKKDH-FUHWJXTLSA-N 1 3 298.474 3.945 20 0 CHADHO CC[C@@H](N[C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(OC)cc1 ZINC000623339768 1117838938 /nfs/dbraw/zinc/83/89/38/1117838938.db2.gz JNDPLNFGKHLEAB-NVXWUHKLSA-N 1 3 290.451 3.609 20 0 CHADHO CC[C@@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(OC)cc1 ZINC000623339768 1117838944 /nfs/dbraw/zinc/83/89/44/1117838944.db2.gz JNDPLNFGKHLEAB-NVXWUHKLSA-N 1 3 290.451 3.609 20 0 CHADHO C[C@@H](C[NH2+]CC[C@H](C)N1CCCCC1)C(C)(C)C ZINC000670269052 1117849266 /nfs/dbraw/zinc/84/92/66/1117849266.db2.gz LDXARHGUSLQCHE-GJZGRUSLSA-N 1 3 254.462 3.523 20 0 CHADHO C[C@@H](CCc1ccccc1)C[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000623657463 1117883693 /nfs/dbraw/zinc/88/36/93/1117883693.db2.gz RFWLRXFRSMGWEM-HKUYNNGSSA-N 1 3 288.479 3.577 20 0 CHADHO CC[C@@H](C)[C@@H](C)[NH2+]C1CCN(CC2CCCC2)CC1 ZINC000178158110 1117887780 /nfs/dbraw/zinc/88/77/80/1117887780.db2.gz JQGWNVLSNWUCAF-HUUCEWRRSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@H]1C[C@H](NC2(c3ccc(Cl)cc3)CCC2)CC[N@@H+]1C ZINC000180355554 1117929059 /nfs/dbraw/zinc/92/90/59/1117929059.db2.gz CYPSMFXOKLFXCK-XJKSGUPXSA-N 1 3 292.854 3.792 20 0 CHADHO C[C@H]1C[C@H](NC2(c3ccc(Cl)cc3)CCC2)CC[N@H+]1C ZINC000180355554 1117929063 /nfs/dbraw/zinc/92/90/63/1117929063.db2.gz CYPSMFXOKLFXCK-XJKSGUPXSA-N 1 3 292.854 3.792 20 0 CHADHO c1ccc([C@@H]([NH2+]CCCN2CCCC2)C2CCC2)cc1 ZINC000119930652 1117969425 /nfs/dbraw/zinc/96/94/25/1117969425.db2.gz CGEFPUYTGGHDKA-GOSISDBHSA-N 1 3 272.436 3.603 20 0 CHADHO c1ccc([C@@H](NCCC[NH+]2CCCC2)C2CCC2)cc1 ZINC000119930652 1117969428 /nfs/dbraw/zinc/96/94/28/1117969428.db2.gz CGEFPUYTGGHDKA-GOSISDBHSA-N 1 3 272.436 3.603 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H](C)Cc2ccc(Cl)cc2)C1 ZINC000232668474 1117973560 /nfs/dbraw/zinc/97/35/60/1117973560.db2.gz MLYBTVPKRWLRNP-GOEBONIOSA-N 1 3 294.870 3.591 20 0 CHADHO Cc1ccc([C@H]([NH2+]C[C@@H]2CCCCN(C)C2)C2CC2)cc1 ZINC000624122149 1117984441 /nfs/dbraw/zinc/98/44/41/1117984441.db2.gz KWKJJEQSBZTPDF-LPHOPBHVSA-N 1 3 286.463 3.768 20 0 CHADHO Cc1ccc([C@H](NC[C@@H]2CCCC[N@@H+](C)C2)C2CC2)cc1 ZINC000624122149 1117984445 /nfs/dbraw/zinc/98/44/45/1117984445.db2.gz KWKJJEQSBZTPDF-LPHOPBHVSA-N 1 3 286.463 3.768 20 0 CHADHO Cc1ccc([C@H](NC[C@@H]2CCCC[N@H+](C)C2)C2CC2)cc1 ZINC000624122149 1117984447 /nfs/dbraw/zinc/98/44/47/1117984447.db2.gz KWKJJEQSBZTPDF-LPHOPBHVSA-N 1 3 286.463 3.768 20 0 CHADHO C[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccc(Cl)s1 ZINC000624120109 1117984962 /nfs/dbraw/zinc/98/49/62/1117984962.db2.gz RLJGOPDYQWZVFV-NEPJUHHUSA-N 1 3 286.872 3.784 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)C(C)(C)c1ccccc1 ZINC000624122076 1117986326 /nfs/dbraw/zinc/98/63/26/1117986326.db2.gz JFNKEVITKRHERS-IAGOWNOFSA-N 1 3 288.479 3.674 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)cc1C ZINC000624120430 1117986436 /nfs/dbraw/zinc/98/64/36/1117986436.db2.gz YWRSRYUBFZLOQS-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+](C[C@@H](C)Cc2ccccc2)C1 ZINC000182043136 1118011732 /nfs/dbraw/zinc/01/17/32/1118011732.db2.gz MOOVHOFWSOLDME-HKUYNNGSSA-N 1 3 288.479 3.529 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+](C[C@@H](C)Cc2ccccc2)C1 ZINC000182043136 1118011735 /nfs/dbraw/zinc/01/17/35/1118011735.db2.gz MOOVHOFWSOLDME-HKUYNNGSSA-N 1 3 288.479 3.529 20 0 CHADHO CC(C)[C@@H](NC[C@H]1CCC[N@H+](C)C1)c1ccc(F)c(F)c1 ZINC000182073361 1118013196 /nfs/dbraw/zinc/01/31/96/1118013196.db2.gz QUJXBOKCFNIFSO-CXAGYDPISA-N 1 3 296.405 3.593 20 0 CHADHO CC(C)[C@@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccc(F)c(F)c1 ZINC000182073361 1118013201 /nfs/dbraw/zinc/01/32/01/1118013201.db2.gz QUJXBOKCFNIFSO-CXAGYDPISA-N 1 3 296.405 3.593 20 0 CHADHO C[C@@H](NCCCC[N@@H+]1CCCC[C@H]1C)c1ccncc1F ZINC000340187620 1118105266 /nfs/dbraw/zinc/10/52/66/1118105266.db2.gz XYLOVTREBPXDMB-HUUCEWRRSA-N 1 3 293.430 3.526 20 0 CHADHO C[C@@H](NCCCC[N@H+]1CCCC[C@H]1C)c1ccncc1F ZINC000340187620 1118105268 /nfs/dbraw/zinc/10/52/68/1118105268.db2.gz XYLOVTREBPXDMB-HUUCEWRRSA-N 1 3 293.430 3.526 20 0 CHADHO Cc1ccc2c(c1)CC[C@H]2NC1CC[NH+](C2CCC2)CC1 ZINC000765429422 1118152333 /nfs/dbraw/zinc/15/23/33/1118152333.db2.gz VHNQTWHQLCMOAY-LJQANCHMSA-N 1 3 284.447 3.589 20 0 CHADHO C[C@H]1CC[C@@H]([NH2+]C2CCN(CC3CCCC3)CC2)CS1 ZINC000655703779 1118188155 /nfs/dbraw/zinc/18/81/55/1118188155.db2.gz LHEFFEBVXPIUGU-WMLDXEAASA-N 1 3 296.524 3.515 20 0 CHADHO C[C@H]([NH2+]Cc1ccccc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000306747605 1118340554 /nfs/dbraw/zinc/34/05/54/1118340554.db2.gz FPYBZZMJEUEXHH-PXNSSMCTSA-N 1 3 294.442 3.687 20 0 CHADHO C[C@H](NCc1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000306747605 1118340560 /nfs/dbraw/zinc/34/05/60/1118340560.db2.gz FPYBZZMJEUEXHH-PXNSSMCTSA-N 1 3 294.442 3.687 20 0 CHADHO C[C@H](NCc1ccccc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000306747605 1118340566 /nfs/dbraw/zinc/34/05/66/1118340566.db2.gz FPYBZZMJEUEXHH-PXNSSMCTSA-N 1 3 294.442 3.687 20 0 CHADHO CCC[NH+]1CCC(NC[C@@H](C)Sc2ccccc2)CC1 ZINC000129685627 1118443757 /nfs/dbraw/zinc/44/37/57/1118443757.db2.gz GZRLBDRPMKOIPD-OAHLLOKOSA-N 1 3 292.492 3.631 20 0 CHADHO CN(CCC1=CCCCC1)CC[C@H]1CCCC[N@@H+]1C ZINC001657424499 1118456438 /nfs/dbraw/zinc/45/64/38/1118456438.db2.gz QSZQEJWPCWVWJN-QGZVFWFLSA-N 1 3 264.457 3.683 20 0 CHADHO CN(CCC1=CCCCC1)CC[C@H]1CCCC[N@H+]1C ZINC001657424499 1118456444 /nfs/dbraw/zinc/45/64/44/1118456444.db2.gz QSZQEJWPCWVWJN-QGZVFWFLSA-N 1 3 264.457 3.683 20 0 CHADHO CC(C)C[C@@H]([NH2+]CC[C@@H]1CCCN1C)c1ccccc1 ZINC000341036123 1118591639 /nfs/dbraw/zinc/59/16/39/1118591639.db2.gz ITISMTWGLKPGES-ZWKOTPCHSA-N 1 3 274.452 3.848 20 0 CHADHO CC(C)C[C@@H](NCC[C@@H]1CCC[N@@H+]1C)c1ccccc1 ZINC000341036123 1118591640 /nfs/dbraw/zinc/59/16/40/1118591640.db2.gz ITISMTWGLKPGES-ZWKOTPCHSA-N 1 3 274.452 3.848 20 0 CHADHO CC(C)C[C@@H](NCC[C@@H]1CCC[N@H+]1C)c1ccccc1 ZINC000341036123 1118591642 /nfs/dbraw/zinc/59/16/42/1118591642.db2.gz ITISMTWGLKPGES-ZWKOTPCHSA-N 1 3 274.452 3.848 20 0 CHADHO C[C@H]([NH3+])[C@H]1CCN(Cc2cccc(C3CCCC3)c2)C1 ZINC000656785711 1118657753 /nfs/dbraw/zinc/65/77/53/1118657753.db2.gz IOCHQTHHOSLIRT-KSSFIOAISA-N 1 3 272.436 3.513 20 0 CHADHO C[C@@H](Oc1ccc([C@H](C)NCCC[NH3+])cc1)c1ccccc1 ZINC000656786902 1118658843 /nfs/dbraw/zinc/65/88/43/1118658843.db2.gz DIZWRXNEPIFMTA-JKSUJKDBSA-N 1 3 298.430 3.826 20 0 CHADHO CC(C)C[C@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000157526368 1118739708 /nfs/dbraw/zinc/73/97/08/1118739708.db2.gz OXWAPCSDTVMNSA-HNNXBMFYSA-N 1 3 266.473 3.808 20 0 CHADHO C[C@H](c1ccccc1Cl)N(C)CC[C@@H]1CCC[NH2+]C1 ZINC000062014444 1118776399 /nfs/dbraw/zinc/77/63/99/1118776399.db2.gz YSPNCVMOIQEYPU-KGLIPLIRSA-N 1 3 280.843 3.723 20 0 CHADHO C1CC([C@@H]2CC[C@H]2[NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000510721261 1118796252 /nfs/dbraw/zinc/79/62/52/1118796252.db2.gz MMFRSVZVDMDRSH-RBUKOAKNSA-N 1 3 290.495 3.952 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCc3cc(F)ccc32)C1 ZINC000341719568 1118814226 /nfs/dbraw/zinc/81/42/26/1118814226.db2.gz CJNHZWPFNRDGFO-LZLYRXPVSA-N 1 3 290.426 3.666 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H]2CC[C@@H](C)[C@@H](C)C2)C1 ZINC000129443702 1118829902 /nfs/dbraw/zinc/82/99/02/1118829902.db2.gz RLIBGGKDCAKCAY-QZWWFDLISA-N 1 3 266.473 3.521 20 0 CHADHO CC[C@@H]1CCCC[C@H]1C[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000401383552 1118902792 /nfs/dbraw/zinc/90/27/92/1118902792.db2.gz IDUPPFQJBMRZAH-BBWFWOEESA-N 1 3 266.473 3.523 20 0 CHADHO CCN1CCC[C@H](C[NH2+]Cc2cc3c(ccc(C)c3C)[nH]2)C1 ZINC000472034544 1118942514 /nfs/dbraw/zinc/94/25/14/1118942514.db2.gz FOLGJPWNVGBWKP-MRXNPFEDSA-N 1 3 299.462 3.606 20 0 CHADHO Cc1ccc2[nH]c(C[NH2+][C@@H]3CCC[C@H](N(C)C)C3)cc2c1C ZINC000472080385 1118960889 /nfs/dbraw/zinc/96/08/89/1118960889.db2.gz OENPAYCVJOSKFE-WBVHZDCISA-N 1 3 299.462 3.747 20 0 CHADHO C[C@H](CC[NH+](C)C)N[C@H]1CCC(C)(C)c2ccccc21 ZINC000049553769 1119104388 /nfs/dbraw/zinc/10/43/88/1119104388.db2.gz FMTBZCRTEUWGHB-PBHICJAKSA-N 1 3 274.452 3.729 20 0 CHADHO C[NH2+]Cc1ccccc1CNCc1ccc(C2CC2)cc1 ZINC000650720725 1119380534 /nfs/dbraw/zinc/38/05/34/1119380534.db2.gz ZNMHIOAYFGJOCL-UHFFFAOYSA-N 1 3 280.415 3.573 20 0 CHADHO Cc1ccccc1[C@@H]1C[C@H]1[NH2+][C@@H]1C[C@@H](N)c2ccccc21 ZINC000650741999 1119397169 /nfs/dbraw/zinc/39/71/69/1119397169.db2.gz PGEZUFZDKFPNNH-WJFTUGDTSA-N 1 3 278.399 3.585 20 0 CHADHO [NH3+]Cc1ccc(CN[C@H]2CCCCc3ccccc32)c(F)c1 ZINC000650753651 1119410645 /nfs/dbraw/zinc/41/06/45/1119410645.db2.gz SCKCRIWEANFEOL-IBGZPJMESA-N 1 3 298.405 3.842 20 0 CHADHO CC[C@@H](NCc1ccccc1C[NH2+]C)c1cccc(F)c1 ZINC000650757411 1119415185 /nfs/dbraw/zinc/41/51/85/1119415185.db2.gz WTGHLPBCHHWAOL-GOSISDBHSA-N 1 3 286.394 3.786 20 0 CHADHO Cc1ccc([C@@H](C)NCCCC[NH+]2CCC(C)CC2)o1 ZINC000158204158 1119436427 /nfs/dbraw/zinc/43/64/27/1119436427.db2.gz MUTGLTVRPIIYOL-MRXNPFEDSA-N 1 3 278.440 3.751 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H](N(C)C)C2)c2ccccc21 ZINC000343593421 1119464341 /nfs/dbraw/zinc/46/43/41/1119464341.db2.gz AWVWCPSNVSOOTD-LLDVTBCESA-N 1 3 272.436 3.697 20 0 CHADHO CC[C@H](N)C[NH2+][C@H](C)c1ccc(OCc2ccccc2)cc1 ZINC000231439062 1119589431 /nfs/dbraw/zinc/58/94/31/1119589431.db2.gz PXFIUZYKQAQFJV-QAPCUYQASA-N 1 3 298.430 3.654 20 0 CHADHO CC1=C[C@H](C)C[C@H](CN2CCC[C@@H]([NH+]3CCCC3)C2)C1 ZINC000685834264 1119853802 /nfs/dbraw/zinc/85/38/02/1119853802.db2.gz BLLABQWKIFXTGD-RYQLBKOJSA-N 1 3 276.468 3.539 20 0 CHADHO CC[C@H]([NH2+]C1CCN(C2CCCCC2)CC1)[C@@H]1C[C@@H]1C ZINC000414092836 1119894703 /nfs/dbraw/zinc/89/47/03/1119894703.db2.gz FJFUOKZEURGFMQ-QGTPRVQTSA-N 1 3 278.484 3.808 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@@H](C)[C@@H]1CC2CCC1CC2 ZINC000381724923 1128885830 /nfs/dbraw/zinc/88/58/30/1128885830.db2.gz RZJDBNVAONZFNH-OTBWCIGPSA-N 1 3 266.473 3.521 20 0 CHADHO CC1(C[NH2+]C2CCN(C3CCCCC3)CC2)CCCC1 ZINC000089555445 1120047104 /nfs/dbraw/zinc/04/71/04/1120047104.db2.gz ICDSQUBJRJUWML-UHFFFAOYSA-N 1 3 278.484 3.953 20 0 CHADHO C[C@H](Cc1ccc(Cl)cc1)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000623657758 1120064897 /nfs/dbraw/zinc/06/48/97/1120064897.db2.gz YGQHFTCKSTXLPU-GDBMZVCRSA-N 1 3 294.870 3.593 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H](N(C)C)C2)CC(C)(C)C1 ZINC000715539245 1120081881 /nfs/dbraw/zinc/08/18/81/1120081881.db2.gz BTYCYBAYJSYXPJ-WCVJEAGWSA-N 1 3 266.473 3.664 20 0 CHADHO CC(C)[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccccc1 ZINC000624121933 1120101118 /nfs/dbraw/zinc/10/11/18/1120101118.db2.gz GGPKTOFOVJGJQC-FUHWJXTLSA-N 1 3 274.452 3.705 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)C1 ZINC000624122680 1120103544 /nfs/dbraw/zinc/10/35/44/1120103544.db2.gz YOEOFPCFBQMMFC-BHIYHBOVSA-N 1 3 286.463 3.644 20 0 CHADHO CC(C)C1CCC([NH2+][C@H]2CCC[C@H](N(C)C)C2)CC1 ZINC000715544788 1120110658 /nfs/dbraw/zinc/11/06/58/1120110658.db2.gz SHHIUQPJYRFDOR-GQGLESIBSA-N 1 3 266.473 3.664 20 0 CHADHO CN(C)[C@H]1CCC[C@@H]([NH2+]C2CCC3(CCCC3)CC2)C1 ZINC000715578308 1120131479 /nfs/dbraw/zinc/13/14/79/1120131479.db2.gz FCWHCYHALBZGCK-SJORKVTESA-N 1 3 278.484 3.952 20 0 CHADHO C[C@@H](CN(C)CC[C@H]1CCCC[N@@H+]1C)c1ccccc1 ZINC000472666158 1120137951 /nfs/dbraw/zinc/13/79/51/1120137951.db2.gz LAEHAJZGBHVBBQ-FUHWJXTLSA-N 1 3 274.452 3.596 20 0 CHADHO C[C@@H](CN(C)CC[C@H]1CCCC[N@H+]1C)c1ccccc1 ZINC000472666158 1120137955 /nfs/dbraw/zinc/13/79/55/1120137955.db2.gz LAEHAJZGBHVBBQ-FUHWJXTLSA-N 1 3 274.452 3.596 20 0 CHADHO Cc1cccc(F)c1CN[C@@H](CCC[NH3+])c1ccccc1 ZINC000925524432 1120281582 /nfs/dbraw/zinc/28/15/82/1120281582.db2.gz TVUPXGKWYHKFCI-SFHVURJKSA-N 1 3 286.394 3.704 20 0 CHADHO N[C@H]1C[C@H]([NH2+]CC2(C(F)(F)F)CCCC2)c2ccccc21 ZINC000629551979 1128915598 /nfs/dbraw/zinc/91/55/98/1128915598.db2.gz ZCALOSOFEMLKPB-KBPBESRZSA-N 1 3 298.352 3.844 20 0 CHADHO CC[NH+]1CCC(N[C@H](C)c2ccc(C3CC3)cc2)CC1 ZINC000417354784 1120434850 /nfs/dbraw/zinc/43/48/50/1120434850.db2.gz MQLAWPJRFCPPNC-CQSZACIVSA-N 1 3 272.436 3.699 20 0 CHADHO CCc1c2ccccc2oc1[C@H](C)[NH2+]CCCN(C)C ZINC000019959026 1120551934 /nfs/dbraw/zinc/55/19/34/1120551934.db2.gz DCWHCJKLLSNLSI-ZDUSSCGKSA-N 1 3 274.408 3.598 20 0 CHADHO CC(C)C[C@H](N[C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(F)cc1 ZINC000652154382 1120792009 /nfs/dbraw/zinc/79/20/09/1120792009.db2.gz DDHAOJHSKNJQGL-WBAXXEDZSA-N 1 3 292.442 3.985 20 0 CHADHO CC(C)C[C@H](N[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(F)cc1 ZINC000652154382 1120792012 /nfs/dbraw/zinc/79/20/12/1120792012.db2.gz DDHAOJHSKNJQGL-WBAXXEDZSA-N 1 3 292.442 3.985 20 0 CHADHO Cc1ccc2[nH]c(C[N@@H+](C)C[C@H]3CCCN(C)C3)cc2c1C ZINC000473142392 1120806487 /nfs/dbraw/zinc/80/64/87/1120806487.db2.gz CFFLRMBWLPHBOG-INIZCTEOSA-N 1 3 299.462 3.558 20 0 CHADHO Cc1ccc2[nH]c(C[N@H+](C)C[C@H]3CCCN(C)C3)cc2c1C ZINC000473142392 1120806489 /nfs/dbraw/zinc/80/64/89/1120806489.db2.gz CFFLRMBWLPHBOG-INIZCTEOSA-N 1 3 299.462 3.558 20 0 CHADHO C[C@@H]([NH3+])[C@@H]1CCCN(Cc2cccc(C(C)(C)C)c2)C1 ZINC000662244489 1120910715 /nfs/dbraw/zinc/91/07/15/1120910715.db2.gz HKODRFHRVGZZLB-GDBMZVCRSA-N 1 3 274.452 3.543 20 0 CHADHO C[C@H]([NH3+])[C@@H]1CCCN(Cc2cccc(C(C)(C)C)c2)C1 ZINC000662244490 1120910830 /nfs/dbraw/zinc/91/08/30/1120910830.db2.gz HKODRFHRVGZZLB-GOEBONIOSA-N 1 3 274.452 3.543 20 0 CHADHO C[C@H]([NH3+])[C@H]1CCCN(Cc2cccc(C(C)(C)C)c2)C1 ZINC000662244491 1120911178 /nfs/dbraw/zinc/91/11/78/1120911178.db2.gz HKODRFHRVGZZLB-HOCLYGCPSA-N 1 3 274.452 3.543 20 0 CHADHO C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663344065 1120940483 /nfs/dbraw/zinc/94/04/83/1120940483.db2.gz NIYAYHBXDBUDFM-DJIMGWMZSA-N 1 3 278.484 3.523 20 0 CHADHO CC1(C)C[C@]1(CN[C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000663368028 1120948039 /nfs/dbraw/zinc/94/80/39/1120948039.db2.gz MSYGIGYMSCAWCH-BJLQDIEVSA-N 1 3 298.474 3.571 20 0 CHADHO CC1(C)C[C@]1(CN[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000663368028 1120948040 /nfs/dbraw/zinc/94/80/40/1120948040.db2.gz MSYGIGYMSCAWCH-BJLQDIEVSA-N 1 3 298.474 3.571 20 0 CHADHO CC[C@H](NCCC[NH+]1CCCC1)c1cccc(C)c1 ZINC000311682084 1120959558 /nfs/dbraw/zinc/95/95/58/1120959558.db2.gz NGMYJMJFENAMDL-KRWDZBQOSA-N 1 3 260.425 3.522 20 0 CHADHO CC[C@H]([NH2+]CCCN1CCCC1)c1cccc(C)c1 ZINC000311682084 1120959561 /nfs/dbraw/zinc/95/95/61/1120959561.db2.gz NGMYJMJFENAMDL-KRWDZBQOSA-N 1 3 260.425 3.522 20 0 CHADHO C([NH2+][C@H]1CCCC[C@@H]1C1CC1)[C@@H]1CCCN(CC2CC2)C1 ZINC000663465114 1120979886 /nfs/dbraw/zinc/97/98/86/1120979886.db2.gz IBISMPHMZSYELW-UHOSZYNNSA-N 1 3 290.495 3.667 20 0 CHADHO CCC(C)(C)[C@H](C)[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000663465530 1120981255 /nfs/dbraw/zinc/98/12/55/1120981255.db2.gz KJHNKASHMWVBFK-GOEBONIOSA-N 1 3 266.473 3.523 20 0 CHADHO CC[C@H]([NH2+]C[C@@H]1CCCN(CC2CC2)C1)C1CCCC1 ZINC000663466627 1120982136 /nfs/dbraw/zinc/98/21/36/1120982136.db2.gz WCTQJMLGVSYBPD-WMZOPIPTSA-N 1 3 278.484 3.667 20 0 CHADHO c1ccc([C@@H](NC[C@@H]2CCC[N@H+](CC3CC3)C2)C2CC2)cc1 ZINC000663467676 1120983911 /nfs/dbraw/zinc/98/39/11/1120983911.db2.gz HCMWFCXJRLIGPC-FXAWDEMLSA-N 1 3 298.474 3.849 20 0 CHADHO c1ccc([C@@H](NC[C@@H]2CCC[N@@H+](CC3CC3)C2)C2CC2)cc1 ZINC000663467676 1120983913 /nfs/dbraw/zinc/98/39/13/1120983913.db2.gz HCMWFCXJRLIGPC-FXAWDEMLSA-N 1 3 298.474 3.849 20 0 CHADHO c1ccc([C@@H]([NH2+]C[C@@H]2CCCN(CC3CC3)C2)C2CC2)cc1 ZINC000663467676 1120983914 /nfs/dbraw/zinc/98/39/14/1120983914.db2.gz HCMWFCXJRLIGPC-FXAWDEMLSA-N 1 3 298.474 3.849 20 0 CHADHO Cc1ccc([C@@H](N[C@H]2CCC[NH2+]CC2)C2CCC2)cc1 ZINC000643523165 1121005285 /nfs/dbraw/zinc/00/52/85/1121005285.db2.gz XAMOLLPCJPBSPJ-ROUUACIJSA-N 1 3 272.436 3.568 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N1CCc2cc(F)ccc2C1 ZINC001167840400 1121048893 /nfs/dbraw/zinc/04/88/93/1121048893.db2.gz GCRSIAPEDSANLF-HNNXBMFYSA-N 1 3 292.442 3.694 20 0 CHADHO c1ccc([C@@H](CC2CCC2)NCCC[NH+]2CCCC2)cc1 ZINC000344088164 1121077444 /nfs/dbraw/zinc/07/74/44/1121077444.db2.gz NSOCWGRFYFQFRE-LJQANCHMSA-N 1 3 286.463 3.993 20 0 CHADHO c1ccc([C@@H](CC2CCC2)[NH2+]CCCN2CCCC2)cc1 ZINC000344088164 1121077451 /nfs/dbraw/zinc/07/74/51/1121077451.db2.gz NSOCWGRFYFQFRE-LJQANCHMSA-N 1 3 286.463 3.993 20 0 CHADHO CCCCN(CCOC(C)C)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001174983586 1121141537 /nfs/dbraw/zinc/14/15/37/1121141537.db2.gz JFTRLKQKYFBEAQ-UHFFFAOYSA-N 1 3 298.515 3.823 20 0 CHADHO CCC(CC)CN1CCC(CC)([NH+]2CCCC2)CC1 ZINC001175156080 1121186919 /nfs/dbraw/zinc/18/69/19/1121186919.db2.gz MHUIDZDWURBBLP-UHFFFAOYSA-N 1 3 266.473 3.763 20 0 CHADHO CC(C)(C)N1CCC([NH2+]Cc2ccc(C3CC3)cc2)CC1 ZINC000094519209 1121209984 /nfs/dbraw/zinc/20/99/84/1121209984.db2.gz CVMKPEQHKAMVPO-UHFFFAOYSA-N 1 3 286.463 3.917 20 0 CHADHO Cc1ccc([C@H](C)C[NH2+]C2CCN(C(C)(C)C)CC2)cc1 ZINC000766096689 1121230738 /nfs/dbraw/zinc/23/07/38/1121230738.db2.gz WZAZUBJRTQYXLV-MRXNPFEDSA-N 1 3 288.479 3.951 20 0 CHADHO c1ccc([C@H](CC2CC2)N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000675751886 1121351639 /nfs/dbraw/zinc/35/16/39/1121351639.db2.gz BMFLZDOJCFBGEN-QRVBRYPASA-N 1 3 284.447 3.744 20 0 CHADHO c1ccc([C@H](CC2CC2)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000675751886 1121351648 /nfs/dbraw/zinc/35/16/48/1121351648.db2.gz BMFLZDOJCFBGEN-QRVBRYPASA-N 1 3 284.447 3.744 20 0 CHADHO C[C@H](CCc1ccccc1)C[N@@H+]1CCC[C@H](N(C)C)CC1 ZINC000432801634 1121367050 /nfs/dbraw/zinc/36/70/50/1121367050.db2.gz XHHUTUPTCRNYSN-MJGOQNOKSA-N 1 3 288.479 3.671 20 0 CHADHO C[C@H](CCc1ccccc1)C[N@H+]1CCC[C@H](N(C)C)CC1 ZINC000432801634 1121367058 /nfs/dbraw/zinc/36/70/58/1121367058.db2.gz XHHUTUPTCRNYSN-MJGOQNOKSA-N 1 3 288.479 3.671 20 0 CHADHO CC[NH+]1CCC(CCN[C@H](C)c2nc(C)sc2C)CC1 ZINC000676493320 1121436273 /nfs/dbraw/zinc/43/62/73/1121436273.db2.gz VSZBPPVNUQFVFW-GFCCVEGCSA-N 1 3 295.496 3.533 20 0 CHADHO C[C@@H]1CCCC[C@@H]1[NH+]1CCC(N[C@@H]2CC23CCCC3)CC1 ZINC000429426372 1121575440 /nfs/dbraw/zinc/57/54/40/1121575440.db2.gz FVIABMUVKVHIHF-BPQIPLTHSA-N 1 3 290.495 3.952 20 0 CHADHO CN1CCC[C@H]1CC[NH2+]C(C1CCCC1)C1CCCC1 ZINC001176364408 1121614893 /nfs/dbraw/zinc/61/48/93/1121614893.db2.gz CRRFAQWBVBSNGG-KRWDZBQOSA-N 1 3 278.484 3.809 20 0 CHADHO C[C@H]([NH2+]CC[C@@H]1CCCN1C)c1ccc(C2CC2)cc1 ZINC000419347663 1121674323 /nfs/dbraw/zinc/67/43/23/1121674323.db2.gz XAYJGVCKIOCMJP-KSSFIOAISA-N 1 3 272.436 3.699 20 0 CHADHO C[C@@H]([NH2+]CC[C@@H]1CCCN1C)c1ccc(C2CC2)cc1 ZINC000419347662 1121674548 /nfs/dbraw/zinc/67/45/48/1121674548.db2.gz XAYJGVCKIOCMJP-KDOFPFPSSA-N 1 3 272.436 3.699 20 0 CHADHO C[C@@H](c1ccc(F)c(F)c1)N1CCC(CC[NH+](C)C)CC1 ZINC000052442311 1121686138 /nfs/dbraw/zinc/68/61/38/1121686138.db2.gz RNHYTCNJDYPXEW-ZDUSSCGKSA-N 1 3 296.405 3.690 20 0 CHADHO CC(C)N1CCC([NH2+]Cc2cc3cc(F)ccc3o2)CC1 ZINC001177157449 1121715878 /nfs/dbraw/zinc/71/58/78/1121715878.db2.gz LKPLJPKKLNMARY-UHFFFAOYSA-N 1 3 290.382 3.534 20 0 CHADHO Cc1cc(C)c(/C=C\CNC2CC[NH+](C3CC3)CC2)cc1C ZINC001177161908 1121716794 /nfs/dbraw/zinc/71/67/94/1121716794.db2.gz GWMDLCYCEJODLB-PLNGDYQASA-N 1 3 298.474 3.841 20 0 CHADHO CC(C)(C)N1CCC([NH2+]C/C=C\c2ccccc2)CC1 ZINC001177338290 1121726054 /nfs/dbraw/zinc/72/60/54/1121726054.db2.gz UVELNACZBQNPLS-YFHOEESVSA-N 1 3 272.436 3.552 20 0 CHADHO CCC1CCC([NH2+]C[C@@H]2CCCN(CC(C)C)C2)CC1 ZINC001178249386 1121772832 /nfs/dbraw/zinc/77/28/32/1121772832.db2.gz OKMDGZFWICSCKP-ADKAHSJRSA-N 1 3 280.500 3.913 20 0 CHADHO CCN(Cc1ccc2ccccc2c1)[C@H]1CCC[NH2+]CC1 ZINC000345181831 1121853566 /nfs/dbraw/zinc/85/35/66/1121853566.db2.gz ROLABSWQMWPHEX-IBGZPJMESA-N 1 3 282.431 3.804 20 0 CHADHO CC(C)C1CCC([NH2+]C[C@@H]2CCCN(CC3CC3)C2)CC1 ZINC001179259133 1121866682 /nfs/dbraw/zinc/86/66/82/1121866682.db2.gz RJPZVXHJQULHLI-VIQWUECVSA-N 1 3 292.511 3.913 20 0 CHADHO CC(C)CCCCN1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC001179924869 1121924346 /nfs/dbraw/zinc/92/43/46/1121924346.db2.gz KQBNWIOJSFRRLE-FUHWJXTLSA-N 1 3 278.484 3.761 20 0 CHADHO CC(C)CCCCN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC001179924869 1121924351 /nfs/dbraw/zinc/92/43/51/1121924351.db2.gz KQBNWIOJSFRRLE-FUHWJXTLSA-N 1 3 278.484 3.761 20 0 CHADHO Cc1ccc(CN2CCC(C[N@@H+](C)C(C)C)CC2)c(F)c1 ZINC001180165791 1121960174 /nfs/dbraw/zinc/96/01/74/1121960174.db2.gz JMDHXTYMEPDFKV-UHFFFAOYSA-N 1 3 292.442 3.686 20 0 CHADHO Cc1ccc(CN2CCC(C[N@H+](C)C(C)C)CC2)c(F)c1 ZINC001180165791 1121960178 /nfs/dbraw/zinc/96/01/78/1121960178.db2.gz JMDHXTYMEPDFKV-UHFFFAOYSA-N 1 3 292.442 3.686 20 0 CHADHO CC(C)[C@@H]1CCC[C@@H]1[NH2+]CC[C@H](C)N1CCCCC1 ZINC001180811142 1122017646 /nfs/dbraw/zinc/01/76/46/1122017646.db2.gz QSBGYEYTBSIGLC-ULQDDVLXSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@H](CC[NH2+][C@@H](C)C1CCCCC1)N1CCCCC1 ZINC001180809260 1122018076 /nfs/dbraw/zinc/01/80/76/1122018076.db2.gz CHLBFDBQGICQBR-CVEARBPZSA-N 1 3 266.473 3.809 20 0 CHADHO C1CC2(C1)CC[C@H]2[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000502475847 1122089766 /nfs/dbraw/zinc/08/97/66/1122089766.db2.gz WWCWIRGQQJCYFT-QGZVFWFLSA-N 1 3 276.468 3.706 20 0 CHADHO Cc1cc([C@@H](C)[NH2+][C@@H](CCN(C)C)C(C)(C)C)oc1C ZINC000502724717 1122144010 /nfs/dbraw/zinc/14/40/10/1122144010.db2.gz FWEIBLAWPPSVOO-CJNGLKHVSA-N 1 3 280.456 3.913 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@H]2C[C@H](C)c3c2cccc3C)C1 ZINC000504895197 1122309902 /nfs/dbraw/zinc/30/99/02/1122309902.db2.gz RMHDKDKTGVHYFW-JZXOWHBKSA-N 1 3 286.463 3.865 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@H]2C[C@H](C)c3c2cccc3C)C1 ZINC000504895197 1122309907 /nfs/dbraw/zinc/30/99/07/1122309907.db2.gz RMHDKDKTGVHYFW-JZXOWHBKSA-N 1 3 286.463 3.865 20 0 CHADHO CC[C@H](C)[C@@H](C)[N@@H+]1CCC[C@@H](CN2CCC(C)CC2)C1 ZINC001190652315 1122550386 /nfs/dbraw/zinc/55/03/86/1122550386.db2.gz ZOHACQNJSADUPV-KSZLIROESA-N 1 3 280.500 3.865 20 0 CHADHO CCN(CC)C[C@H]1CC[N@H+](C[C@H](C)C2CCCCC2)C1 ZINC001191260068 1122585811 /nfs/dbraw/zinc/58/58/11/1122585811.db2.gz ZCZAUMDDVDZVOI-DLBZAZTESA-N 1 3 280.500 3.867 20 0 CHADHO CCN(CC)C[C@H]1CC[N@@H+](C[C@H](C)C2CCCCC2)C1 ZINC001191260068 1122585815 /nfs/dbraw/zinc/58/58/15/1122585815.db2.gz ZCZAUMDDVDZVOI-DLBZAZTESA-N 1 3 280.500 3.867 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCC[C@@H]1c1ccc(Cl)cc1)CN(C)C ZINC000425934388 1122662923 /nfs/dbraw/zinc/66/29/23/1122662923.db2.gz BPAURFKPEGPPRV-KBRIMQKVSA-N 1 3 294.870 3.763 20 0 CHADHO C[C@@H](C[NH2+][C@H](c1ccccc1)C1CCCC1)CN(C)C ZINC000425932359 1122663852 /nfs/dbraw/zinc/66/38/52/1122663852.db2.gz PVMUJPBXFBGCEG-MAUKXSAKSA-N 1 3 274.452 3.705 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)[C@@H](C)c1ccc(Cl)cc1)CN(C)C ZINC000425938111 1122668563 /nfs/dbraw/zinc/66/85/63/1122668563.db2.gz VTLGQPCNAVCFJA-MCIONIFRSA-N 1 3 282.859 3.619 20 0 CHADHO CC(C)[C@@H](CSc1ccccc1)[NH2+]C[C@H](C)CN(C)C ZINC000425938313 1122668990 /nfs/dbraw/zinc/66/89/90/1122668990.db2.gz WUYLPMMWBPXAGE-DOTOQJQBSA-N 1 3 294.508 3.591 20 0 CHADHO Cc1ccc([C@@H]([NH2+]C[C@@H](C)CN(C)C)C2CCC2)cc1 ZINC000425940828 1122671558 /nfs/dbraw/zinc/67/15/58/1122671558.db2.gz AWNFZTWCLISYNU-QAPCUYQASA-N 1 3 274.452 3.624 20 0 CHADHO CC[NH+]1CCC(CCNCc2ccc(Cl)cc2F)CC1 ZINC000438193447 1122686110 /nfs/dbraw/zinc/68/61/10/1122686110.db2.gz VFJRCUHZALZYKF-UHFFFAOYSA-N 1 3 298.833 3.691 20 0 CHADHO CC1(C)CCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167969801 1122860770 /nfs/dbraw/zinc/86/07/70/1122860770.db2.gz DTXSSDDMJHYAOL-NPYXIHBLSA-N 1 3 276.468 3.560 20 0 CHADHO CC[C@H]([NH2+]CC[C@H]1CCCN1C)c1cc(C)ccc1C ZINC001196944216 1122940922 /nfs/dbraw/zinc/94/09/22/1122940922.db2.gz UHOSXHKWNRHMFV-AEFFLSMTSA-N 1 3 274.452 3.828 20 0 CHADHO CC[C@H](NCC[C@H]1CCC[N@@H+]1C)c1cc(C)ccc1C ZINC001196944216 1122940924 /nfs/dbraw/zinc/94/09/24/1122940924.db2.gz UHOSXHKWNRHMFV-AEFFLSMTSA-N 1 3 274.452 3.828 20 0 CHADHO CC[C@H](NCC[C@H]1CCC[N@H+]1C)c1cc(C)ccc1C ZINC001196944216 1122940927 /nfs/dbraw/zinc/94/09/27/1122940927.db2.gz UHOSXHKWNRHMFV-AEFFLSMTSA-N 1 3 274.452 3.828 20 0 CHADHO C[C@]1(F)CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001167985074 1122945267 /nfs/dbraw/zinc/94/52/67/1122945267.db2.gz UKLBPGWGWTWFDW-WFFDWFOESA-N 1 3 294.458 3.606 20 0 CHADHO C[C@]1(F)CCC[N@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)CC1 ZINC001167985074 1122945269 /nfs/dbraw/zinc/94/52/69/1122945269.db2.gz UKLBPGWGWTWFDW-WFFDWFOESA-N 1 3 294.458 3.606 20 0 CHADHO CC(C)[NH+]1CCC(N(C)CCc2ccccc2Cl)CC1 ZINC000507345648 1122949217 /nfs/dbraw/zinc/94/92/17/1122949217.db2.gz CUDZVOZJCSAVKW-UHFFFAOYSA-N 1 3 294.870 3.687 20 0 CHADHO c1cc(C2CC2)c(C2CC2)cc1CNCC[NH+]1CCCC1 ZINC001198991279 1123018368 /nfs/dbraw/zinc/01/83/68/1123018368.db2.gz OIVNVIRTCFNSDR-UHFFFAOYSA-N 1 3 284.447 3.627 20 0 CHADHO CC1=CCC[C@@H](C)[C@@H]1C[NH2+]CCCN1CCC(C)CC1 ZINC001199012818 1123018475 /nfs/dbraw/zinc/01/84/75/1123018475.db2.gz GLZKLCPNQVNDLO-QZTJIDSGSA-N 1 3 278.484 3.690 20 0 CHADHO CC[C@H](F)CN1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000440715868 1123034413 /nfs/dbraw/zinc/03/44/13/1123034413.db2.gz RFGKKDFITVHXOA-SFHVURJKSA-N 1 3 292.442 3.579 20 0 CHADHO CC[C@H](F)CN1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000440715868 1123034408 /nfs/dbraw/zinc/03/44/08/1123034408.db2.gz RFGKKDFITVHXOA-SFHVURJKSA-N 1 3 292.442 3.579 20 0 CHADHO C[C@H]1[C@H](C[NH3+])CCCN1Cc1ccc(C2CCC2)cc1 ZINC001205915235 1123083188 /nfs/dbraw/zinc/08/31/88/1123083188.db2.gz OXIFHRMDRZMHKQ-KSSFIOAISA-N 1 3 272.436 3.513 20 0 CHADHO CC[C@@H](C)C[N@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001201521628 1123121495 /nfs/dbraw/zinc/12/14/95/1123121495.db2.gz WNVNEOPSJLVIRH-OAHLLOKOSA-N 1 3 266.473 3.761 20 0 CHADHO CC[C@@H](C)C[N@@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001201521628 1123121497 /nfs/dbraw/zinc/12/14/97/1123121497.db2.gz WNVNEOPSJLVIRH-OAHLLOKOSA-N 1 3 266.473 3.761 20 0 CHADHO CCCC[C@@H](CC)C[NH+]1CCC(N(C)C2CC2)CC1 ZINC001201567613 1123125836 /nfs/dbraw/zinc/12/58/36/1123125836.db2.gz GICYEXHGBHWZMS-OAHLLOKOSA-N 1 3 266.473 3.761 20 0 CHADHO CCCC[C@@H](CC)CN1CCC([N@H+](C)C2CC2)CC1 ZINC001201567613 1123125837 /nfs/dbraw/zinc/12/58/37/1123125837.db2.gz GICYEXHGBHWZMS-OAHLLOKOSA-N 1 3 266.473 3.761 20 0 CHADHO CCCC[C@@H](CC)CN1CCC([N@@H+](C)C2CC2)CC1 ZINC001201567613 1123125839 /nfs/dbraw/zinc/12/58/39/1123125839.db2.gz GICYEXHGBHWZMS-OAHLLOKOSA-N 1 3 266.473 3.761 20 0 CHADHO C[C@@H](CC[NH2+][C@H]1CC[C@@H](C)[C@@H](C)C1)N1CCCCC1 ZINC001201954000 1123162645 /nfs/dbraw/zinc/16/26/45/1123162645.db2.gz CTLCLIPLHKTQJU-QZWWFDLISA-N 1 3 266.473 3.665 20 0 CHADHO C[C@H]1CCC[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000152427756 1123216969 /nfs/dbraw/zinc/21/69/69/1123216969.db2.gz PDEAFKUNOWOAKZ-WMLDXEAASA-N 1 3 264.457 3.562 20 0 CHADHO C[C@H]([NH2+]CC1(N)CCCC1)c1cc2ccccc2s1 ZINC000665247857 1123257352 /nfs/dbraw/zinc/25/73/52/1123257352.db2.gz KYERZRPBAXDIRE-LBPRGKRZSA-N 1 3 274.433 3.823 20 0 CHADHO C[C@H]([NH2+]CC1(N)CCCC1)c1ccc2ccccc2c1 ZINC000665249911 1123262950 /nfs/dbraw/zinc/26/29/50/1123262950.db2.gz AYLUQGUAWZSQHG-AWEZNQCLSA-N 1 3 268.404 3.762 20 0 CHADHO C[C@H]1CCCCN1CCC[NH2+][C@H]1CCC12CCCC2 ZINC000474031308 1123304062 /nfs/dbraw/zinc/30/40/62/1123304062.db2.gz IHHLPERERZQQID-HOTGVXAUSA-N 1 3 264.457 3.563 20 0 CHADHO CCSc1ccc([C@H](C)NCC[C@@H]([NH3+])C(C)C)cc1 ZINC000665280793 1123312564 /nfs/dbraw/zinc/31/25/64/1123312564.db2.gz LUIOIJNACBRVQZ-XJKSGUPXSA-N 1 3 280.481 3.823 20 0 CHADHO CC[C@@H](NCC[C@@H]([NH3+])C(C)C)c1ccc(Cl)s1 ZINC000665281242 1123313555 /nfs/dbraw/zinc/31/35/55/1123313555.db2.gz YECMMNIEMNGEBD-GHMZBOCLSA-N 1 3 274.861 3.816 20 0 CHADHO C[C@@H](CSC(C)(C)C)[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000853239641 1123428893 /nfs/dbraw/zinc/42/88/93/1123428893.db2.gz ITIVZORDYWKPIR-GOEBONIOSA-N 1 3 298.540 3.618 20 0 CHADHO CCCCC[C@@H](C)[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000853240654 1123429010 /nfs/dbraw/zinc/42/90/10/1123429010.db2.gz QEEPQUVBPBXUOU-WBVHZDCISA-N 1 3 266.473 3.667 20 0 CHADHO C[C@@H](CSC(C)(C)C)[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000853239645 1123429111 /nfs/dbraw/zinc/42/91/11/1123429111.db2.gz ITIVZORDYWKPIR-HOCLYGCPSA-N 1 3 298.540 3.618 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@H](C)C1CCC(F)(F)CC1 ZINC000353241780 1123442608 /nfs/dbraw/zinc/44/26/08/1123442608.db2.gz GKQYGOPEDFKCMZ-CYBMUJFWSA-N 1 3 276.415 3.520 20 0 CHADHO CCC(CC)(CC)C[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000395171168 1123465206 /nfs/dbraw/zinc/46/52/06/1123465206.db2.gz CZSDOWFGPNNUEU-HNNXBMFYSA-N 1 3 254.462 3.523 20 0 CHADHO CC(C)=CCN(C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000114480775 1123488182 /nfs/dbraw/zinc/48/81/82/1123488182.db2.gz ALOSEUOFLSDZLU-UHFFFAOYSA-N 1 3 272.436 3.549 20 0 CHADHO C[NH+](C)CC[C@@H](N[C@@H]1CCc2c1cccc2F)C(C)(C)C ZINC000474934521 1123615638 /nfs/dbraw/zinc/61/56/38/1123615638.db2.gz QNNJHSLNGMHHRX-IAGOWNOFSA-N 1 3 292.442 3.769 20 0 CHADHO C[NH2+]C[C@@H]1CCCN(Cc2c(C)c(C)c(C)c(C)c2C)C1 ZINC001205009281 1123647381 /nfs/dbraw/zinc/64/73/81/1123647381.db2.gz MEYFBRFUHIIYMF-SFHVURJKSA-N 1 3 288.479 3.660 20 0 CHADHO Cc1cc(F)ccc1[C@H](C)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000858491628 1123657626 /nfs/dbraw/zinc/65/76/26/1123657626.db2.gz MDBWVIAOXBTRCG-GJZGRUSLSA-N 1 3 278.415 3.517 20 0 CHADHO C[C@@H]([NH3+])[C@@H]1CCN(Cc2cc(-c3ccccc3)cs2)C1 ZINC000346650554 1123701172 /nfs/dbraw/zinc/70/11/72/1123701172.db2.gz PQBKCOCVGWCLMW-UKRRQHHQSA-N 1 3 286.444 3.584 20 0 CHADHO [NH3+][C@@H]1CC[C@H]2CN(Cc3cc(-c4ccccc4)cs3)C[C@H]12 ZINC000346826977 1123724012 /nfs/dbraw/zinc/72/40/12/1123724012.db2.gz FMBMURKANLASKO-JCGIZDLHSA-N 1 3 298.455 3.584 20 0 CHADHO [NH3+][C@@H]1CC[C@@H]2CN(Cc3cc(-c4ccccc4)cs3)C[C@H]12 ZINC000346826973 1123724283 /nfs/dbraw/zinc/72/42/83/1123724283.db2.gz FMBMURKANLASKO-FHLIZLRMSA-N 1 3 298.455 3.584 20 0 CHADHO CCC[N@H+](Cc1c(C)oc2ccccc21)C1CCNCC1 ZINC000347015683 1123742073 /nfs/dbraw/zinc/74/20/73/1123742073.db2.gz YTKBWZQWPIYOGA-UHFFFAOYSA-N 1 3 286.419 3.705 20 0 CHADHO CCC[N@@H+](Cc1c(C)oc2ccccc21)C1CCNCC1 ZINC000347015683 1123742077 /nfs/dbraw/zinc/74/20/77/1123742077.db2.gz YTKBWZQWPIYOGA-UHFFFAOYSA-N 1 3 286.419 3.705 20 0 CHADHO CCCN(Cc1c(C)oc2ccccc21)C1CC[NH2+]CC1 ZINC000347015683 1123742080 /nfs/dbraw/zinc/74/20/80/1123742080.db2.gz YTKBWZQWPIYOGA-UHFFFAOYSA-N 1 3 286.419 3.705 20 0 CHADHO CC[C@@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccc(Cl)s1 ZINC000158244057 1129142167 /nfs/dbraw/zinc/14/21/67/1129142167.db2.gz MVMOLLFHIYSQQX-NWDGAFQWSA-N 1 3 286.872 3.784 20 0 CHADHO CC[C@@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccc(Cl)s1 ZINC000158244057 1129142169 /nfs/dbraw/zinc/14/21/69/1129142169.db2.gz MVMOLLFHIYSQQX-NWDGAFQWSA-N 1 3 286.872 3.784 20 0 CHADHO Cc1ccsc1[C@@H](C)[NH2+]CC[C@H](C)N1CCCCC1 ZINC000544374998 1123747480 /nfs/dbraw/zinc/74/74/80/1123747480.db2.gz JOYGFELKENUZIE-LSDHHAIUSA-N 1 3 280.481 3.972 20 0 CHADHO CCc1ccc([C@@H](C)NC2CC[NH+](C(C)C)CC2)s1 ZINC000042290396 1123782926 /nfs/dbraw/zinc/78/29/26/1123782926.db2.gz KHWWLYYQSXTRRC-CYBMUJFWSA-N 1 3 280.481 3.834 20 0 CHADHO c1ccc([C@@H]2CCC[C@@H]([NH2+][C@@H]3CCNC34CCC4)C2)cc1 ZINC000863543351 1123875854 /nfs/dbraw/zinc/87/58/54/1123875854.db2.gz YKQIDYRPBLJYHX-KZNAEPCWSA-N 1 3 284.447 3.587 20 0 CHADHO c1ccc([C@@H]2CCC[C@@H]([NH2+][C@H]3CCNC34CCC4)C2)cc1 ZINC000863543349 1123875924 /nfs/dbraw/zinc/87/59/24/1123875924.db2.gz YKQIDYRPBLJYHX-KURKYZTESA-N 1 3 284.447 3.587 20 0 CHADHO Cc1ccc2c(c1)[C@H](NCC(C)(C)C[NH+](C)C)CCC2 ZINC000339066111 1123918456 /nfs/dbraw/zinc/91/84/56/1123918456.db2.gz BISXQEFKWGURJA-QGZVFWFLSA-N 1 3 274.452 3.550 20 0 CHADHO Cc1cc(NC[C@@H](c2ccco2)N2CCCCC2)cc[nH+]1 ZINC000302211731 1123961527 /nfs/dbraw/zinc/96/15/27/1123961527.db2.gz DOGBAYAJOMCILL-INIZCTEOSA-N 1 3 285.391 3.622 20 0 CHADHO CC(C)c1ccc(C[NH2+]C2CC(N3CCCCC3)C2)cc1 ZINC000475578726 1124017914 /nfs/dbraw/zinc/01/79/14/1124017914.db2.gz CFSCCUHEJQIMKP-UHFFFAOYSA-N 1 3 286.463 3.917 20 0 CHADHO COc1ccc([C@@H](C)[N@@H+](C)CCCN2CCCCC2)cc1 ZINC000444574466 1124043148 /nfs/dbraw/zinc/04/31/48/1124043148.db2.gz QFAQNNJDKMRTNH-MRXNPFEDSA-N 1 3 290.451 3.564 20 0 CHADHO COc1ccc([C@@H](C)[N@H+](C)CCCN2CCCCC2)cc1 ZINC000444574466 1124043144 /nfs/dbraw/zinc/04/31/44/1124043144.db2.gz QFAQNNJDKMRTNH-MRXNPFEDSA-N 1 3 290.451 3.564 20 0 CHADHO CS[C@H]1C[C@H](NC2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)C1 ZINC000866486435 1124072112 /nfs/dbraw/zinc/07/21/12/1124072112.db2.gz HMWSULICPMXXES-DZUCGIPZSA-N 1 3 296.524 3.513 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)CCc2ccc(Cl)cc2)C[C@@H]1C ZINC000445209751 1124076615 /nfs/dbraw/zinc/07/66/15/1124076615.db2.gz HADYZFVIYSCSPC-WMLDXEAASA-N 1 3 294.870 3.687 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)CCc2ccc(Cl)cc2)C[C@@H]1C ZINC000445209751 1124076620 /nfs/dbraw/zinc/07/66/20/1124076620.db2.gz HADYZFVIYSCSPC-WMLDXEAASA-N 1 3 294.870 3.687 20 0 CHADHO CN1CCC[C@@H](C[N@H+](C)C/C=C\c2ccc(Cl)cc2)C1 ZINC000508568621 1124115597 /nfs/dbraw/zinc/11/55/97/1124115597.db2.gz KWFHHMHNTFYKSM-IMMZDGJCSA-N 1 3 292.854 3.627 20 0 CHADHO CN1CCC[C@@H](C[N@@H+](C)C/C=C\c2ccc(Cl)cc2)C1 ZINC000508568621 1124115598 /nfs/dbraw/zinc/11/55/98/1124115598.db2.gz KWFHHMHNTFYKSM-IMMZDGJCSA-N 1 3 292.854 3.627 20 0 CHADHO CC[C@H](NCc1cccc2c1CC[NH2+]C2)c1cccc(F)c1 ZINC000635007584 1129169191 /nfs/dbraw/zinc/16/91/91/1129169191.db2.gz DUVRQPMDZLOBRU-IBGZPJMESA-N 1 3 298.405 3.712 20 0 CHADHO CC(C)[C@H]1C[C@@H](N[C@@H]2CC[N@H+](C)[C@H](C)C2)c2ccccc21 ZINC000448026528 1124555581 /nfs/dbraw/zinc/55/55/81/1124555581.db2.gz INWLQYCGDSGEMI-OHDICMOHSA-N 1 3 286.463 3.943 20 0 CHADHO CC(C)[C@H]1C[C@@H](N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c2ccccc21 ZINC000448026528 1124555585 /nfs/dbraw/zinc/55/55/85/1124555585.db2.gz INWLQYCGDSGEMI-OHDICMOHSA-N 1 3 286.463 3.943 20 0 CHADHO CC[C@H](CCC(F)(F)F)[NH2+][C@H]1CCC[C@H](N(C)C)C1 ZINC000872041582 1124664486 /nfs/dbraw/zinc/66/44/86/1124664486.db2.gz UPYOHMHIBMQPIZ-AGIUHOORSA-N 1 3 280.378 3.570 20 0 CHADHO Fc1ccc(C2=CCC[NH2+]CC2)cc1CN1CCCCC1 ZINC001238950546 1131276244 /nfs/dbraw/zinc/27/62/44/1131276244.db2.gz PJRWRDCORLRFMN-UHFFFAOYSA-N 1 3 288.410 3.578 20 0 CHADHO CC[C@@H](N[C@@H](C)c1cccc(C[NH+](C)C)c1)c1ccncc1 ZINC000820811132 1131302363 /nfs/dbraw/zinc/30/23/63/1131302363.db2.gz LHKOVTROXHGGQJ-HNAYVOBHSA-N 1 3 297.446 3.945 20 0 CHADHO CCC[NH+]1CCC(N(C)C[C@@H]2CCCCC2(F)F)CC1 ZINC000450467949 1125037627 /nfs/dbraw/zinc/03/76/27/1125037627.db2.gz MQTRHCVOZAYFLC-AWEZNQCLSA-N 1 3 288.426 3.618 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)Cc2c(C)cccc2C)C[C@@H]1C ZINC000530663049 1125169920 /nfs/dbraw/zinc/16/99/20/1125169920.db2.gz CLUQXIPNNIGNLN-IRXDYDNUSA-N 1 3 274.452 3.608 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)Cc2c(C)cccc2C)C[C@@H]1C ZINC000530663049 1125169921 /nfs/dbraw/zinc/16/99/21/1125169921.db2.gz CLUQXIPNNIGNLN-IRXDYDNUSA-N 1 3 274.452 3.608 20 0 CHADHO CC(C)CC[NH+]1CCC(CNCc2ccc(Cl)o2)CC1 ZINC000530953035 1125189569 /nfs/dbraw/zinc/18/95/69/1125189569.db2.gz ZRCVNXRMLFIOGA-UHFFFAOYSA-N 1 3 298.858 3.781 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CC[C@H](C)[C@H](C)C1)CN1CCCCC1 ZINC000251554270 1125196893 /nfs/dbraw/zinc/19/68/93/1125196893.db2.gz BCUSXYCZYGAUMO-YYIAUSFCSA-N 1 3 266.473 3.523 20 0 CHADHO CS[C@@H]1CC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000128318313 1125260824 /nfs/dbraw/zinc/26/08/24/1125260824.db2.gz DCOOWLLGANNVFI-DOTOQJQBSA-N 1 3 296.524 3.657 20 0 CHADHO C[C@H]1CC([NH2+]C2CCC3(CCCC3)CC2)C[C@H](C)N1 ZINC001246128776 1131343553 /nfs/dbraw/zinc/34/35/53/1131343553.db2.gz NLQACJHKMNMQSK-KBPBESRZSA-N 1 3 264.457 3.608 20 0 CHADHO CS[C@H]1CCC[C@H]([NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000129378913 1125331268 /nfs/dbraw/zinc/33/12/68/1125331268.db2.gz HDUMDHBBEKLAFB-RDJZCZTQSA-N 1 3 296.524 3.657 20 0 CHADHO CC[NH2+]Cc1cccc(Nc2ccc3nc(C)[nH]c3c2)c1 ZINC001159956921 1131350517 /nfs/dbraw/zinc/35/05/17/1131350517.db2.gz WYOWHPVSPBXEEO-UHFFFAOYSA-N 1 3 280.375 3.724 20 0 CHADHO CC1CCC([NH2+]C2CC(C)(C)N(C)C(C)(C)C2)CC1 ZINC001168203236 1125410656 /nfs/dbraw/zinc/41/06/56/1125410656.db2.gz JOKMSKCBEQGRNO-UHFFFAOYSA-N 1 3 266.473 3.806 20 0 CHADHO C[C@H](CN)C[N@H+](Cc1ccccc1)C1CCC(C)CC1 ZINC001168204273 1125410817 /nfs/dbraw/zinc/41/08/17/1125410817.db2.gz HIXZHYFWOQPHBR-UPTPFMHGSA-N 1 3 274.452 3.662 20 0 CHADHO C[C@H](CN)C[N@@H+](Cc1ccccc1)C1CCC(C)CC1 ZINC001168204273 1125410821 /nfs/dbraw/zinc/41/08/21/1125410821.db2.gz HIXZHYFWOQPHBR-UPTPFMHGSA-N 1 3 274.452 3.662 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H]2CCCc3sccc32)C1 ZINC000125908175 1125452503 /nfs/dbraw/zinc/45/25/03/1125452503.db2.gz XAQJGFMVIOQQDU-GOEBONIOSA-N 1 3 292.492 3.836 20 0 CHADHO C[C@@H]1CCCC[N@@H+]1CCC1CCN(Cc2ccoc2)CC1 ZINC000093844578 1129428545 /nfs/dbraw/zinc/42/85/45/1129428545.db2.gz QEIUOKSAWYUGNI-MRXNPFEDSA-N 1 3 290.451 3.756 20 0 CHADHO C[C@@H]1CCCC[N@H+]1CCC1CCN(Cc2ccoc2)CC1 ZINC000093844578 1129428547 /nfs/dbraw/zinc/42/85/47/1129428547.db2.gz QEIUOKSAWYUGNI-MRXNPFEDSA-N 1 3 290.451 3.756 20 0 CHADHO CC[C@@H](NC[C@H]1CCC[NH2+]C1)c1cccc2ccccc21 ZINC000643500812 1129443179 /nfs/dbraw/zinc/44/31/79/1129443179.db2.gz UYQOEEDIHDDYLS-HNAYVOBHSA-N 1 3 282.431 3.880 20 0 CHADHO C[C@@H](N[C@H]1CC12CC[NH2+]CC2)c1cccc(Cl)c1Cl ZINC000643533727 1129444422 /nfs/dbraw/zinc/44/44/22/1129444422.db2.gz CHCQZFIMSJLCCC-MFKMUULPSA-N 1 3 299.245 3.786 20 0 CHADHO CC1(C)[C@H]([NH2+][C@@H]2CCNC3(CCC3)C2)C[C@H]1c1ccccc1 ZINC000643547210 1129445040 /nfs/dbraw/zinc/44/50/40/1129445040.db2.gz BIBLCJNFWUCJID-FGTMMUONSA-N 1 3 298.474 3.833 20 0 CHADHO C[C@H]([NH2+][C@H]1CCNC2(CCC2)C1)C1CCCCCC1 ZINC000643547454 1129445237 /nfs/dbraw/zinc/44/52/37/1129445237.db2.gz FSQJKSPFZKHXTH-HOCLYGCPSA-N 1 3 264.457 3.610 20 0 CHADHO CCCC1CCC([NH+]2C[C@H]3CN(CCC)C[C@@H]3C2)CC1 ZINC001258534667 1129449681 /nfs/dbraw/zinc/44/96/81/1129449681.db2.gz NKZHSRBJLMBXNZ-QLOLRVAOSA-N 1 3 278.484 3.619 20 0 CHADHO Clc1ccsc1CN1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647543551 1129580764 /nfs/dbraw/zinc/58/07/64/1129580764.db2.gz PESWSYCDRSRJNB-QWHCGFSZSA-N 1 3 298.883 3.613 20 0 CHADHO Clc1cscc1CN1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647544374 1129581097 /nfs/dbraw/zinc/58/10/97/1129581097.db2.gz ZOOAHPGAYKYUHG-QWHCGFSZSA-N 1 3 298.883 3.613 20 0 CHADHO CCN(CC)[C@H](CNc1[nH+]ccc2[nH]ccc21)c1ccco1 ZINC000647860881 1129586195 /nfs/dbraw/zinc/58/61/95/1129586195.db2.gz CUQXUSTYILMOBH-OAHLLOKOSA-N 1 3 298.390 3.651 20 0 CHADHO C[C@@H](c1cc(F)ccc1F)N(C)CCCC1CC[NH2+]CC1 ZINC000647875687 1129586980 /nfs/dbraw/zinc/58/69/80/1129586980.db2.gz HTEGNRFRWGJWOT-ZDUSSCGKSA-N 1 3 296.405 3.737 20 0 CHADHO CCC(CC)(NC[C@@H]1CC[NH2+]C1)c1ccc(Cl)cc1 ZINC000647892325 1129587064 /nfs/dbraw/zinc/58/70/64/1129587064.db2.gz VCRMJKWAPCETTN-CYBMUJFWSA-N 1 3 280.843 3.554 20 0 CHADHO C[C@H](c1ccc(C(C)(C)C)cc1)N1CCC(C)([NH3+])CC1 ZINC000647924717 1129588204 /nfs/dbraw/zinc/58/82/04/1129588204.db2.gz FJRMXEZQZXYLHW-CQSZACIVSA-N 1 3 274.452 3.858 20 0 CHADHO CC[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(C)cc1 ZINC001169099325 1129696247 /nfs/dbraw/zinc/69/62/47/1129696247.db2.gz PTUGUJFWLZWPPQ-ZJPYXAASSA-N 1 3 272.436 3.661 20 0 CHADHO CC[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(C)cc1 ZINC001169099325 1129696248 /nfs/dbraw/zinc/69/62/48/1129696248.db2.gz PTUGUJFWLZWPPQ-ZJPYXAASSA-N 1 3 272.436 3.661 20 0 CHADHO CC(C)[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001169101270 1129697303 /nfs/dbraw/zinc/69/73/03/1129697303.db2.gz QEOAHCNKLZYPHX-MHORFTMASA-N 1 3 290.426 3.738 20 0 CHADHO CC(C)[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001169101270 1129697306 /nfs/dbraw/zinc/69/73/06/1129697306.db2.gz QEOAHCNKLZYPHX-MHORFTMASA-N 1 3 290.426 3.738 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](N[C@@H](CC1CC1)c1ccccc1)C2 ZINC001169116330 1129700170 /nfs/dbraw/zinc/70/01/70/1129700170.db2.gz PXQNNQZVWLOROW-RDGPPVDQSA-N 1 3 284.447 3.743 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](N[C@@H](CC1CC1)c1ccccc1)C2 ZINC001169116330 1129700172 /nfs/dbraw/zinc/70/01/72/1129700172.db2.gz PXQNNQZVWLOROW-RDGPPVDQSA-N 1 3 284.447 3.743 20 0 CHADHO CC[NH+]1CCC(N[C@@H](c2cccc(F)c2)C2CCC2)CC1 ZINC001169230344 1129710690 /nfs/dbraw/zinc/71/06/90/1129710690.db2.gz YRVKZSDTUIVDFF-GOSISDBHSA-N 1 3 290.426 3.741 20 0 CHADHO CC[NH+]1CCC(NC2(c3cccc4ccccc43)CC2)CC1 ZINC001169238494 1129712389 /nfs/dbraw/zinc/71/23/89/1129712389.db2.gz IMBBISLAXGNIPN-UHFFFAOYSA-N 1 3 294.442 3.903 20 0 CHADHO C[C@@H](NCCC1(C[NH3+])CC1)c1cc(Cl)sc1Cl ZINC000650743198 1129720507 /nfs/dbraw/zinc/72/05/07/1129720507.db2.gz OHANSQPPAZPQQZ-MRVPVSSYSA-N 1 3 293.263 3.835 20 0 CHADHO C[NH2+]Cc1ccccc1CNCc1ccc(Cl)c(C)c1 ZINC000650719132 1129720529 /nfs/dbraw/zinc/72/05/29/1129720529.db2.gz FANZJKVUKMGVFQ-UHFFFAOYSA-N 1 3 288.822 3.658 20 0 CHADHO Cc1ccc2c(c1)[C@@H](NCc1ccc(C[NH3+])cc1F)[C@H](C)C2 ZINC000650754438 1129721289 /nfs/dbraw/zinc/72/12/89/1129721289.db2.gz JAPLKQFEGKBLCS-YJYMSZOUSA-N 1 3 298.405 3.616 20 0 CHADHO c1ccc([C@H]2C[C@H](NC3C[C@H]4CC[C@@H](C3)[N@H+]4C3CC3)C2)cc1 ZINC000903168675 1130122993 /nfs/dbraw/zinc/12/29/93/1130122993.db2.gz ZTADDVZXFQVJFX-FCZZKEPISA-N 1 3 296.458 3.680 20 0 CHADHO c1ccc([C@H]2C[C@H](NC3C[C@H]4CC[C@@H](C3)[N@@H+]4C3CC3)C2)cc1 ZINC000903168675 1130122997 /nfs/dbraw/zinc/12/29/97/1130122997.db2.gz ZTADDVZXFQVJFX-FCZZKEPISA-N 1 3 296.458 3.680 20 0 CHADHO CCC[C@@H](N[C@H](CC[NH+](C)C)c1cccnc1)C1CCC1 ZINC000903376233 1130168224 /nfs/dbraw/zinc/16/82/24/1130168224.db2.gz BUTILFIIIAPDOY-QZTJIDSGSA-N 1 3 289.467 3.633 20 0 CHADHO CCC(CC)[C@H](NC[C@@H]([NH3+])CC(F)F)c1ccccc1 ZINC000903925601 1130210141 /nfs/dbraw/zinc/21/01/41/1130210141.db2.gz OUMFWYGWWBMGID-HOCLYGCPSA-N 1 3 284.394 3.736 20 0 CHADHO C[C@@H]1CC[C@@H]([NH2+]C2CCN(C[C@H]3CC=CCC3)CC2)C1 ZINC001170124245 1130285187 /nfs/dbraw/zinc/28/51/87/1130285187.db2.gz FXFGWVXYBMXEJQ-SOLBZPMBSA-N 1 3 276.468 3.585 20 0 CHADHO Cc1ccc([C@H](C)NCc2cccc(C[NH+](C)C)c2)c(C)n1 ZINC000678411387 1130412011 /nfs/dbraw/zinc/41/20/11/1130412011.db2.gz LJCUSKZBXWLHFZ-HNNXBMFYSA-N 1 3 297.446 3.611 20 0 CHADHO Cc1ccc(-c2ccccc2CN2CCC([NH3+])CC2)cc1C ZINC001240701597 1130425962 /nfs/dbraw/zinc/42/59/62/1130425962.db2.gz BGROXEZWTCPYJI-UHFFFAOYSA-N 1 3 294.442 3.894 20 0 CHADHO C[C@H]1CC[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000747100245 1130517927 /nfs/dbraw/zinc/51/79/27/1130517927.db2.gz GOLGBLFDMXMCSM-GOEBONIOSA-N 1 3 264.457 3.562 20 0 CHADHO C[C@H]([NH2+]CC1CCCCC1)[C@H]1CCCN(C2CCC2)C1 ZINC000679740030 1130554302 /nfs/dbraw/zinc/55/43/02/1130554302.db2.gz UALZJBJEAYUSSD-RDJZCZTQSA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)[NH+]1CCC(N(C)Cc2cccc3cnccc32)CC1 ZINC000679981914 1130566840 /nfs/dbraw/zinc/56/68/40/1130566840.db2.gz DKLUWPSPXYVQKD-UHFFFAOYSA-N 1 3 297.446 3.539 20 0 CHADHO c1ccc(-c2ccccc2CN2CC[C@]3(CC[NH2+]C3)C2)cc1 ZINC001235034254 1130703826 /nfs/dbraw/zinc/70/38/26/1130703826.db2.gz WAOXMZVTZAREKV-FQEVSTJZSA-N 1 3 292.426 3.539 20 0 CHADHO C[C@H](N[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc[nH]1 ZINC000781515908 1130722753 /nfs/dbraw/zinc/72/27/53/1130722753.db2.gz AVYONHUWZKGVCK-BQFCYCMXSA-N 1 3 297.446 3.718 20 0 CHADHO C[C@H](N[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc[nH]1 ZINC000781515908 1130722758 /nfs/dbraw/zinc/72/27/58/1130722758.db2.gz AVYONHUWZKGVCK-BQFCYCMXSA-N 1 3 297.446 3.718 20 0 CHADHO Clc1cccc(CN2CCC([C@H]3CCCC[NH2+]3)CC2)c1 ZINC001235227224 1130723791 /nfs/dbraw/zinc/72/37/91/1130723791.db2.gz FFIXVFVYCIHALL-QGZVFWFLSA-N 1 3 292.854 3.694 20 0 CHADHO Cc1cccc(-c2ccc(CN3C[C@@H]4C[C@H]3C[C@@H]4[NH3+])cc2)c1 ZINC001235256611 1130729443 /nfs/dbraw/zinc/72/94/43/1130729443.db2.gz SFVWDMMTIVTYJZ-UFYCRDLUSA-N 1 3 292.426 3.584 20 0 CHADHO CN(CCC[NH3+])Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001235435283 1130743540 /nfs/dbraw/zinc/74/35/40/1130743540.db2.gz GUONBXMJFJTJAD-UHFFFAOYSA-N 1 3 293.414 3.616 20 0 CHADHO [NH3+]Cc1ccc(CN2CCC[C@H]2c2cccc(F)c2)cc1 ZINC001235716098 1130771245 /nfs/dbraw/zinc/77/12/45/1130771245.db2.gz YSRGMTFDJMQHAC-SFHVURJKSA-N 1 3 284.378 3.622 20 0 CHADHO Fc1cccc([C@H]2CCCN2Cc2ccc3c(c2)C[NH2+]C3)c1 ZINC001235715917 1130771591 /nfs/dbraw/zinc/77/15/91/1130771591.db2.gz XUEZJPIPJTVBJF-LJQANCHMSA-N 1 3 296.389 3.766 20 0 CHADHO Fc1ccccc1[C@H]1CCCN1Cc1ccc2c(c1)C[NH2+]C2 ZINC001235719029 1130773830 /nfs/dbraw/zinc/77/38/30/1130773830.db2.gz QNPHWTUQNFQZOC-LJQANCHMSA-N 1 3 296.389 3.766 20 0 CHADHO Cc1cc(Oc2ccccc2)ccc1CN1CC[C@H](C[NH3+])C1 ZINC001235750657 1130777367 /nfs/dbraw/zinc/77/73/67/1130777367.db2.gz REKVHTTZIMEMMD-MRXNPFEDSA-N 1 3 296.414 3.568 20 0 CHADHO CC/C=C\CCCCCC[N@H+](CCOC)C1CCNCC1 ZINC001235946673 1130812624 /nfs/dbraw/zinc/81/26/24/1130812624.db2.gz OWQYEQGXBRUDBE-PLNGDYQASA-N 1 3 296.499 3.604 20 0 CHADHO CC/C=C\CCCCCC[N@@H+](CCOC)C1CCNCC1 ZINC001235946673 1130812629 /nfs/dbraw/zinc/81/26/29/1130812629.db2.gz OWQYEQGXBRUDBE-PLNGDYQASA-N 1 3 296.499 3.604 20 0 CHADHO CC/C=C\CCCCCCN(CCOC)C1CC[NH2+]CC1 ZINC001235946673 1130812633 /nfs/dbraw/zinc/81/26/33/1130812633.db2.gz OWQYEQGXBRUDBE-PLNGDYQASA-N 1 3 296.499 3.604 20 0 CHADHO c1cc(C[N@@H+]2CC[C@H](C3CCCCC3)C2)cc2c1CNC2 ZINC001235949646 1130814586 /nfs/dbraw/zinc/81/45/86/1130814586.db2.gz PQLASXXROFEIIE-SFHVURJKSA-N 1 3 284.447 3.692 20 0 CHADHO c1cc(C[N@H+]2CC[C@H](C3CCCCC3)C2)cc2c1CNC2 ZINC001235949646 1130814593 /nfs/dbraw/zinc/81/45/93/1130814593.db2.gz PQLASXXROFEIIE-SFHVURJKSA-N 1 3 284.447 3.692 20 0 CHADHO COc1ccc2cc(C[N@H+](C)[C@H]3CCCC[C@H]3N)ccc2c1 ZINC001236210664 1130888570 /nfs/dbraw/zinc/88/85/70/1130888570.db2.gz DWRPIMUWTUXGBT-MOPGFXCFSA-N 1 3 298.430 3.550 20 0 CHADHO COc1ccc2cc(C[N@@H+](C)[C@H]3CCCC[C@H]3N)ccc2c1 ZINC001236210664 1130888577 /nfs/dbraw/zinc/88/85/77/1130888577.db2.gz DWRPIMUWTUXGBT-MOPGFXCFSA-N 1 3 298.430 3.550 20 0 CHADHO C[N@H+](Cc1cccc(C(C)(C)C)c1)[C@H]1CCCC[C@H]1N ZINC001236213885 1130890318 /nfs/dbraw/zinc/89/03/18/1130890318.db2.gz CEIYSXNWISSYGE-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO C[N@@H+](Cc1cccc(C(C)(C)C)c1)[C@H]1CCCC[C@H]1N ZINC001236213885 1130890326 /nfs/dbraw/zinc/89/03/26/1130890326.db2.gz CEIYSXNWISSYGE-SJORKVTESA-N 1 3 274.452 3.686 20 0 CHADHO CC(C)Cc1ccc(C[N@H+](C)[C@@H]2CCCC[C@@H]2N)cc1 ZINC001236218031 1130893562 /nfs/dbraw/zinc/89/35/62/1130893562.db2.gz RANWRIJYTBYGOH-ZWKOTPCHSA-N 1 3 274.452 3.587 20 0 CHADHO CC(C)Cc1ccc(C[N@@H+](C)[C@@H]2CCCC[C@@H]2N)cc1 ZINC001236218031 1130893567 /nfs/dbraw/zinc/89/35/67/1130893567.db2.gz RANWRIJYTBYGOH-ZWKOTPCHSA-N 1 3 274.452 3.587 20 0 CHADHO CN(Cc1cccc(Cl)c1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236223187 1130896635 /nfs/dbraw/zinc/89/66/35/1130896635.db2.gz NSFKFYNBKQDDBY-HAQNSBGRSA-N 1 3 287.234 3.695 20 0 CHADHO Cc1cc(Cl)cc(C)c1CN(C)C1(C)CC[NH2+]CC1 ZINC001236226696 1130896952 /nfs/dbraw/zinc/89/69/52/1130896952.db2.gz RJTMPGAVPHWRAL-UHFFFAOYSA-N 1 3 280.843 3.531 20 0 CHADHO C(C1CCCCC1)[N@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236373532 1130923859 /nfs/dbraw/zinc/92/38/59/1130923859.db2.gz ZCFKVBXFUNSKNS-KRWDZBQOSA-N 1 3 278.484 3.811 20 0 CHADHO C(C1CCCCC1)[N@@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236373532 1130923861 /nfs/dbraw/zinc/92/38/61/1130923861.db2.gz ZCFKVBXFUNSKNS-KRWDZBQOSA-N 1 3 278.484 3.811 20 0 CHADHO CCC[C@H](C)C[N@H+](Cc1cccc(F)c1)C1CCNCC1 ZINC001236402208 1130928752 /nfs/dbraw/zinc/92/87/52/1130928752.db2.gz XYFRUWBBIYDPEP-HNNXBMFYSA-N 1 3 292.442 3.816 20 0 CHADHO CCC[C@H](C)C[N@@H+](Cc1cccc(F)c1)C1CCNCC1 ZINC001236402208 1130928754 /nfs/dbraw/zinc/92/87/54/1130928754.db2.gz XYFRUWBBIYDPEP-HNNXBMFYSA-N 1 3 292.442 3.816 20 0 CHADHO CCC[C@H](C)CN(Cc1cccc(F)c1)C1CC[NH2+]CC1 ZINC001236402208 1130928759 /nfs/dbraw/zinc/92/87/59/1130928759.db2.gz XYFRUWBBIYDPEP-HNNXBMFYSA-N 1 3 292.442 3.816 20 0 CHADHO CCC(CC)C[N@H+](Cc1cccc(F)c1)C1CCNCC1 ZINC001236401295 1130929040 /nfs/dbraw/zinc/92/90/40/1130929040.db2.gz NZFWKAOMBDWVIR-UHFFFAOYSA-N 1 3 292.442 3.816 20 0 CHADHO CCC(CC)C[N@@H+](Cc1cccc(F)c1)C1CCNCC1 ZINC001236401295 1130929044 /nfs/dbraw/zinc/92/90/44/1130929044.db2.gz NZFWKAOMBDWVIR-UHFFFAOYSA-N 1 3 292.442 3.816 20 0 CHADHO CCC(CC)CN(Cc1cccc(F)c1)C1CC[NH2+]CC1 ZINC001236401295 1130929049 /nfs/dbraw/zinc/92/90/49/1130929049.db2.gz NZFWKAOMBDWVIR-UHFFFAOYSA-N 1 3 292.442 3.816 20 0 CHADHO CCN(Cc1ccccc1-c1ccccc1)C[C@H]1CC[NH2+]C1 ZINC001236407440 1130931495 /nfs/dbraw/zinc/93/14/95/1130931495.db2.gz FKTMOAVZPBNWCR-KRWDZBQOSA-N 1 3 294.442 3.785 20 0 CHADHO CC(C)C[NH2+]Cc1ccc(-c2cc(N(C)C)ccn2)cc1 ZINC001236427094 1130939092 /nfs/dbraw/zinc/93/90/92/1130939092.db2.gz XLJIHMUFFVWJLR-UHFFFAOYSA-N 1 3 283.419 3.560 20 0 CHADHO CCc1ccccc1C[N@H+](CC(C)(C)C)C1CCNCC1 ZINC001236457597 1130946799 /nfs/dbraw/zinc/94/67/99/1130946799.db2.gz OMKWOQOOWDXBKY-UHFFFAOYSA-N 1 3 288.479 3.849 20 0 CHADHO CCc1ccccc1C[N@@H+](CC(C)(C)C)C1CCNCC1 ZINC001236457597 1130946802 /nfs/dbraw/zinc/94/68/02/1130946802.db2.gz OMKWOQOOWDXBKY-UHFFFAOYSA-N 1 3 288.479 3.849 20 0 CHADHO CC[C@H](C)C[N@H+](Cc1cc(C)cc(F)c1)C1CCNCC1 ZINC001236481332 1130952146 /nfs/dbraw/zinc/95/21/46/1130952146.db2.gz RFYMKFGBMHOQRK-AWEZNQCLSA-N 1 3 292.442 3.734 20 0 CHADHO CC[C@H](C)C[N@@H+](Cc1cc(C)cc(F)c1)C1CCNCC1 ZINC001236481332 1130952147 /nfs/dbraw/zinc/95/21/47/1130952147.db2.gz RFYMKFGBMHOQRK-AWEZNQCLSA-N 1 3 292.442 3.734 20 0 CHADHO CC[C@H](C)CN(Cc1cc(C)cc(F)c1)C1CC[NH2+]CC1 ZINC001236481332 1130952152 /nfs/dbraw/zinc/95/21/52/1130952152.db2.gz RFYMKFGBMHOQRK-AWEZNQCLSA-N 1 3 292.442 3.734 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@H+](C[C@@H]1CCCNC1)C1CC1 ZINC001236584858 1130980432 /nfs/dbraw/zinc/98/04/32/1130980432.db2.gz XKYXBPYHPWJYTK-DLBZAZTESA-N 1 3 278.484 3.833 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@@H+](C[C@@H]1CCCNC1)C1CC1 ZINC001236584858 1130980437 /nfs/dbraw/zinc/98/04/37/1130980437.db2.gz XKYXBPYHPWJYTK-DLBZAZTESA-N 1 3 278.484 3.833 20 0 CHADHO CCc1cccc(C)c1CN(C[C@H]1CCC[NH2+]C1)C1CC1 ZINC001236602113 1130982716 /nfs/dbraw/zinc/98/27/16/1130982716.db2.gz UBPCYWAELKXEQO-INIZCTEOSA-N 1 3 286.463 3.521 20 0 CHADHO CC(C)c1ccccc1C[N@H+](C1CCC1)C1CCNCC1 ZINC001236636655 1130986657 /nfs/dbraw/zinc/98/66/57/1130986657.db2.gz HAJDZXCDNOFXEO-UHFFFAOYSA-N 1 3 286.463 3.917 20 0 CHADHO CC(C)c1ccccc1C[N@@H+](C1CCC1)C1CCNCC1 ZINC001236636655 1130986659 /nfs/dbraw/zinc/98/66/59/1130986659.db2.gz HAJDZXCDNOFXEO-UHFFFAOYSA-N 1 3 286.463 3.917 20 0 CHADHO CC(C)c1ccccc1CN(C1CCC1)C1CC[NH2+]CC1 ZINC001236636655 1130986664 /nfs/dbraw/zinc/98/66/64/1130986664.db2.gz HAJDZXCDNOFXEO-UHFFFAOYSA-N 1 3 286.463 3.917 20 0 CHADHO Cc1cc(F)ccc1[C@H](C)[NH2+][C@@H]1CCC[C@H](N(C)C)C1 ZINC000815586159 1131003853 /nfs/dbraw/zinc/00/38/53/1131003853.db2.gz ARDPKKYXXAOBCP-IMJJTQAJSA-N 1 3 278.415 3.658 20 0 CHADHO CCCN(Cc1c(C)cc(Cl)cc1C)C[C@H]1CC[NH2+]C1 ZINC001236842947 1131020534 /nfs/dbraw/zinc/02/05/34/1131020534.db2.gz IGNAZSXHRNHDDX-HNNXBMFYSA-N 1 3 294.870 3.778 20 0 CHADHO C[C@@]1(C[NH3+])CCCN(Cc2ccc(C3CCC3)cc2)C1 ZINC001237083185 1131047416 /nfs/dbraw/zinc/04/74/16/1131047416.db2.gz WXDJPAMDNUNLAN-SFHVURJKSA-N 1 3 272.436 3.515 20 0 CHADHO [NH3+]CC1C[C@H]2CC[C@@H](C1)N2Cc1c(Cl)cccc1Cl ZINC001237081270 1131047460 /nfs/dbraw/zinc/04/74/60/1131047460.db2.gz KBFFHTUVKKFAGG-YOGCLGLASA-N 1 3 299.245 3.695 20 0 CHADHO CCC(C)(C)c1ccc(CN2CCC[C@](C)(C[NH3+])C2)cc1 ZINC001237080153 1131047965 /nfs/dbraw/zinc/04/79/65/1131047965.db2.gz DESLULZCWGPKSQ-LJQANCHMSA-N 1 3 288.479 3.935 20 0 CHADHO C[NH+]1CCC2(CCCN(Cc3ccc(Cl)cc3)C2)CC1 ZINC000798957455 1131065359 /nfs/dbraw/zinc/06/53/59/1131065359.db2.gz XRCQLKQHZXFZON-UHFFFAOYSA-N 1 3 292.854 3.648 20 0 CHADHO C[C@H](Cc1ccc(C(C)(C)C)cc1)CN1C[C@@H]([NH3+])C[C@H]1C ZINC001237204033 1131071491 /nfs/dbraw/zinc/07/14/91/1131071491.db2.gz PPUDILABHQPAHS-RKVPGOIHSA-N 1 3 288.479 3.584 20 0 CHADHO CC[C@@H]1CC[N@H+](Cc2ccc3c(c2)C(C(C)C)=NCC3)C1 ZINC001237880022 1131147218 /nfs/dbraw/zinc/14/72/18/1131147218.db2.gz SLTYFTJKCXYADX-OAHLLOKOSA-N 1 3 284.447 3.920 20 0 CHADHO CC[C@@H]1CC[N@@H+](Cc2ccc3c(c2)C(C(C)C)=NCC3)C1 ZINC001237880022 1131147219 /nfs/dbraw/zinc/14/72/19/1131147219.db2.gz SLTYFTJKCXYADX-OAHLLOKOSA-N 1 3 284.447 3.920 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@@H+]3CCC[C@@H]4C[C@@H]43)cc21 ZINC001237889806 1131148950 /nfs/dbraw/zinc/14/89/50/1131148950.db2.gz OHKVRSHJLQYSBI-AEFFLSMTSA-N 1 3 282.431 3.672 20 0 CHADHO CC(C)C1=NCCc2ccc(C[N@H+]3CCC[C@@H]4C[C@@H]43)cc21 ZINC001237889806 1131148951 /nfs/dbraw/zinc/14/89/51/1131148951.db2.gz OHKVRSHJLQYSBI-AEFFLSMTSA-N 1 3 282.431 3.672 20 0 CHADHO CC(C)(C)c1cc(Nc2cccc(CC[NH3+])c2)ccn1 ZINC001159672024 1131179447 /nfs/dbraw/zinc/17/94/47/1131179447.db2.gz MZYPFQLPZHAQEC-UHFFFAOYSA-N 1 3 269.392 3.624 20 0 CHADHO C[C@@H](N[C@@H]1CCC[NH2+]CC1)c1csc2ccccc12 ZINC000817899415 1131186950 /nfs/dbraw/zinc/18/69/50/1131186950.db2.gz OJDSCKPEOMYWAJ-CHWSQXEVSA-N 1 3 274.433 3.694 20 0 CHADHO N[C@@H]1C[C@H]([NH2+]CCSCc2ccccc2)c2ccccc21 ZINC000817896887 1131187032 /nfs/dbraw/zinc/18/70/32/1131187032.db2.gz YCHQXIQMODDGJN-MSOLQXFVSA-N 1 3 298.455 3.654 20 0 CHADHO C[C@H](NCc1ccc(CC[NH3+])cc1)c1ccc(Cl)s1 ZINC000817946610 1131189589 /nfs/dbraw/zinc/18/95/89/1131189589.db2.gz BBEAOVYXFHEVGS-NSHDSACASA-N 1 3 294.851 3.754 20 0 CHADHO CCCCC[C@H]([NH2+][C@@H]1CCNC[C@H]1C)C(C)(C)C ZINC000817969953 1131193631 /nfs/dbraw/zinc/19/36/31/1131193631.db2.gz IMKHPYHLMZEPFF-KFWWJZLASA-N 1 3 254.462 3.569 20 0 CHADHO COc1c(C)cc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2N)cc1Cl ZINC000818614658 1131218746 /nfs/dbraw/zinc/21/87/46/1131218746.db2.gz DMVIXTGLAXFGGX-NILFDRSVSA-N 1 3 296.842 3.578 20 0 CHADHO CC[C@@H]1CC(N[C@H]2CC23CCCCC3)C[C@@H](CC)[NH2+]1 ZINC001246333577 1131474729 /nfs/dbraw/zinc/47/47/29/1131474729.db2.gz KEIQKNZGPVZFFC-FMKPAKJESA-N 1 3 264.457 3.608 20 0 CHADHO CC[C@@H]1C[C@H](N[C@@H]2CC23CCCCC3)C[C@H](CC)[NH2+]1 ZINC001246333580 1131474755 /nfs/dbraw/zinc/47/47/55/1131474755.db2.gz KEIQKNZGPVZFFC-FXUDXRNXSA-N 1 3 264.457 3.608 20 0 CHADHO CC[C@H](C)C1CCC([NH2+][C@@H]2C[C@@H](C)N[C@@H](C)C2)CC1 ZINC001246340556 1131479154 /nfs/dbraw/zinc/47/91/54/1131479154.db2.gz VCMITRHWFDVUPE-MSMMBACJSA-N 1 3 266.473 3.710 20 0 CHADHO CCC[C@@]1(CN[C@H](C)C[C@@H](C)CC(C)C)CC[NH2+]1 ZINC001246454170 1131503433 /nfs/dbraw/zinc/50/34/33/1131503433.db2.gz ABHRLNGPZQLRTJ-XHSDSOJGSA-N 1 3 254.462 3.569 20 0 CHADHO CCC[C@H](C)CC[C@H](C)[NH2+][C@@H](C1CCC1)C1CNC1 ZINC001246519212 1131545773 /nfs/dbraw/zinc/54/57/73/1131545773.db2.gz QSVLIDOQTYMPMZ-ZQIUZPCESA-N 1 3 266.473 3.569 20 0 CHADHO CCCCC[C@H](CCC)[N@H+]1CCC[C@@H](CN)[C@H]1C ZINC001246564306 1131628434 /nfs/dbraw/zinc/62/84/34/1131628434.db2.gz MNHZRLPECFKWPV-PMPSAXMXSA-N 1 3 254.462 3.795 20 0 CHADHO CCCCC[C@H](CCC)[N@@H+]1CCC[C@@H](CN)[C@H]1C ZINC001246564306 1131628432 /nfs/dbraw/zinc/62/84/32/1131628432.db2.gz MNHZRLPECFKWPV-PMPSAXMXSA-N 1 3 254.462 3.795 20 0 CHADHO CCCC[C@H](CC(C)C)[N@@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001246566718 1131633648 /nfs/dbraw/zinc/63/36/48/1131633648.db2.gz UYZUMAIXQIOVLP-HRCADAONSA-N 1 3 254.462 3.651 20 0 CHADHO CCCC[C@H](CC(C)C)[N@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001246566718 1131633651 /nfs/dbraw/zinc/63/36/51/1131633651.db2.gz UYZUMAIXQIOVLP-HRCADAONSA-N 1 3 254.462 3.651 20 0 CHADHO C[C@H](NCCCCCC[NH3+])c1c(F)cccc1Cl ZINC000846222443 1131702284 /nfs/dbraw/zinc/70/22/84/1131702284.db2.gz CQOVPYMZVUWONA-NSHDSACASA-N 1 3 272.795 3.649 20 0 CHADHO CCCCC1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)N3)CC1 ZINC001246682146 1131778733 /nfs/dbraw/zinc/77/87/33/1131778733.db2.gz SSSGWEUYJLXNPV-FVQHAEBGSA-N 1 3 264.457 3.562 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@@H+]2CCCCC[C@H]2C)CCN1 ZINC001246771593 1131780523 /nfs/dbraw/zinc/78/05/23/1131780523.db2.gz ZEVKZHOQGFSANA-BZUAXINKSA-N 1 3 252.446 3.562 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@H+]2CCCCC[C@H]2C)CCN1 ZINC001246771593 1131780526 /nfs/dbraw/zinc/78/05/26/1131780526.db2.gz ZEVKZHOQGFSANA-BZUAXINKSA-N 1 3 252.446 3.562 20 0 CHADHO CCCN(Cc1ccccc1)[C@H]1CC[NH2+][C@@H](C(C)C)C1 ZINC001246776638 1131781047 /nfs/dbraw/zinc/78/10/47/1131781047.db2.gz LITAGRPVHPVJCC-ZWKOTPCHSA-N 1 3 274.452 3.675 20 0 CHADHO CCCN(Cc1ccccc1)[C@H]1CC[NH2+][C@H](C(C)C)C1 ZINC001246776636 1131781721 /nfs/dbraw/zinc/78/17/21/1131781721.db2.gz LITAGRPVHPVJCC-ROUUACIJSA-N 1 3 274.452 3.675 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@@H+]2CCC3(CCCC3)C2)CCN1 ZINC001246810142 1131783412 /nfs/dbraw/zinc/78/34/12/1131783412.db2.gz YEDPAAAWXPKVQM-HZPDHXFCSA-N 1 3 264.457 3.563 20 0 CHADHO CCCC[C@@H]1C[C@H]([N@H+]2CCC3(CCCC3)C2)CCN1 ZINC001246810142 1131783416 /nfs/dbraw/zinc/78/34/16/1131783416.db2.gz YEDPAAAWXPKVQM-HZPDHXFCSA-N 1 3 264.457 3.563 20 0 CHADHO C1CCC2(CC1)CCC([NH+]1CCCNCCC1)CC2 ZINC001246904182 1131807419 /nfs/dbraw/zinc/80/74/19/1131807419.db2.gz FNELAKGFUGWDBH-UHFFFAOYSA-N 1 3 264.457 3.565 20 0 CHADHO CCC[N@H+](CC(C)C)C1C[C@H](CC)N[C@@H](CC)C1 ZINC001246912756 1131814647 /nfs/dbraw/zinc/81/46/47/1131814647.db2.gz SRDDMFJPVFFWRJ-GJZGRUSLSA-N 1 3 254.462 3.664 20 0 CHADHO CCC[N@@H+](CC(C)C)C1C[C@H](CC)N[C@@H](CC)C1 ZINC001246912756 1131814656 /nfs/dbraw/zinc/81/46/56/1131814656.db2.gz SRDDMFJPVFFWRJ-GJZGRUSLSA-N 1 3 254.462 3.664 20 0 CHADHO c1ccc(CN2C[C@@H]3C[C@H]2C[C@@H]([NH2+][C@@H]2CC=CCC2)C3)cc1 ZINC000716627726 1132028859 /nfs/dbraw/zinc/02/88/59/1132028859.db2.gz UAEDTMCYAWTRGH-YRPNKDGESA-N 1 3 296.458 3.738 20 0 CHADHO C1=C(C[NH2+][C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)CCC1 ZINC000716639555 1132028936 /nfs/dbraw/zinc/02/89/36/1132028936.db2.gz TZWBSRLMPSBRIL-UFYCRDLUSA-N 1 3 296.458 3.739 20 0 CHADHO C[C@H]1CCC[C@@H]([NH2+]C2CC(C)(C)N(C)C(C)(C)C2)C1 ZINC001171613182 1132065611 /nfs/dbraw/zinc/06/56/11/1132065611.db2.gz GYZJEMGOEGMCOT-UONOGXRCSA-N 1 3 266.473 3.806 20 0 CHADHO CN1C(C)(C)CC([NH2+]CCC(C)(C)C)CC1(C)C ZINC001171617721 1132066068 /nfs/dbraw/zinc/06/60/68/1132066068.db2.gz QFSZRIFAHGHKIN-UHFFFAOYSA-N 1 3 254.462 3.664 20 0 CHADHO Cc1cccc([C@@H](C)N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC001172100220 1132126102 /nfs/dbraw/zinc/12/61/02/1132126102.db2.gz BIYNADVETDPSBW-DDBAPUKQSA-N 1 3 272.436 3.661 20 0 CHADHO Cc1cccc([C@@H](C)N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC001172100220 1132126106 /nfs/dbraw/zinc/12/61/06/1132126106.db2.gz BIYNADVETDPSBW-DDBAPUKQSA-N 1 3 272.436 3.661 20 0 CHADHO CC[C@@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001172107595 1132129379 /nfs/dbraw/zinc/12/93/79/1132129379.db2.gz FPFSCUJUAXIAIS-ZJPYXAASSA-N 1 3 290.426 3.882 20 0 CHADHO CC[C@@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001172107595 1132129382 /nfs/dbraw/zinc/12/93/82/1132129382.db2.gz FPFSCUJUAXIAIS-ZJPYXAASSA-N 1 3 290.426 3.882 20 0 CHADHO CC(C)c1ccc(CN[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172102697 1132130845 /nfs/dbraw/zinc/13/08/45/1132130845.db2.gz OINBHHCNJNKYFC-LDLYASANSA-N 1 3 286.463 3.915 20 0 CHADHO CC(C)c1ccc(CN[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172102697 1132130850 /nfs/dbraw/zinc/13/08/50/1132130850.db2.gz OINBHHCNJNKYFC-LDLYASANSA-N 1 3 286.463 3.915 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC3(CC(F)(F)C3)CC1)C2 ZINC001172116883 1132132990 /nfs/dbraw/zinc/13/29/90/1132132990.db2.gz DPEXTJUWFZEENA-FICVDOATSA-N 1 3 298.421 3.513 20 0 CHADHO Cc1ccc(CN(C)[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1C ZINC001172122367 1132136399 /nfs/dbraw/zinc/13/63/99/1132136399.db2.gz AGEQZCVMKLEAOW-BWTSREIZSA-N 1 3 286.463 3.751 20 0 CHADHO Cc1ccc(CN(C)[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1C ZINC001172122367 1132136401 /nfs/dbraw/zinc/13/64/01/1132136401.db2.gz AGEQZCVMKLEAOW-BWTSREIZSA-N 1 3 286.463 3.751 20 0 CHADHO CC[C@@H](C)OCC[C@@H](C)[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001172324986 1132160937 /nfs/dbraw/zinc/16/09/37/1132160937.db2.gz PMXWZFUPBHXZAT-HUUCEWRRSA-N 1 3 298.515 3.821 20 0 CHADHO CCC(CC)N1CCC([NH2+][C@@H](C)CCO[C@@H](C)CC)CC1 ZINC001172332345 1132172217 /nfs/dbraw/zinc/17/22/17/1132172217.db2.gz DNLAHDSAYQZDBZ-HOTGVXAUSA-N 1 3 298.515 3.823 20 0 CHADHO C[C@@H]1CC[C@@H]([NH+]2CCC(N3CCCCC3)CC2)C[C@@H]1C ZINC001172366707 1132191861 /nfs/dbraw/zinc/19/18/61/1132191861.db2.gz OWUBRQQCYGHMGT-SOLBZPMBSA-N 1 3 278.484 3.761 20 0 CHADHO CC[C@H](CC(C)C)[NH2+]CCCN1CCCC[C@H]1C ZINC001172390262 1132214813 /nfs/dbraw/zinc/21/48/13/1132214813.db2.gz SIGCFIWFZNPWEU-HZPDHXFCSA-N 1 3 254.462 3.665 20 0 CHADHO CC(C)COCC[C@H](C)[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001172461315 1132241323 /nfs/dbraw/zinc/24/13/23/1132241323.db2.gz FNHQVHRRVHPWKI-HNNXBMFYSA-N 1 3 298.515 3.679 20 0 CHADHO CN1CCC[C@H]1CC[NH2+][C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172544015 1132279278 /nfs/dbraw/zinc/27/92/78/1132279278.db2.gz VSPIHPDYLOYEOA-QRVBRYPASA-N 1 3 286.463 3.787 20 0 CHADHO C[C@H]1CCCCN1CCC[NH2+]C1CC(C)(C)OC(C)(C)C1 ZINC001172649638 1132287818 /nfs/dbraw/zinc/28/78/18/1132287818.db2.gz RIARWRITCGSBLN-HNNXBMFYSA-N 1 3 296.499 3.577 20 0 CHADHO CCCN1C[C@@H]2C[N@H+](C3CCC4(CCCC4)CC3)C[C@@H]2C1 ZINC001172730291 1132303552 /nfs/dbraw/zinc/30/35/52/1132303552.db2.gz CNDDVJIDXZHYKY-CALCHBBNSA-N 1 3 290.495 3.763 20 0 CHADHO CCCN1C[C@@H]2C[N@@H+](C3CCC4(CCCC4)CC3)C[C@@H]2C1 ZINC001172730291 1132303557 /nfs/dbraw/zinc/30/35/57/1132303557.db2.gz CNDDVJIDXZHYKY-CALCHBBNSA-N 1 3 290.495 3.763 20 0 CHADHO CCC[N@@H+](Cc1cc(F)cc(CN(C)C)c1)CC1CC1 ZINC001232143377 1132428495 /nfs/dbraw/zinc/42/84/95/1132428495.db2.gz BVSVOWKYQUCQQZ-UHFFFAOYSA-N 1 3 278.415 3.509 20 0 CHADHO CCC[N@H+](Cc1cc(F)cc(CN(C)C)c1)CC1CC1 ZINC001232143377 1132428499 /nfs/dbraw/zinc/42/84/99/1132428499.db2.gz BVSVOWKYQUCQQZ-UHFFFAOYSA-N 1 3 278.415 3.509 20 0 CHADHO CCC(CC)N1CCC([NH2+][C@H]2CC[C@H](CC)C2)CC1 ZINC001173270181 1132435328 /nfs/dbraw/zinc/43/53/28/1132435328.db2.gz BAZOCPQWCXWKLU-HOCLYGCPSA-N 1 3 266.473 3.808 20 0 CHADHO CC[C@H]1CC[C@@H](N2CCC(C)([NH+]3CCCC3)CC2)C1 ZINC001173281664 1132455314 /nfs/dbraw/zinc/45/53/14/1132455314.db2.gz ATQPGSNQCHZYNM-JKSUJKDBSA-N 1 3 264.457 3.515 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+][C@@H]1CCCC2(CCCCC2)C1 ZINC001173341981 1132468615 /nfs/dbraw/zinc/46/86/15/1132468615.db2.gz UKWXUEAQWNYKAL-IAGOWNOFSA-N 1 3 278.484 3.953 20 0 CHADHO C[NH+](C)Cc1ccccc1Nc1ccnc(C2CC2)c1 ZINC001173929183 1132642387 /nfs/dbraw/zinc/64/23/87/1132642387.db2.gz YXLMIMPNEXXCCC-UHFFFAOYSA-N 1 3 267.376 3.764 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](CN2CC(C)(C[NH3+])C2)CC1 ZINC001206712195 1133262096 /nfs/dbraw/zinc/26/20/96/1133262096.db2.gz WFOCSQMUFKZXLK-QGZVFWFLSA-N 1 3 276.468 3.740 20 0 CHADHO C[NH2+]C[C@H]1CCCN(Cc2ccc(C)c3ccccc23)C1 ZINC001205008432 1133516566 /nfs/dbraw/zinc/51/65/66/1133516566.db2.gz AOGVEUGYWXRJQJ-MRXNPFEDSA-N 1 3 282.431 3.580 20 0 CHADHO CCCCc1ccc(CN2CC[C@@H](C)[C@H](C[NH3+])C2)s1 ZINC001205306336 1133557937 /nfs/dbraw/zinc/55/79/37/1133557937.db2.gz VNYGXDFBGMFUCB-ZIAGYGMSSA-N 1 3 280.481 3.507 20 0 CHADHO Cc1cccc(-c2ccc(C[N@H+]3CCNCC[C@@H]3C)cc2)c1 ZINC001205331136 1133562311 /nfs/dbraw/zinc/56/23/11/1133562311.db2.gz FLFKSWQVHHQHGX-KRWDZBQOSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1cccc(-c2ccc(C[N@@H+]3CCNCC[C@@H]3C)cc2)c1 ZINC001205331136 1133562313 /nfs/dbraw/zinc/56/23/13/1133562313.db2.gz FLFKSWQVHHQHGX-KRWDZBQOSA-N 1 3 294.442 3.846 20 0 CHADHO Cc1ccc(F)c(CN2CCC[C@@](C)(C[NH3+])CC2)c1Cl ZINC001206303207 1133686693 /nfs/dbraw/zinc/68/66/93/1133686693.db2.gz CWHHECHSOJKFMN-MRXNPFEDSA-N 1 3 298.833 3.738 20 0 CHADHO CC(C)[N@H+](CCCc1ccccc1F)[C@H]1CCCNCC1 ZINC001206580115 1133722334 /nfs/dbraw/zinc/72/23/34/1133722334.db2.gz CIHZKMYJPPIHRD-KRWDZBQOSA-N 1 3 292.442 3.611 20 0 CHADHO CC(C)[N@@H+](CCCc1ccccc1F)[C@H]1CCCNCC1 ZINC001206580115 1133722336 /nfs/dbraw/zinc/72/23/36/1133722336.db2.gz CIHZKMYJPPIHRD-KRWDZBQOSA-N 1 3 292.442 3.611 20 0 CHADHO [NH3+]C[C@@H]1CCCCN(Cc2ccc(F)c3ccccc23)C1 ZINC001206624259 1133728809 /nfs/dbraw/zinc/72/88/09/1133728809.db2.gz SFGNFRDDQANOPZ-AWEZNQCLSA-N 1 3 286.394 3.540 20 0 CHADHO C[NH+](C)CC(C)(C)CN(Cc1ccccc1)C1CCC1 ZINC001207283968 1133787222 /nfs/dbraw/zinc/78/72/22/1133787222.db2.gz GGGKAJVUNHUZOH-UHFFFAOYSA-N 1 3 274.452 3.629 20 0 CHADHO CN(C)CC(C)(C)C[N@@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC001207282875 1133787357 /nfs/dbraw/zinc/78/73/57/1133787357.db2.gz QHHRFEHKTWLBKH-OAHLLOKOSA-N 1 3 294.870 3.717 20 0 CHADHO CN(C)CC(C)(C)C[N@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC001207282875 1133787362 /nfs/dbraw/zinc/78/73/62/1133787362.db2.gz QHHRFEHKTWLBKH-OAHLLOKOSA-N 1 3 294.870 3.717 20 0 CHADHO CCN(Cc1cccc(F)c1F)CC1CC[NH+](CC)CC1 ZINC001208602990 1133918652 /nfs/dbraw/zinc/91/86/52/1133918652.db2.gz QKCYTCHRFNXARD-UHFFFAOYSA-N 1 3 296.405 3.519 20 0 CHADHO CC(C)CCC[N@@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001208735908 1133938200 /nfs/dbraw/zinc/93/82/00/1133938200.db2.gz RGCOGWUKRWERAF-QGZVFWFLSA-N 1 3 266.473 3.763 20 0 CHADHO CC(C)CCC[N@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001208735908 1133938206 /nfs/dbraw/zinc/93/82/06/1133938206.db2.gz RGCOGWUKRWERAF-QGZVFWFLSA-N 1 3 266.473 3.763 20 0 CHADHO c1ccc(C[N@H+]2CC[C@H](CN3CC4CCC(CC4)C3)C2)cc1 ZINC001208955710 1133969429 /nfs/dbraw/zinc/96/94/29/1133969429.db2.gz FBLRPKFKJDTPPU-MHJFOBGBSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(C[N@@H+]2CC[C@H](CN3CC4CCC(CC4)C3)C2)cc1 ZINC001208955710 1133969432 /nfs/dbraw/zinc/96/94/32/1133969432.db2.gz FBLRPKFKJDTPPU-MHJFOBGBSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(CN2CC[C@H](C[NH+]3CC4CCC(CC4)C3)C2)cc1 ZINC001208955710 1133969435 /nfs/dbraw/zinc/96/94/35/1133969435.db2.gz FBLRPKFKJDTPPU-MHJFOBGBSA-N 1 3 298.474 3.631 20 0 CHADHO c1csc(CC[N@H+]2CCCC[C@H]2CCN2CCCC2)c1 ZINC001209224432 1133991236 /nfs/dbraw/zinc/99/12/36/1133991236.db2.gz AYJGIOJUTLWTQL-INIZCTEOSA-N 1 3 292.492 3.631 20 0 CHADHO c1csc(CC[N@@H+]2CCCC[C@H]2CCN2CCCC2)c1 ZINC001209224432 1133991238 /nfs/dbraw/zinc/99/12/38/1133991238.db2.gz AYJGIOJUTLWTQL-INIZCTEOSA-N 1 3 292.492 3.631 20 0 CHADHO c1csc(CCN2CCCC[C@H]2CC[NH+]2CCCC2)c1 ZINC001209224432 1133991240 /nfs/dbraw/zinc/99/12/40/1133991240.db2.gz AYJGIOJUTLWTQL-INIZCTEOSA-N 1 3 292.492 3.631 20 0 CHADHO C[C@H]1CC[N@H+](Cc2ccccc2-c2ccccc2)CCN1 ZINC001210496123 1134228557 /nfs/dbraw/zinc/22/85/57/1134228557.db2.gz DNMQBLZKUMYDIM-INIZCTEOSA-N 1 3 280.415 3.537 20 0 CHADHO C[C@H]1CC[N@@H+](Cc2ccccc2-c2ccccc2)CCN1 ZINC001210496123 1134228563 /nfs/dbraw/zinc/22/85/63/1134228563.db2.gz DNMQBLZKUMYDIM-INIZCTEOSA-N 1 3 280.415 3.537 20 0 CHADHO C[NH2+]Cc1ccc(Nc2ccnc(C3CCC3)c2)cc1 ZINC001211130568 1134376893 /nfs/dbraw/zinc/37/68/93/1134376893.db2.gz RJPQKAIXRTXVPH-UHFFFAOYSA-N 1 3 267.376 3.812 20 0 CHADHO Cc1ccc(CN2CCCC[C@@]3(CCCC[NH2+]C3)C2)cc1 ZINC001222161411 1135202819 /nfs/dbraw/zinc/20/28/19/1135202819.db2.gz NVCUUZGRNZRDJP-LJQANCHMSA-N 1 3 286.463 3.741 20 0 CHADHO Cc1ccc(CN2CCCC[C@@]3(CCCC[NH2+]C3)C2)s1 ZINC001222161619 1135202890 /nfs/dbraw/zinc/20/28/90/1135202890.db2.gz QGUVKSFUAOHCSK-QGZVFWFLSA-N 1 3 292.492 3.802 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@@H+]1CCC[C@@]12CCCNC2 ZINC001222231639 1135211092 /nfs/dbraw/zinc/21/10/92/1135211092.db2.gz OSWAKPFLMQYDIP-IAGOWNOFSA-N 1 3 264.457 3.587 20 0 CHADHO CC(C)=CCC[C@@H](C)C[N@H+]1CCC[C@@]12CCCNC2 ZINC001222231639 1135211097 /nfs/dbraw/zinc/21/10/97/1135211097.db2.gz OSWAKPFLMQYDIP-IAGOWNOFSA-N 1 3 264.457 3.587 20 0 CHADHO CC(C)=CCC[C@@H](C)CN1CCC[C@@]12CCC[NH2+]C2 ZINC001222231639 1135211101 /nfs/dbraw/zinc/21/11/01/1135211101.db2.gz OSWAKPFLMQYDIP-IAGOWNOFSA-N 1 3 264.457 3.587 20 0 CHADHO CC1=CC[C@@H](CC[N@@H+]2CCC[C@@]23CCCNC3)C1(C)C ZINC001222230722 1135211305 /nfs/dbraw/zinc/21/13/05/1135211305.db2.gz CLCSMWHVEIMCFS-FUHWJXTLSA-N 1 3 276.468 3.587 20 0 CHADHO CC1=CC[C@@H](CC[N@H+]2CCC[C@@]23CCCNC3)C1(C)C ZINC001222230722 1135211310 /nfs/dbraw/zinc/21/13/10/1135211310.db2.gz CLCSMWHVEIMCFS-FUHWJXTLSA-N 1 3 276.468 3.587 20 0 CHADHO c1c2ccccc2oc1CN1CCC[C@]12CCC[NH2+]CC2 ZINC001222316433 1135225022 /nfs/dbraw/zinc/22/50/22/1135225022.db2.gz WDVBNZUPKDRAQU-SFHVURJKSA-N 1 3 284.403 3.541 20 0 CHADHO C[N@@H+]1CC[C@H](N[C@@H]2CCCc3ccccc32)[C@H]2CCC[C@H]21 ZINC000353453210 529807011 /nfs/dbraw/zinc/80/70/11/529807011.db2.gz FDMPLUIJUZJSGG-AKHDSKFASA-N 1 3 284.447 3.526 20 0 CHADHO C[N@H+]1CC[C@H](N[C@@H]2CCCc3ccccc32)[C@H]2CCC[C@H]21 ZINC000353453210 529807012 /nfs/dbraw/zinc/80/70/12/529807012.db2.gz FDMPLUIJUZJSGG-AKHDSKFASA-N 1 3 284.447 3.526 20 0 CHADHO CC[C@H](NCC[C@@H]1CCCC[N@@H+]1C)c1ccccc1 ZINC000052206354 522597792 /nfs/dbraw/zinc/59/77/92/522597792.db2.gz SAKWQDYGKWTFJR-IRXDYDNUSA-N 1 3 260.425 3.602 20 0 CHADHO CC[C@H](NCC[C@@H]1CCCC[N@H+]1C)c1ccccc1 ZINC000052206354 522597804 /nfs/dbraw/zinc/59/78/04/522597804.db2.gz SAKWQDYGKWTFJR-IRXDYDNUSA-N 1 3 260.425 3.602 20 0 CHADHO CSc1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)N3C)s1 ZINC000352829238 532956621 /nfs/dbraw/zinc/95/66/21/532956621.db2.gz FYRGQODESWSWPD-YHWZYXNKSA-N 1 3 296.505 3.575 20 0 CHADHO C([C@@H]1CCCNC1)[NH+](C1CCCCC1)C1CCCCC1 ZINC000020072495 170982789 /nfs/dbraw/zinc/98/27/89/170982789.db2.gz NELDEATVSMYPIC-MRXNPFEDSA-N 1 3 278.484 3.953 20 0 CHADHO CC[C@@H](NC1CC[NH+](C(C)C)CC1)c1ccccc1 ZINC000020189065 171054397 /nfs/dbraw/zinc/05/43/97/171054397.db2.gz MFCFJUWXUAZMMD-QGZVFWFLSA-N 1 3 260.425 3.600 20 0 CHADHO C[NH+]1CCC(NCc2cc(-c3ccccc3)cs2)CC1 ZINC000038030781 174023260 /nfs/dbraw/zinc/02/32/60/174023260.db2.gz DEGOMNVJPVGAMC-UHFFFAOYSA-N 1 3 286.444 3.599 20 0 CHADHO CC(C)N(C)CCC[NH2+]CC[C@H](C)c1ccccc1 ZINC000219375208 260010984 /nfs/dbraw/zinc/01/09/84/260010984.db2.gz HCNVXDFWNWFEGB-INIZCTEOSA-N 1 3 262.441 3.500 20 0 CHADHO CC(C)C[C@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC000037042979 260064368 /nfs/dbraw/zinc/06/43/68/260064368.db2.gz KEBYDGAQFKFIGX-IPQPSQTFSA-N 1 3 286.463 3.989 20 0 CHADHO CC(C)C[C@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC000037042979 260064370 /nfs/dbraw/zinc/06/43/70/260064370.db2.gz KEBYDGAQFKFIGX-IPQPSQTFSA-N 1 3 286.463 3.989 20 0 CHADHO CC(C)CC[C@H]([NH2+]CCCN(C)C(C)C)C1CC1 ZINC000310726036 260226236 /nfs/dbraw/zinc/22/62/36/260226236.db2.gz UHLQKUKUSREQMG-INIZCTEOSA-N 1 3 254.462 3.521 20 0 CHADHO C[C@@H]1CC[C@@H](NC[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc21 ZINC000126540784 260353733 /nfs/dbraw/zinc/35/37/33/260353733.db2.gz OVBOQTJATACSEQ-ZRGWGRIASA-N 1 3 284.447 3.699 20 0 CHADHO C[C@@H]1CC[C@@H](NC[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc21 ZINC000126540784 260353734 /nfs/dbraw/zinc/35/37/34/260353734.db2.gz OVBOQTJATACSEQ-ZRGWGRIASA-N 1 3 284.447 3.699 20 0 CHADHO CC(C)C[C@@H](N[C@@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000129022767 260380836 /nfs/dbraw/zinc/38/08/36/260380836.db2.gz ZAFQNNGSXZZUPO-IAGOWNOFSA-N 1 3 260.425 3.506 20 0 CHADHO CCc1ccccc1CCN(C)[C@@H]1CC[N@@H+](CC)[C@H](C)C1 ZINC000444647408 261056199 /nfs/dbraw/zinc/05/61/99/261056199.db2.gz FBIIKHMWDUPKJU-VQIMIIECSA-N 1 3 288.479 3.596 20 0 CHADHO CCc1ccccc1CCN(C)[C@@H]1CC[N@H+](CC)[C@H](C)C1 ZINC000444647408 261056201 /nfs/dbraw/zinc/05/62/01/261056201.db2.gz FBIIKHMWDUPKJU-VQIMIIECSA-N 1 3 288.479 3.596 20 0 CHADHO C[C@H](NCCCCC[NH+]1CCCCC1)c1cncc(F)c1 ZINC000164640287 261356154 /nfs/dbraw/zinc/35/61/54/261356154.db2.gz MVAUWUWEFUHDHK-HNNXBMFYSA-N 1 3 293.430 3.528 20 0 CHADHO N[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCCC2(F)F)c2ccccc21 ZINC000390669872 262237530 /nfs/dbraw/zinc/23/75/30/262237530.db2.gz RTQRAOTVVMYRQY-NILFDRSVSA-N 1 3 280.362 3.546 20 0 CHADHO CC(C)(C)c1ccc(C[NH2+]CCCN2CCCC2)cc1 ZINC000021514367 262387967 /nfs/dbraw/zinc/38/79/67/262387967.db2.gz DLJZRLVVXZXHRT-UHFFFAOYSA-N 1 3 274.452 3.560 20 0 CHADHO C[C@@H](C[NH2+][C@@H]1CCCc2sccc21)CN1CCCCC1 ZINC000061328594 262394063 /nfs/dbraw/zinc/39/40/63/262394063.db2.gz SBNWULZJBKEQLP-GOEBONIOSA-N 1 3 292.492 3.837 20 0 CHADHO CCN(Cc1ccccc1Cl)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414668666 263026408 /nfs/dbraw/zinc/02/64/08/263026408.db2.gz AMMVPPIAIXSFRL-ZIAGYGMSSA-N 1 3 280.843 3.550 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2CN)C[C@@H](c2ccccc2)C1 ZINC000414794862 263049542 /nfs/dbraw/zinc/04/95/42/263049542.db2.gz FYTZWUWLTKZVOO-XFUTXVRSSA-N 1 3 286.463 3.676 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CNCc2cc(Cl)cs2)cc1 ZINC000414816527 263053641 /nfs/dbraw/zinc/05/36/41/263053641.db2.gz PYAIGXVWYUBIQU-SNVBAGLBSA-N 1 3 280.824 3.711 20 0 CHADHO C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCNC2)C[C@@H](c2ccccc2)C1 ZINC000414827884 263055816 /nfs/dbraw/zinc/05/58/16/263055816.db2.gz KWIBBKUEVHMRDG-CAMMJAKZSA-N 1 3 286.463 3.548 20 0 CHADHO C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@@H](C)[C@H]1CCCNC1 ZINC000414827636 263055863 /nfs/dbraw/zinc/05/58/63/263055863.db2.gz YDOOGPVZEJMZRA-IKGGRYGDSA-N 1 3 288.479 3.721 20 0 CHADHO Cc1ccc(CC[C@H](C)NCC2([NH3+])CCCCC2)cc1 ZINC000414837915 263057164 /nfs/dbraw/zinc/05/71/64/263057164.db2.gz HKPXWJCXMWQOEC-INIZCTEOSA-N 1 3 274.452 3.567 20 0 CHADHO C[C@@H]([NH2+]C1CCC(C(C)(C)C)CC1)[C@@H]1CCCNC1 ZINC000414844899 263059507 /nfs/dbraw/zinc/05/95/07/263059507.db2.gz DFJWESYDCHYPCG-WXLSXGNJSA-N 1 3 266.473 3.569 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+][C@H]1CCC[C@H](N)C1 ZINC000414907075 263114252 /nfs/dbraw/zinc/11/42/52/263114252.db2.gz AIRVTLOSQNVHLR-KSZLIROESA-N 1 3 274.452 3.647 20 0 CHADHO C[C@H](NCCCCC[NH+]1CCCC1)c1ccc(Cl)nc1 ZINC000293827723 263150765 /nfs/dbraw/zinc/15/07/65/263150765.db2.gz WVBOARVHISPHHI-AWEZNQCLSA-N 1 3 295.858 3.652 20 0 CHADHO C[C@H]1CNCC[C@@H]1[NH2+]CC1CCC(c2ccccc2)CC1 ZINC000414948420 263156277 /nfs/dbraw/zinc/15/62/77/263156277.db2.gz YDVMSHOMKZGEKX-GSHBMFQSSA-N 1 3 286.463 3.548 20 0 CHADHO Cc1ccccc1-c1cccc(C[NH2+][C@H]2CCN[C@@H](C)C2)c1 ZINC000414952894 263158231 /nfs/dbraw/zinc/15/82/31/263158231.db2.gz REHCRGSQSPKAQC-LPHOPBHVSA-N 1 3 294.442 3.892 20 0 CHADHO Clc1ccc(Cl)c(CNCCC[C@@H]2CCC[NH2+]2)c1 ZINC000414966519 263169683 /nfs/dbraw/zinc/16/96/83/263169683.db2.gz GMNBVVZEBFVNGA-CYBMUJFWSA-N 1 3 287.234 3.615 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H](C2CC2)C2CCCC2)C1 ZINC000453116069 263190561 /nfs/dbraw/zinc/19/05/61/263190561.db2.gz XRHPIZQIATUCSR-MAUKXSAKSA-N 1 3 278.484 3.665 20 0 CHADHO Cc1cc(C)cc(CN[C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000415048960 263255547 /nfs/dbraw/zinc/25/55/47/263255547.db2.gz GWINVOQWCIMHIW-IBGZPJMESA-N 1 3 282.431 3.873 20 0 CHADHO Cc1ccc(CN[C@H]2CC[NH2+][C@H](c3ccccc3)C2)s1 ZINC000415086962 263271799 /nfs/dbraw/zinc/27/17/99/263271799.db2.gz SILJKQGHXCRXNP-RDJZCZTQSA-N 1 3 286.444 3.639 20 0 CHADHO C[C@@H](C[NH2+][C@@H](c1ccccc1)C1CCCC1)CN(C)C ZINC000425932362 263913884 /nfs/dbraw/zinc/91/38/84/263913884.db2.gz PVMUJPBXFBGCEG-YJBOKZPZSA-N 1 3 274.452 3.705 20 0 CHADHO C[C@@H](CN[C@@H](c1ccccc1)C1CCCC1)C[NH+](C)C ZINC000425932362 263913886 /nfs/dbraw/zinc/91/38/86/263913886.db2.gz PVMUJPBXFBGCEG-YJBOKZPZSA-N 1 3 274.452 3.705 20 0 CHADHO CC[NH+](CC)Cc1cccc(CN[C@@H]2CC[C@@H]2SC)c1 ZINC000425359647 264140968 /nfs/dbraw/zinc/14/09/68/264140968.db2.gz PZLJFFSZNSBDDL-SJORKVTESA-N 1 3 292.492 3.512 20 0 CHADHO CS[C@@H]1CC[C@@H]1NCc1cccc(C[N@H+](C)C(C)C)c1 ZINC000425361219 264147207 /nfs/dbraw/zinc/14/72/07/264147207.db2.gz UAJZOOUSUSRAGK-DLBZAZTESA-N 1 3 292.492 3.510 20 0 CHADHO CS[C@@H]1CC[C@@H]1NCc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000425361219 264147208 /nfs/dbraw/zinc/14/72/08/264147208.db2.gz UAJZOOUSUSRAGK-DLBZAZTESA-N 1 3 292.492 3.510 20 0 CHADHO CC[C@H](N[C@H]1CCC[C@H]1C[NH3+])c1cccc(Cl)c1 ZINC000251301316 264281318 /nfs/dbraw/zinc/28/13/18/264281318.db2.gz TWKYFGAVNGAJMQ-QEJZJMRPSA-N 1 3 266.816 3.508 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]C[C@H]2C[C@@H]2c2ccccc2)C1 ZINC000348240487 265147919 /nfs/dbraw/zinc/14/79/19/265147919.db2.gz IBIXIGBDIHYSNH-BHIYHBOVSA-N 1 3 286.463 3.500 20 0 CHADHO CC1(C)CC[C@H](NC[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc21 ZINC000314691669 265178091 /nfs/dbraw/zinc/17/80/91/265178091.db2.gz LSLWAVKKQCMVFL-KXBFYZLASA-N 1 3 298.474 3.873 20 0 CHADHO CC1(C)CC[C@H](NC[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc21 ZINC000314691669 265178092 /nfs/dbraw/zinc/17/80/92/265178092.db2.gz LSLWAVKKQCMVFL-KXBFYZLASA-N 1 3 298.474 3.873 20 0 CHADHO C[C@H](CC[N@@H+]1CCC[C@@H]2CN(C)CC[C@H]21)c1ccccc1 ZINC000519129545 265328018 /nfs/dbraw/zinc/32/80/18/265328018.db2.gz BEAUVYDUYNOUIN-BHIYHBOVSA-N 1 3 286.463 3.596 20 0 CHADHO C[C@H](CC[N@H+]1CCC[C@@H]2CN(C)CC[C@H]21)c1ccccc1 ZINC000519129545 265328021 /nfs/dbraw/zinc/32/80/21/265328021.db2.gz BEAUVYDUYNOUIN-BHIYHBOVSA-N 1 3 286.463 3.596 20 0 CHADHO CC(C)(C[NH2+][C@@H]1CCCc2sccc21)CN1CCCC1 ZINC000357851046 266377566 /nfs/dbraw/zinc/37/75/66/266377566.db2.gz NCFZGPSGUPYFKH-OAHLLOKOSA-N 1 3 292.492 3.837 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+]C2CCC3(CC3)CC2)C1 ZINC000362928554 267062703 /nfs/dbraw/zinc/06/27/03/267062703.db2.gz UFGHPAMNAAWHAC-MRXNPFEDSA-N 1 3 278.484 3.667 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H]([NH2+][C@H]2CCN3CCC[C@H]3C2)C1 ZINC000370477718 267320883 /nfs/dbraw/zinc/32/08/83/267320883.db2.gz QAULIHDZGHNSEV-MUGJNUQGSA-N 1 3 298.474 3.713 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H](N[C@H]2CC[N@@H+]3CCC[C@H]3C2)C1 ZINC000370477718 267320884 /nfs/dbraw/zinc/32/08/84/267320884.db2.gz QAULIHDZGHNSEV-MUGJNUQGSA-N 1 3 298.474 3.713 20 0 CHADHO C[C@]1(c2ccccc2)CC[C@H](N[C@H]2CC[N@H+]3CCC[C@H]3C2)C1 ZINC000370477718 267320885 /nfs/dbraw/zinc/32/08/85/267320885.db2.gz QAULIHDZGHNSEV-MUGJNUQGSA-N 1 3 298.474 3.713 20 0 CHADHO C[C@H](NCc1ccc(C[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000119547127 267344793 /nfs/dbraw/zinc/34/47/93/267344793.db2.gz SSIVMDZABJWAHT-AWEZNQCLSA-N 1 3 286.394 3.738 20 0 CHADHO CC(C)(C)c1ccc(CNCc2ccc(C[NH3+])cc2)cc1 ZINC000575312362 335092591 /nfs/dbraw/zinc/09/25/91/335092591.db2.gz NQPQQCXGYGGIMB-UHFFFAOYSA-N 1 3 282.431 3.733 20 0 CHADHO CC(C)(C)N1CCC([NH2+][C@@H](c2ccccc2)C2CC2)CC1 ZINC000041075744 328026557 /nfs/dbraw/zinc/02/65/57/328026557.db2.gz WOZLROFMDVCLHQ-SFHVURJKSA-N 1 3 286.463 3.990 20 0 CHADHO CC(C)(C)[NH+]1CCC(N[C@@H](c2ccccc2)C2CC2)CC1 ZINC000041075744 328026559 /nfs/dbraw/zinc/02/65/59/328026559.db2.gz WOZLROFMDVCLHQ-SFHVURJKSA-N 1 3 286.463 3.990 20 0 CHADHO C[NH+](C)CC[C@H](N[C@H]1CCc2ccccc21)C(C)(C)C ZINC000531714905 328027875 /nfs/dbraw/zinc/02/78/75/328027875.db2.gz RLXUEMGNKJXHKX-IRXDYDNUSA-N 1 3 274.452 3.630 20 0 CHADHO C[C@H](N)[C@@H]1CCC[N@@H+]([C@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000414652030 328208442 /nfs/dbraw/zinc/20/84/42/328208442.db2.gz CWSQRQWRRIAWHF-NBMJBFSESA-N 1 3 286.463 3.556 20 0 CHADHO C[C@H](N)[C@@H]1CCC[N@H+]([C@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000414652030 328208443 /nfs/dbraw/zinc/20/84/43/328208443.db2.gz CWSQRQWRRIAWHF-NBMJBFSESA-N 1 3 286.463 3.556 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000414946063 328279056 /nfs/dbraw/zinc/27/90/56/328279056.db2.gz SJSOQGHUOAGXIL-ISWURRPUSA-N 1 3 292.854 3.564 20 0 CHADHO Clc1ccc(CNCCC[C@@H]2CCC[NH2+]2)c(Cl)c1 ZINC000414960842 328282437 /nfs/dbraw/zinc/28/24/37/328282437.db2.gz ATEUGSJMHBFAIK-CYBMUJFWSA-N 1 3 287.234 3.615 20 0 CHADHO C[C@@H](N)[C@@H](C)[NH2+]Cc1ccc(Sc2ccccc2)cc1 ZINC000415011853 328298790 /nfs/dbraw/zinc/29/87/90/328298790.db2.gz IPBHRSGQBKFVJN-ZIAGYGMSSA-N 1 3 286.444 3.663 20 0 CHADHO [NH3+]CCC[C@H](NCc1ccc(Cl)s1)c1ccccc1 ZINC000415052382 328299013 /nfs/dbraw/zinc/29/90/13/328299013.db2.gz KXBFXCVTMPKXKW-AWEZNQCLSA-N 1 3 294.851 3.971 20 0 CHADHO C[C@@H](N[C@@H](C)CC[NH+](C)C)c1ccc2c(c1)CCCC2 ZINC000049553711 328371549 /nfs/dbraw/zinc/37/15/49/328371549.db2.gz FTBVPXWFXXJXPH-LSDHHAIUSA-N 1 3 274.452 3.556 20 0 CHADHO Cc1cc(C[NH2+]CCCN2CCC(C)CC2)c(C)s1 ZINC000049685276 328377906 /nfs/dbraw/zinc/37/79/06/328377906.db2.gz HQSMGFOSHGJEHI-UHFFFAOYSA-N 1 3 280.481 3.577 20 0 CHADHO C[C@H](NC1CCC([NH3+])CC1)c1cc(Cl)ccc1Cl ZINC000051693551 328467833 /nfs/dbraw/zinc/46/78/33/328467833.db2.gz TXXKHCQLMGADQM-GCVQQVDUSA-N 1 3 287.234 3.914 20 0 CHADHO CC(C)c1ccc([C@H](C)N2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)cc1 ZINC000261721553 327035175 /nfs/dbraw/zinc/03/51/75/327035175.db2.gz KGSXJCNNIYCPGI-RUGDWHBFSA-N 1 3 272.436 3.540 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]Cc2ccc(C(C)(C)C)s2)C1 ZINC000149760436 327146066 /nfs/dbraw/zinc/14/60/66/327146066.db2.gz UEYDBWRMPHWPFD-CQSZACIVSA-N 1 3 294.508 3.866 20 0 CHADHO CO[C@H](C)[C@@H](C)NC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449340188 327164420 /nfs/dbraw/zinc/16/44/20/327164420.db2.gz VNXOQSAKAAWGON-HUUCEWRRSA-N 1 3 298.515 3.679 20 0 CHADHO CC(C)CCC[C@H](C)[NH2+]C1CCN(c2ccncc2)CC1 ZINC000036961227 327253888 /nfs/dbraw/zinc/25/38/88/327253888.db2.gz VIUZBFIOLTYGIY-INIZCTEOSA-N 1 3 289.467 3.855 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@@H]1N[C@H](c1cccs1)C1CCCC1 ZINC000261600061 327258515 /nfs/dbraw/zinc/25/85/15/327258515.db2.gz PTJFUDZUCOZZGI-INWMFGNUSA-N 1 3 278.465 3.567 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H](c1cccs1)C1CCCC1 ZINC000261600061 327258516 /nfs/dbraw/zinc/25/85/16/327258516.db2.gz PTJFUDZUCOZZGI-INWMFGNUSA-N 1 3 278.465 3.567 20 0 CHADHO C[C@@H]([NH2+]C[C@H](C)CN(C)C)c1ccc(F)c2ccccc21 ZINC000559859999 327265623 /nfs/dbraw/zinc/26/56/23/327265623.db2.gz VYBNDWCJZDMRLR-UONOGXRCSA-N 1 3 288.410 3.827 20 0 CHADHO C[C@@H](NC[C@H](C)C[NH+](C)C)c1ccc(F)c2ccccc21 ZINC000559859999 327265624 /nfs/dbraw/zinc/26/56/24/327265624.db2.gz VYBNDWCJZDMRLR-UONOGXRCSA-N 1 3 288.410 3.827 20 0 CHADHO CSC1(CNC2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)CC1 ZINC000193818542 329063236 /nfs/dbraw/zinc/06/32/36/329063236.db2.gz UYZQXAIIANLGCI-GOEBONIOSA-N 1 3 296.524 3.515 20 0 CHADHO CSC1(C[NH2+]C2CCN([C@@H]3CCC[C@H](C)C3)CC2)CC1 ZINC000193818542 329063237 /nfs/dbraw/zinc/06/32/37/329063237.db2.gz UYZQXAIIANLGCI-GOEBONIOSA-N 1 3 296.524 3.515 20 0 CHADHO CCc1ccc(CN2CCC(C[NH+]3CCCC3)CC2)s1 ZINC000582896199 329282688 /nfs/dbraw/zinc/28/26/88/329282688.db2.gz HDCDHLDOPGOXEK-UHFFFAOYSA-N 1 3 292.492 3.618 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]CCCC2CCCCC2)C1 ZINC000395225070 329284636 /nfs/dbraw/zinc/28/46/36/329284636.db2.gz PKLKUNXGCMLUIX-QGZVFWFLSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CNCc2cccc(C3CC3)c2)cc1 ZINC000422554419 330149124 /nfs/dbraw/zinc/14/91/24/330149124.db2.gz MLBOGOJXACGLJV-CQSZACIVSA-N 1 3 280.415 3.874 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@H]1CCCC[C@H]1Cc1ccccc1 ZINC000422710422 330151363 /nfs/dbraw/zinc/15/13/63/330151363.db2.gz LFRNFSVKAUSAAO-LAQRGFTBSA-N 1 3 274.452 3.503 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H]1CCCC[C@H]1C(C)C ZINC000422708671 330151549 /nfs/dbraw/zinc/15/15/49/330151549.db2.gz CEWSQDCMCVLUIG-ZVZYQTTQSA-N 1 3 289.467 3.714 20 0 CHADHO Cc1[nH]c2c(cc(C)cc2CN[C@@H]2CC[NH2+]CC[C@H]2C)c1C ZINC000422735175 330152744 /nfs/dbraw/zinc/15/27/44/330152744.db2.gz DLYJUUXYDBBREF-FZKQIMNGSA-N 1 3 299.462 3.571 20 0 CHADHO Cc1ccc([C@H](C)CN[C@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000422756275 330153576 /nfs/dbraw/zinc/15/35/76/330153576.db2.gz GSTPSQQHCKQJCC-CCKFTAQKSA-N 1 3 280.415 3.833 20 0 CHADHO C[C@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc2ccccc21 ZINC000422763950 330154048 /nfs/dbraw/zinc/15/40/48/330154048.db2.gz PCEVIVKVCVLDRG-JTUUTPGSSA-N 1 3 280.415 3.773 20 0 CHADHO C[C@H](N[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1cccs1 ZINC000422766239 330154107 /nfs/dbraw/zinc/15/41/07/330154107.db2.gz RBCPHVJAWONDDL-NUEKZKHPSA-N 1 3 286.444 3.892 20 0 CHADHO C[C@@H](N[C@@H](C)c1cccc2ccccc21)[C@@H]1CCC[NH2+]C1 ZINC000422769026 330154259 /nfs/dbraw/zinc/15/42/59/330154259.db2.gz UHKDRIYIZCVQJV-HLLBOEOZSA-N 1 3 282.431 3.879 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)c1cccc2ccccc21)[C@@H]1CCCNC1 ZINC000422769026 330154261 /nfs/dbraw/zinc/15/42/61/330154261.db2.gz UHKDRIYIZCVQJV-HLLBOEOZSA-N 1 3 282.431 3.879 20 0 CHADHO C[C@H](C[NH2+][C@@H]1C[C@@H](N)c2ccccc21)Sc1ccccc1 ZINC000422778971 330154964 /nfs/dbraw/zinc/15/49/64/330154964.db2.gz BIKOBDMTFRAMTN-FSPWUOQZSA-N 1 3 298.455 3.902 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H](C)c1ccc(-c2ccncc2)cc1 ZINC000422804257 330155968 /nfs/dbraw/zinc/15/59/68/330155968.db2.gz FAHVYACSAMWVLX-RRFJBIMHSA-N 1 3 283.419 3.525 20 0 CHADHO C[C@@H](CN[C@@H](C)C[C@H](C)[NH3+])c1c(Cl)cccc1Cl ZINC000422882741 330158770 /nfs/dbraw/zinc/15/87/70/330158770.db2.gz TTXVCWYEGISGCA-DCAQKATOSA-N 1 3 289.250 3.812 20 0 CHADHO Fc1cccc([C@@H](N[C@@H]2CCC[NH2+]CC2)C2CCCC2)c1 ZINC000422879350 330158790 /nfs/dbraw/zinc/15/87/90/330158790.db2.gz VETIXEKFLCLOBT-MSOLQXFVSA-N 1 3 290.426 3.789 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H](c1cccc(F)c1)C1CCCC1 ZINC000422879409 330158822 /nfs/dbraw/zinc/15/88/22/330158822.db2.gz VIIHJNAKMYOQCD-AHIWAGSCSA-N 1 3 278.415 3.772 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NC[C@H](C)c1c(Cl)cccc1Cl ZINC000422882742 330158920 /nfs/dbraw/zinc/15/89/20/330158920.db2.gz TTXVCWYEGISGCA-GARJFASQSA-N 1 3 289.250 3.812 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H]1NCC1(c2ccc(Cl)cc2)CCCC1 ZINC000422882323 330158968 /nfs/dbraw/zinc/15/89/68/330158968.db2.gz RXAHXCGQXWQJNK-CVEARBPZSA-N 1 3 292.854 3.621 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCCc1cccc(-c2ccccc2)c1 ZINC000422883664 330159077 /nfs/dbraw/zinc/15/90/77/330159077.db2.gz CPYIZQBCEBCGQF-JKSUJKDBSA-N 1 3 282.431 3.612 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]CCc1cccc(-c2ccccc2)c1 ZINC000422883664 330159078 /nfs/dbraw/zinc/15/90/78/330159078.db2.gz CPYIZQBCEBCGQF-JKSUJKDBSA-N 1 3 282.431 3.612 20 0 CHADHO c1ccc2c(c1)CC[C@@H]2C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCCN1 ZINC000422910247 330159821 /nfs/dbraw/zinc/15/98/21/330159821.db2.gz PYGMSWZVAGIQOX-GSEOLPGOSA-N 1 3 298.474 3.617 20 0 CHADHO Cc1cccc(C2(C[NH2+][C@@H](C)C[C@H](C)N)CCCC2)c1 ZINC000422909419 330159855 /nfs/dbraw/zinc/15/98/55/330159855.db2.gz NZPBCNOQEDKEHO-HOTGVXAUSA-N 1 3 274.452 3.522 20 0 CHADHO Cc1cccc(C2(CN[C@@H](C)C[C@H](C)[NH3+])CCCC2)c1 ZINC000422909419 330159856 /nfs/dbraw/zinc/15/98/56/330159856.db2.gz NZPBCNOQEDKEHO-HOTGVXAUSA-N 1 3 274.452 3.522 20 0 CHADHO C[C@H](CCCC[NH3+])N[C@H](C)c1c(F)cccc1Cl ZINC000422923472 330160665 /nfs/dbraw/zinc/16/06/65/330160665.db2.gz WHJRBZGVQDIKSX-GHMZBOCLSA-N 1 3 272.795 3.647 20 0 CHADHO C[C@H](CCC[NH3+])N[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000422935101 330161543 /nfs/dbraw/zinc/16/15/43/330161543.db2.gz KPNPUYVOTGFABM-RDTXWAMCSA-N 1 3 286.394 3.632 20 0 CHADHO c1ccc(CC2(CN[C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)CC2)cc1 ZINC000422998907 330163555 /nfs/dbraw/zinc/16/35/55/330163555.db2.gz RPPZIFZHZSSZNY-IPMKNSEASA-N 1 3 298.474 3.520 20 0 CHADHO [NH3+][C@H]1C[C@H](NCC2(Cc3ccccc3)CC2)c2ccccc21 ZINC000422996447 330163586 /nfs/dbraw/zinc/16/35/86/330163586.db2.gz MDFMBAPNBFNUNB-OALUTQOASA-N 1 3 292.426 3.744 20 0 CHADHO COc1ccccc1[C@@H](N[C@@H](C)CCC[NH3+])c1ccccc1 ZINC000422958327 330164274 /nfs/dbraw/zinc/16/42/74/330164274.db2.gz PGSWXFJRHJPTSQ-KXBFYZLASA-N 1 3 298.430 3.502 20 0 CHADHO COc1ccccc1[C@H](N[C@@H](C)CCC[NH3+])c1ccccc1 ZINC000422958326 330164283 /nfs/dbraw/zinc/16/42/83/330164283.db2.gz PGSWXFJRHJPTSQ-HNAYVOBHSA-N 1 3 298.430 3.502 20 0 CHADHO Cc1ccc(CC[C@H](C)N[C@H]2C[C@@H]([NH3+])c3ccccc32)o1 ZINC000423008519 330165170 /nfs/dbraw/zinc/16/51/70/330165170.db2.gz SWSXZBMKFPFWCM-RZAIGCCYSA-N 1 3 284.403 3.644 20 0 CHADHO CC[C@H](CC(F)(F)F)N[C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000423037584 330166573 /nfs/dbraw/zinc/16/65/73/330166573.db2.gz MZTXQBGSVDGBEU-JHJVBQTASA-N 1 3 280.378 3.618 20 0 CHADHO Cc1oc2ccccc2c1CCN[C@@H]1CCCCC[C@H]1[NH3+] ZINC000423052942 330167365 /nfs/dbraw/zinc/16/73/65/330167365.db2.gz RMGRLLFKPBLXQR-IAGOWNOFSA-N 1 3 286.419 3.533 20 0 CHADHO C[C@H](N[C@@H](C)[C@H]1CCC[NH2+]C1)c1cc2ccccc2s1 ZINC000423063222 330168061 /nfs/dbraw/zinc/16/80/61/330168061.db2.gz WAHNGQMGLQRNDK-YDHLFZDLSA-N 1 3 288.460 3.940 20 0 CHADHO C[C@H]([NH2+][C@@H](C)[C@H]1CCCNC1)c1cc2ccccc2s1 ZINC000423063222 330168062 /nfs/dbraw/zinc/16/80/62/330168062.db2.gz WAHNGQMGLQRNDK-YDHLFZDLSA-N 1 3 288.460 3.940 20 0 CHADHO CC(C)[C@H]1C[C@@H](N[C@@H](C)C[C@H](C)[NH3+])c2ccccc21 ZINC000423088332 330169142 /nfs/dbraw/zinc/16/91/42/330169142.db2.gz RMNTUERPGLUAFA-WRFANHODSA-N 1 3 260.425 3.586 20 0 CHADHO [NH3+][C@@H]1C[C@H](NC[C@@H]2CCCC(F)(F)C2)c2ccccc21 ZINC000423114162 330170754 /nfs/dbraw/zinc/17/07/54/330170754.db2.gz LSGZYLUUPKQDNE-DFBGVHRSSA-N 1 3 280.362 3.546 20 0 CHADHO CC[C@H]1CC[C@H](N[C@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC000423121637 330171100 /nfs/dbraw/zinc/17/11/00/330171100.db2.gz AXQCVHODRQQNKQ-KFZJALRRSA-N 1 3 258.409 3.690 20 0 CHADHO [NH3+]C[C@H]1CCCC[C@H]1NCc1ccc2sccc2c1 ZINC000423121863 330171264 /nfs/dbraw/zinc/17/12/64/330171264.db2.gz JLIJOVGJAZRSEI-HUUCEWRRSA-N 1 3 274.433 3.508 20 0 CHADHO CC(F)(F)c1ccc(C[NH2+][C@H]2CCCCC[C@@H]2N)cc1 ZINC000423127295 330171551 /nfs/dbraw/zinc/17/15/51/330171551.db2.gz BUGZWXFMFLAHQV-GJZGRUSLSA-N 1 3 282.378 3.548 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC(C)(C)C(C)(C)C ZINC000423131812 330171928 /nfs/dbraw/zinc/17/19/28/330171928.db2.gz OLLXWWDOIPTNMF-LBPRGKRZSA-N 1 3 277.456 3.572 20 0 CHADHO C[C@@H](N)C[C@H](C)[NH2+]C1(Cc2ccc(Cl)cc2)CCC1 ZINC000423136549 330172097 /nfs/dbraw/zinc/17/20/97/330172097.db2.gz VGUVFNIJINQWJL-OLZOCXBDSA-N 1 3 280.843 3.521 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NC1(Cc2ccc(Cl)cc2)CCC1 ZINC000423136549 330172098 /nfs/dbraw/zinc/17/20/98/330172098.db2.gz VGUVFNIJINQWJL-OLZOCXBDSA-N 1 3 280.843 3.521 20 0 CHADHO C=Cc1ccc(CCN[C@@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000423141625 330172641 /nfs/dbraw/zinc/17/26/41/330172641.db2.gz QYDOMHBVJDFSLG-RBUKOAKNSA-N 1 3 278.399 3.607 20 0 CHADHO C=Cc1ccc(CCN[C@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000423141624 330172671 /nfs/dbraw/zinc/17/26/71/330172671.db2.gz QYDOMHBVJDFSLG-OALUTQOASA-N 1 3 278.399 3.607 20 0 CHADHO C[C@H](CCCc1cccnc1)N[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423171748 330174418 /nfs/dbraw/zinc/17/44/18/330174418.db2.gz PVZPFEOLTXBXDA-MDASCCDHSA-N 1 3 295.430 3.527 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@H](c2cccc(Cl)c2)C1)C1CNC1 ZINC000423170774 330174533 /nfs/dbraw/zinc/17/45/33/330174533.db2.gz YUSQGCXGKWRRMW-RVSPLBMKSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@H](CCCc1cccnc1)N[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423171747 330174586 /nfs/dbraw/zinc/17/45/86/330174586.db2.gz PVZPFEOLTXBXDA-CCKFTAQKSA-N 1 3 295.430 3.527 20 0 CHADHO CC[C@@H]([NH2+]CC1(N)CCCCC1)c1cccc(F)c1 ZINC000423176302 330174872 /nfs/dbraw/zinc/17/48/72/330174872.db2.gz GNDOWQRQLGRIIX-OAHLLOKOSA-N 1 3 264.388 3.528 20 0 CHADHO Cc1cccc(COc2ccc([C@H](C)NCCC[NH3+])cc2)c1 ZINC000423178101 330175124 /nfs/dbraw/zinc/17/51/24/330175124.db2.gz KBZXIOVGQUSTAL-INIZCTEOSA-N 1 3 298.430 3.573 20 0 CHADHO C[C@H]([NH2+]C1CCNCC1)c1ccc(-c2ccccc2)s1 ZINC000423193027 330176005 /nfs/dbraw/zinc/17/60/05/330176005.db2.gz WGFAWUQORFEKOB-ZDUSSCGKSA-N 1 3 286.444 3.818 20 0 CHADHO C[C@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@@H](C)c1ccc(Cl)cc1 ZINC000423212801 330178259 /nfs/dbraw/zinc/17/82/59/330178259.db2.gz KALZMWAFLCEBHU-ANVOZQLFSA-N 1 3 292.854 3.705 20 0 CHADHO CCCC[C@@H](NC[C@H]1CCC[NH2+]C1)c1ccccc1 ZINC000423215353 330178296 /nfs/dbraw/zinc/17/82/96/330178296.db2.gz QMEUYMNGWHZYAC-DOTOQJQBSA-N 1 3 260.425 3.507 20 0 CHADHO CCCC[C@@H]([NH2+]C[C@H]1CCCNC1)c1ccccc1 ZINC000423215353 330178297 /nfs/dbraw/zinc/17/82/97/330178297.db2.gz QMEUYMNGWHZYAC-DOTOQJQBSA-N 1 3 260.425 3.507 20 0 CHADHO C[C@@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@H](C)c1ccc(Cl)cc1 ZINC000423212802 330178441 /nfs/dbraw/zinc/17/84/41/330178441.db2.gz KALZMWAFLCEBHU-UPKMFQHCSA-N 1 3 292.854 3.705 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)[C@@H]1CCCNC1)[C@@H](C)c1ccc(Cl)cc1 ZINC000423219592 330179301 /nfs/dbraw/zinc/17/93/01/330179301.db2.gz UJZHWWZFJKJFNG-HGTKMLMNSA-N 1 3 294.870 3.810 20 0 CHADHO CCC[C@H](N[C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(OC)cc1 ZINC000423221950 330179700 /nfs/dbraw/zinc/17/97/00/330179700.db2.gz YUVPNGZTJOOLRJ-LESCRADOSA-N 1 3 290.451 3.514 20 0 CHADHO CCC[C@H]([NH2+][C@@H](C)[C@@H]1CCCNC1)c1ccc(OC)cc1 ZINC000423221950 330179701 /nfs/dbraw/zinc/17/97/01/330179701.db2.gz YUVPNGZTJOOLRJ-LESCRADOSA-N 1 3 290.451 3.514 20 0 CHADHO C[C@H]([NH3+])CCN[C@@H](CCc1ccccc1)c1ccccc1 ZINC000423225979 330180239 /nfs/dbraw/zinc/18/02/39/330180239.db2.gz OYXNEORYPVDFHO-LPHOPBHVSA-N 1 3 282.431 3.687 20 0 CHADHO CC[C@@H](NCC[C@H](C)[NH3+])c1ccc(Cl)c(Cl)c1 ZINC000423231504 330180573 /nfs/dbraw/zinc/18/05/73/330180573.db2.gz LJOSPXXWKXNESM-TVQRCGJNSA-N 1 3 275.223 3.771 20 0 CHADHO C[C@H](NCC[C@@H]1CC[NH2+]C1)c1cc(Cl)sc1Cl ZINC000423254509 330183217 /nfs/dbraw/zinc/18/32/17/330183217.db2.gz YGWOSMNXERRBQN-IUCAKERBSA-N 1 3 293.263 3.705 20 0 CHADHO Cc1nc(C(C)C)sc1[C@H](C)N[C@@H]1CCCC[C@@H]1C[NH3+] ZINC000423270938 330184476 /nfs/dbraw/zinc/18/44/76/330184476.db2.gz HAEHNDHCZCNDAV-IACUBPJLSA-N 1 3 295.496 3.743 20 0 CHADHO CSc1ccccc1[C@H](C)N[C@@H]1CCCC[C@H]1C[NH3+] ZINC000423275019 330184682 /nfs/dbraw/zinc/18/46/82/330184682.db2.gz LHGFBAOIWPAIFU-KCQAQPDRSA-N 1 3 278.465 3.577 20 0 CHADHO C[C@H](N[C@H]1CCCC[C@H]1C[NH3+])c1ccc(F)c(Cl)c1 ZINC000423281991 330185806 /nfs/dbraw/zinc/18/58/06/330185806.db2.gz VQMQTKNROHZYPG-WBIUFABUSA-N 1 3 284.806 3.647 20 0 CHADHO C[C@@H]([NH2+]CC(C)(C)N)c1ccc(OCc2ccccc2)cc1 ZINC000423287500 330186005 /nfs/dbraw/zinc/18/60/05/330186005.db2.gz MRJYXXRVWPZIQU-OAHLLOKOSA-N 1 3 298.430 3.654 20 0 CHADHO CC(C)([NH3+])CN[C@@H]1CCC[C@H](c2cccc(Cl)c2)C1 ZINC000423286660 330186151 /nfs/dbraw/zinc/18/61/51/330186151.db2.gz IAJORBBHTIXZIZ-DZGCQCFKSA-N 1 3 280.843 3.693 20 0 CHADHO CCC([NH3+])(CC)CN[C@@H]1C[C@H](c2ccccc2)C1(C)C ZINC000423290358 330186797 /nfs/dbraw/zinc/18/67/97/330186797.db2.gz ZTYMNNZRUHHIGI-HZPDHXFCSA-N 1 3 274.452 3.676 20 0 CHADHO COc1ccsc1[C@H](C)NCc1ccc([C@@H](C)[NH3+])cc1 ZINC000423291532 330187262 /nfs/dbraw/zinc/18/72/62/330187262.db2.gz ISUOFWWAGSTTAZ-NEPJUHHUSA-N 1 3 290.432 3.627 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2ccc(F)c(F)c2)cc1 ZINC000423293181 330187582 /nfs/dbraw/zinc/18/75/82/330187582.db2.gz QCSWTPQKMULJDQ-VXGBXAGGSA-N 1 3 290.357 3.835 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2cccs2)cc1 ZINC000423293200 330187707 /nfs/dbraw/zinc/18/77/07/330187707.db2.gz QGODFZZKUSYPIV-RYUDHWBXSA-N 1 3 260.406 3.619 20 0 CHADHO Cc1nc(C)c([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)s1 ZINC000423292839 330187792 /nfs/dbraw/zinc/18/77/92/330187792.db2.gz ORATZSGWEYHZOP-MNOVXSKESA-N 1 3 289.448 3.630 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc(F)cc2)cc1 ZINC000423294506 330188066 /nfs/dbraw/zinc/18/80/66/330188066.db2.gz UNEGSEVDRXJRTH-STQMWFEESA-N 1 3 272.367 3.696 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@H]2CCCc3ccccc32)cc1 ZINC000423294971 330188195 /nfs/dbraw/zinc/18/81/95/330188195.db2.gz VXDSSQFYGOLOOJ-LIRRHRJNSA-N 1 3 280.415 3.874 20 0 CHADHO C[C@H](C[NH3+])CN[C@@H](c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000423296957 330188668 /nfs/dbraw/zinc/18/86/68/330188668.db2.gz ICBGMYYTDOLVPJ-YMTOWFKASA-N 1 3 287.234 3.629 20 0 CHADHO CC[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccccc1OC ZINC000423296827 330188674 /nfs/dbraw/zinc/18/86/74/330188674.db2.gz ZZVWXQDHJZRTLS-KDOFPFPSSA-N 1 3 298.430 3.956 20 0 CHADHO CC(C)[C@H](NC[C@H](C)C[NH3+])c1ccc(C(F)(F)F)cc1 ZINC000423310614 330189520 /nfs/dbraw/zinc/18/95/20/330189520.db2.gz SCGLXJBMRFOUEP-RISCZKNCSA-N 1 3 288.357 3.587 20 0 CHADHO N[C@@H](C[NH2+][C@@H](c1ccc(Cl)c(Cl)c1)C1CC1)C1CC1 ZINC000423313177 330189838 /nfs/dbraw/zinc/18/98/38/330189838.db2.gz FGWSNIGBKHQCOE-LSDHHAIUSA-N 1 3 299.245 3.771 20 0 CHADHO Clc1ccc([C@@H]2CCCCC[C@H]2[NH2+]CC2CNC2)cc1 ZINC000423336613 330191780 /nfs/dbraw/zinc/19/17/80/330191780.db2.gz XWLARWRSIGNFJW-DLBZAZTESA-N 1 3 292.854 3.565 20 0 CHADHO CC(C)[C@H](NCC1=CC[NH2+]CC1)c1cc2ccccc2o1 ZINC000423347392 330192528 /nfs/dbraw/zinc/19/25/28/330192528.db2.gz QHNSXFNZKXZLQY-SFHVURJKSA-N 1 3 284.403 3.639 20 0 CHADHO C[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1cccc(Cl)c1 ZINC000423357205 330193318 /nfs/dbraw/zinc/19/33/18/330193318.db2.gz LUGSCYOXWUBIGL-GFCCVEGCSA-N 1 3 286.806 3.794 20 0 CHADHO c1ccc2c(c1)SCC[C@@H]2NCc1ccc2c(c1)C[NH2+]C2 ZINC000423358517 330193640 /nfs/dbraw/zinc/19/36/40/330193640.db2.gz NSCIUPDOMSUYLQ-KRWDZBQOSA-N 1 3 296.439 3.617 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@H](Cc2ccccc2Cl)C2CC2)C1 ZINC000423360966 330193787 /nfs/dbraw/zinc/19/37/87/330193787.db2.gz GILUCECUHZKJHF-HLLBOEOZSA-N 1 3 292.854 3.521 20 0 CHADHO C[C@@H](CCc1ccccc1F)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423363584 330193868 /nfs/dbraw/zinc/19/38/68/330193868.db2.gz ABAAXOXOPQXZSI-AWEZNQCLSA-N 1 3 298.405 3.540 20 0 CHADHO C[C@@H](NCC[C@H]1CCC[NH2+]1)c1cccc2ccccc21 ZINC000423363286 330193937 /nfs/dbraw/zinc/19/39/37/330193937.db2.gz NVJHKJFKOMFPSU-GDBMZVCRSA-N 1 3 268.404 3.633 20 0 CHADHO C[C@H](NCC[C@H]1CCC[NH2+]1)c1cccc2ccccc21 ZINC000423363287 330193991 /nfs/dbraw/zinc/19/39/91/330193991.db2.gz NVJHKJFKOMFPSU-GOEBONIOSA-N 1 3 268.404 3.633 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@H](CC2CCC2)c2ccccc2)CCN1 ZINC000423362900 330194127 /nfs/dbraw/zinc/19/41/27/330194127.db2.gz ABJFTNIAMMHJLE-FHLIZLRMSA-N 1 3 272.436 3.648 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCNC[C@H]1C)c1ccccc1C(C)(C)C ZINC000423363901 330194154 /nfs/dbraw/zinc/19/41/54/330194154.db2.gz CCSKBFBZPCRKGE-JKIFEVAISA-N 1 3 274.452 3.633 20 0 CHADHO N[C@H]1CCC[C@H]([NH2+]C2CCC3(CCCCC3)CC2)C1 ZINC000423364839 330194266 /nfs/dbraw/zinc/19/42/66/330194266.db2.gz JYNMMQXPIMYWRJ-HOCLYGCPSA-N 1 3 264.457 3.739 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](N[C@@H]2CCCc3c(Cl)cccc32)C1 ZINC000423364388 330194272 /nfs/dbraw/zinc/19/42/72/330194272.db2.gz AMOVIXHGYNHUGV-BFQNTYOBSA-N 1 3 278.827 3.577 20 0 CHADHO N[C@@H]1CCC[C@@H]([NH2+]C2CCC3(CCCCC3)CC2)C1 ZINC000423364834 330194414 /nfs/dbraw/zinc/19/44/14/330194414.db2.gz JYNMMQXPIMYWRJ-GDBMZVCRSA-N 1 3 264.457 3.739 20 0 CHADHO CC(C)[C@H](CCc1ccccc1)[NH2+][C@@H]1CCC[C@@H](N)C1 ZINC000423372212 330195309 /nfs/dbraw/zinc/19/53/09/330195309.db2.gz GXDOVDXIJDPDOV-KURKYZTESA-N 1 3 274.452 3.503 20 0 CHADHO Clc1ccc2c(c1)[C@H](NCc1ccc3c(c1)C[NH2+]C3)CC2 ZINC000423372076 330195348 /nfs/dbraw/zinc/19/53/48/330195348.db2.gz GQMSLAHKXUVHJC-GOSISDBHSA-N 1 3 298.817 3.720 20 0 CHADHO C[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)c1cccc(-c2ccncc2)c1 ZINC000423372948 330195362 /nfs/dbraw/zinc/19/53/62/330195362.db2.gz HKRNZOBCYMSKNZ-KYNGSXCRSA-N 1 3 295.430 3.669 20 0 CHADHO C[C@@H]([NH2+]Cc1ccc2c(c1)CNC2)[C@@H]1C[C@H]1c1ccccc1 ZINC000423396815 330195621 /nfs/dbraw/zinc/19/56/21/330195621.db2.gz SRHNWFGDTDYHSG-UAOJZALGSA-N 1 3 292.426 3.572 20 0 CHADHO CCC[C@@H]([NH2+]C[C@H](N)C1CC1)c1ccc(Cl)cc1 ZINC000423325552 330195665 /nfs/dbraw/zinc/19/56/65/330195665.db2.gz QECHFYQMCDITRD-LSDHHAIUSA-N 1 3 266.816 3.508 20 0 CHADHO CCCC[C@H](C)[C@H](C)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423398247 330195855 /nfs/dbraw/zinc/19/58/55/330195855.db2.gz UGPZYZXIPVRODH-KBPBESRZSA-N 1 3 260.425 3.594 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)N[C@H]1CC[NH2+]C[C@@H]1C ZINC000423401992 330196226 /nfs/dbraw/zinc/19/62/26/330196226.db2.gz RCMLIJODYBOMEO-SZMVWBNQSA-N 1 3 274.452 3.670 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)[NH2+][C@H]1CCNC[C@@H]1C ZINC000423401992 330196227 /nfs/dbraw/zinc/19/62/27/330196227.db2.gz RCMLIJODYBOMEO-SZMVWBNQSA-N 1 3 274.452 3.670 20 0 CHADHO CC(C)c1nc([C@@H](C)NC[C@H]2CC[C@H](C[NH3+])CC2)cs1 ZINC000423426920 330198316 /nfs/dbraw/zinc/19/83/16/330198316.db2.gz PSMFPLPNTWFSPU-MGPQQGTHSA-N 1 3 295.496 3.682 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCN[C@@H](C)C1)c1cccc(Cl)c1 ZINC000423383194 330199137 /nfs/dbraw/zinc/19/91/37/330199137.db2.gz PGEXXCFVDVUPOL-CQDKDKBSSA-N 1 3 266.816 3.521 20 0 CHADHO C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423381968 330199292 /nfs/dbraw/zinc/19/92/92/330199292.db2.gz JQIXWSXGMMZJCB-DYVFJYSZSA-N 1 3 272.436 3.594 20 0 CHADHO C[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1cc2c(s1)CCC2 ZINC000423385020 330199470 /nfs/dbraw/zinc/19/94/70/330199470.db2.gz LGODDTCZWYRAAC-GFCCVEGCSA-N 1 3 298.455 3.691 20 0 CHADHO C[C@@H]([NH2+][C@H]1CCN[C@H](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423388660 330199877 /nfs/dbraw/zinc/19/98/77/330199877.db2.gz UNHGCUUDRHENTE-NAWOPXAZSA-N 1 3 298.883 3.624 20 0 CHADHO C[C@@H](N[C@H]1CC[NH2+][C@H](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423388660 330199878 /nfs/dbraw/zinc/19/98/78/330199878.db2.gz UNHGCUUDRHENTE-NAWOPXAZSA-N 1 3 298.883 3.624 20 0 CHADHO c1cc(C[NH2+][C@@H]2CCCC23CCCCC3)cc2c1CNC2 ZINC000423393121 330200762 /nfs/dbraw/zinc/20/07/62/330200762.db2.gz QLCFLTXSJXZJTM-GOSISDBHSA-N 1 3 284.447 3.882 20 0 CHADHO COc1ccccc1-c1ccc([C@H](C)[NH2+][C@H](C)[C@H](C)N)cc1 ZINC000423436614 330201387 /nfs/dbraw/zinc/20/13/87/330201387.db2.gz FKHVSCRAOZTZRS-ZNMIVQPWSA-N 1 3 298.430 3.749 20 0 CHADHO C[C@H](N)[C@H](C)[NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000423453506 330203175 /nfs/dbraw/zinc/20/31/75/330203175.db2.gz XSVBKBFLGZOWAP-KKUMJFAQSA-N 1 3 268.404 3.740 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H](N)CC)c1ccc(Cl)c(Cl)c1 ZINC000423461101 330204027 /nfs/dbraw/zinc/20/40/27/330204027.db2.gz JJWKCKHIFZAWFE-GXFFZTMASA-N 1 3 275.223 3.771 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H]1CNCC[C@@H]1c1ccc(F)cc1)C(C)C ZINC000423472780 330205244 /nfs/dbraw/zinc/20/52/44/330205244.db2.gz NFWZUNPXTYQVJL-CGTJXYLNSA-N 1 3 292.442 3.543 20 0 CHADHO C[C@@H](NCCC[C@@H]1CCC[NH2+]1)c1ccccc1Cl ZINC000423486460 330206743 /nfs/dbraw/zinc/20/67/43/330206743.db2.gz SUOCMTCNFGMIDY-CHWSQXEVSA-N 1 3 266.816 3.523 20 0 CHADHO [NH3+]CCC[C@@H](N[C@@H]1CCc2c1cccc2F)c1ccccc1 ZINC000423495786 330207801 /nfs/dbraw/zinc/20/78/01/330207801.db2.gz CQJKQVDTWBMKBH-RTBURBONSA-N 1 3 298.405 3.883 20 0 CHADHO C[C@H](N[C@H](CCC[NH3+])c1ccccc1)c1ccc(F)cc1 ZINC000423496881 330207805 /nfs/dbraw/zinc/20/78/05/330207805.db2.gz FRZGMDMNUJKTMU-KBXCAEBGSA-N 1 3 286.394 3.957 20 0 CHADHO Cc1ccnc([C@H](C)N[C@H](CCC[NH3+])c2ccccc2)c1 ZINC000423501344 330208556 /nfs/dbraw/zinc/20/85/56/330208556.db2.gz CRKHJYQYLJMZFB-DOTOQJQBSA-N 1 3 283.419 3.521 20 0 CHADHO [NH3+]CCC[C@@H](N[C@@H]1CCc2cc(F)ccc21)c1ccccc1 ZINC000423513675 330209387 /nfs/dbraw/zinc/20/93/87/330209387.db2.gz VOYMUUADKMWFFA-RTBURBONSA-N 1 3 298.405 3.883 20 0 CHADHO [NH3+]CCC[C@@H](N[C@@H]1CCCc2occc21)c1ccccc1 ZINC000423521050 330209996 /nfs/dbraw/zinc/20/99/96/330209996.db2.gz RXGDYBKSVRBBPQ-IAGOWNOFSA-N 1 3 284.403 3.727 20 0 CHADHO C[C@@H]([NH2+]CCCNC1CC1)c1ccc(F)c2ccccc21 ZINC000423543837 330211168 /nfs/dbraw/zinc/21/11/68/330211168.db2.gz CFMHVHLUJBWUEK-CYBMUJFWSA-N 1 3 286.394 3.772 20 0 CHADHO C[C@@H]([NH2+]CCCNC1CC1)[C@@H](C)c1ccc(Cl)cc1 ZINC000423550947 330211704 /nfs/dbraw/zinc/21/17/04/330211704.db2.gz IUJYRCSAIRSTPX-CHWSQXEVSA-N 1 3 280.843 3.564 20 0 CHADHO Cc1cccc([C@@H]([NH2+]CC2=CCN(C)CC2)C(C)C)c1 ZINC000527876413 330291212 /nfs/dbraw/zinc/29/12/12/330291212.db2.gz NGDQLXFAYMEBII-SFHVURJKSA-N 1 3 272.436 3.544 20 0 CHADHO CC(C)c1cccc([C@@H](C)[NH2+]CC2=CCN(C)CC2)c1 ZINC000527876399 330291231 /nfs/dbraw/zinc/29/12/31/330291231.db2.gz NAZPPHSMFPVKGP-OAHLLOKOSA-N 1 3 272.436 3.723 20 0 CHADHO C[C@H]1CCCCN1CCC[NH2+]C1CC(c2ccccc2)C1 ZINC000036840387 330291985 /nfs/dbraw/zinc/29/19/85/330291985.db2.gz WIOGACNMNSUSDK-IVMQYODDSA-N 1 3 286.463 3.787 20 0 CHADHO C[C@H]1CCCC[N@@H+]1CCCNC1CC(c2ccccc2)C1 ZINC000036840387 330291986 /nfs/dbraw/zinc/29/19/86/330291986.db2.gz WIOGACNMNSUSDK-IVMQYODDSA-N 1 3 286.463 3.787 20 0 CHADHO C[C@H]1CCCC[N@H+]1CCCNC1CC(c2ccccc2)C1 ZINC000036840387 330291987 /nfs/dbraw/zinc/29/19/87/330291987.db2.gz WIOGACNMNSUSDK-IVMQYODDSA-N 1 3 286.463 3.787 20 0 CHADHO CC(C)Cc1ccc([C@@H](C)NC[C@H]2CCC[N@H+](C)C2)cc1 ZINC000044534594 330330033 /nfs/dbraw/zinc/33/00/33/330330033.db2.gz FHZWOOBSUGIPED-SJLPKXTDSA-N 1 3 288.479 3.878 20 0 CHADHO CC(C)Cc1ccc([C@@H](C)NC[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000044534594 330330034 /nfs/dbraw/zinc/33/00/34/330330034.db2.gz FHZWOOBSUGIPED-SJLPKXTDSA-N 1 3 288.479 3.878 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)NCc1cc(C)ccc1F ZINC000116911904 330361349 /nfs/dbraw/zinc/36/13/49/330361349.db2.gz JDZQCDRHCCHJFE-HNNXBMFYSA-N 1 3 280.431 3.734 20 0 CHADHO CCN1CC[C@@H]([NH2+]Cc2ccc(C)cc2SC)[C@H](C)C1 ZINC000119271493 330371489 /nfs/dbraw/zinc/37/14/89/330371489.db2.gz DMQBWLNZMZSTTH-GDBMZVCRSA-N 1 3 292.492 3.537 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](c2ccc(F)c(C)c2)C2CC2)C1 ZINC000536948469 330373197 /nfs/dbraw/zinc/37/31/97/330373197.db2.gz UMGWULUHYFZVDP-KBXCAEBGSA-N 1 3 290.426 3.517 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@@H](c2ccc(F)c(C)c2)C2CC2)C1 ZINC000536948469 330373198 /nfs/dbraw/zinc/37/31/98/330373198.db2.gz UMGWULUHYFZVDP-KBXCAEBGSA-N 1 3 290.426 3.517 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@@H](c2ccc(F)c(C)c2)C2CC2)C1 ZINC000536948469 330373199 /nfs/dbraw/zinc/37/31/99/330373199.db2.gz UMGWULUHYFZVDP-KBXCAEBGSA-N 1 3 290.426 3.517 20 0 CHADHO C[C@H]1CC[C@@H](N[C@@H]2C[C@H](C)[N@@H+](C)C[C@@H]2C)c2ccccc21 ZINC000090796136 330396284 /nfs/dbraw/zinc/39/62/84/330396284.db2.gz WWORSJKFUUTNEC-ZZGLYJMHSA-N 1 3 286.463 3.943 20 0 CHADHO C[C@H]1CC[C@@H](N[C@@H]2C[C@H](C)[N@H+](C)C[C@@H]2C)c2ccccc21 ZINC000090796136 330396285 /nfs/dbraw/zinc/39/62/85/330396285.db2.gz WWORSJKFUUTNEC-ZZGLYJMHSA-N 1 3 286.463 3.943 20 0 CHADHO CC[C@H](Cc1ccc(Cl)cc1)[NH2+][C@H]1CCC[C@@H](N)C1 ZINC000516492197 330493715 /nfs/dbraw/zinc/49/37/15/330493715.db2.gz UOUQWQIFMUCJSV-OAGGEKHMSA-N 1 3 280.843 3.521 20 0 CHADHO CCC[C@H]1CCC[C@H]1[NH2+]Cc1cccc(CN(C)C)c1 ZINC000433153840 330618452 /nfs/dbraw/zinc/61/84/52/330618452.db2.gz XRBFDFJZDSYTAQ-ZWKOTPCHSA-N 1 3 274.452 3.807 20 0 CHADHO C1CC2(C1)CCC[C@H]2[NH2+]C1CCN(C2CCCC2)CC1 ZINC000449189873 330904946 /nfs/dbraw/zinc/90/49/46/330904946.db2.gz VHDDPFCYAVJDEZ-QGZVFWFLSA-N 1 3 276.468 3.706 20 0 CHADHO C[C@@H](CC(C)(C)C)[NH2+]CC1CCN(c2ccncc2)CC1 ZINC000449253374 330909957 /nfs/dbraw/zinc/90/99/57/330909957.db2.gz SUBOMWCAEMEATN-HNNXBMFYSA-N 1 3 289.467 3.712 20 0 CHADHO CCN(CC)C[C@H]1CCCC[C@@H]1[NH2+]CC1CC(F)(F)C1 ZINC000450767742 330999044 /nfs/dbraw/zinc/99/90/44/330999044.db2.gz VUMSRGRCSZXRMO-CABCVRRESA-N 1 3 288.426 3.522 20 0 CHADHO CCC[C@H]([NH2+]C[C@H]1CCN(CCC)C1)C(C)(C)C ZINC000453086554 331087932 /nfs/dbraw/zinc/08/79/32/331087932.db2.gz HZQQKHDVCGYYHF-CABCVRRESA-N 1 3 254.462 3.523 20 0 CHADHO CC[C@@H](N[C@@H](CC(C)C)C[NH+]1CCCC1)c1ccncc1 ZINC000453259625 331108557 /nfs/dbraw/zinc/10/85/57/331108557.db2.gz QHYHKZFMZZRJLJ-ZWKOTPCHSA-N 1 3 289.467 3.633 20 0 CHADHO CN1CCC[C@H]1CC[N@H+](C)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463437923 331347789 /nfs/dbraw/zinc/34/77/89/331347789.db2.gz VABNKIJHXFHWFB-MJBXVCDLSA-N 1 3 292.389 3.524 20 0 CHADHO CN1CCC[C@H]1CC[N@@H+](C)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463437923 331347790 /nfs/dbraw/zinc/34/77/90/331347790.db2.gz VABNKIJHXFHWFB-MJBXVCDLSA-N 1 3 292.389 3.524 20 0 CHADHO Clc1cccc(C2(NC[C@@H]3CCC[NH2+]C3)CCCC2)c1 ZINC000469985627 331468690 /nfs/dbraw/zinc/46/86/90/331468690.db2.gz PIJTZNGMMVQCBT-CQSZACIVSA-N 1 3 292.854 3.699 20 0 CHADHO C[C@@H](C[NH2+]C[C@@H](C)c1cccc(Cl)c1)CN1CCCC1 ZINC000470195983 331474973 /nfs/dbraw/zinc/47/49/73/331474973.db2.gz ROYHHAOREJLCBB-LSDHHAIUSA-N 1 3 294.870 3.765 20 0 CHADHO CC(C)(C[NH2+][C@H]1CCC[C@@H](C2CC2)C1)CN1CCCC1 ZINC000477939249 331695072 /nfs/dbraw/zinc/69/50/72/331695072.db2.gz FENCSMBWDPVUHC-SJORKVTESA-N 1 3 278.484 3.667 20 0 CHADHO CC[NH+](CC)CC1CCN([C@@H](C)c2ccc(F)cc2)CC1 ZINC000488389763 332003679 /nfs/dbraw/zinc/00/36/79/332003679.db2.gz KTSFFLUADONHSV-HNNXBMFYSA-N 1 3 292.442 3.941 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+][C@H]1CS[C@H](C(C)(C)C)C1 ZINC000488433279 332007661 /nfs/dbraw/zinc/00/76/61/332007661.db2.gz HQRDMIPDTBKDQM-OAGGEKHMSA-N 1 3 298.540 3.761 20 0 CHADHO C[C@@H]1CCCC[N@@H+]1CCCN[C@H]1CS[C@H](C(C)(C)C)C1 ZINC000488433279 332007662 /nfs/dbraw/zinc/00/76/62/332007662.db2.gz HQRDMIPDTBKDQM-OAGGEKHMSA-N 1 3 298.540 3.761 20 0 CHADHO C[C@@H]1CCCC[N@H+]1CCCN[C@H]1CS[C@H](C(C)(C)C)C1 ZINC000488433279 332007664 /nfs/dbraw/zinc/00/76/64/332007664.db2.gz HQRDMIPDTBKDQM-OAGGEKHMSA-N 1 3 298.540 3.761 20 0 CHADHO C[C@@H]([NH2+]C1CCC2(CC2)CC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000488508867 332014632 /nfs/dbraw/zinc/01/46/32/332014632.db2.gz UNYIZGSNWATALE-HZPDHXFCSA-N 1 3 290.495 3.952 20 0 CHADHO CC[C@@H]1C[C@H](C)CN1CCC[N@@H+]1C[C@@H](C)C[C@H]1CC ZINC000489296638 332045915 /nfs/dbraw/zinc/04/59/15/332045915.db2.gz SKGPLVRTXLAOLG-MWDXBVQZSA-N 1 3 266.473 3.617 20 0 CHADHO CC[C@@H]1C[C@H](C)CN1CCC[N@H+]1C[C@@H](C)C[C@H]1CC ZINC000489296638 332045916 /nfs/dbraw/zinc/04/59/16/332045916.db2.gz SKGPLVRTXLAOLG-MWDXBVQZSA-N 1 3 266.473 3.617 20 0 CHADHO C/C(=C\c1ccc(Cl)cc1)CNC[C@@H](C)C[NH+](C)C ZINC000491597879 332242155 /nfs/dbraw/zinc/24/21/55/332242155.db2.gz ZZMFTZDJWZBPEY-KADHNRKRSA-N 1 3 280.843 3.531 20 0 CHADHO C/C(=C\c1ccc(Cl)cc1)C[NH2+]C[C@@H](C)CN(C)C ZINC000491597879 332242157 /nfs/dbraw/zinc/24/21/57/332242157.db2.gz ZZMFTZDJWZBPEY-KADHNRKRSA-N 1 3 280.843 3.531 20 0 CHADHO C[C@@H](CCC[NH3+])N[C@@H](C)c1ccc(Cl)cc1Cl ZINC000336679798 335111615 /nfs/dbraw/zinc/11/16/15/335111615.db2.gz DHXVLCJNKDXPLV-UWVGGRQHSA-N 1 3 275.223 3.771 20 0 CHADHO CC[C@@H](C)C[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000309878672 333050621 /nfs/dbraw/zinc/05/06/21/333050621.db2.gz VDLVGKRSNXWFRE-IEBWSBKVSA-N 1 3 288.479 3.924 20 0 CHADHO CN(C/C=C/C[N@H+](C)Cc1ccccc1)Cc1ccccc1 ZINC000514077808 333064986 /nfs/dbraw/zinc/06/49/86/333064986.db2.gz ZYMSXEPOQNNKKC-MDZDMXLPSA-N 1 3 294.442 3.807 20 0 CHADHO CN(C/C=C/C[N@@H+](C)Cc1ccccc1)Cc1ccccc1 ZINC000514077808 333064988 /nfs/dbraw/zinc/06/49/88/333064988.db2.gz ZYMSXEPOQNNKKC-MDZDMXLPSA-N 1 3 294.442 3.807 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@H]2NC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000186104837 333154923 /nfs/dbraw/zinc/15/49/23/333154923.db2.gz XWMDNTQVDOHRPN-VQIMIIECSA-N 1 3 298.474 3.755 20 0 CHADHO Cc1ccc(C)c2c1CCC[C@H]2NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000186104837 333154924 /nfs/dbraw/zinc/15/49/24/333154924.db2.gz XWMDNTQVDOHRPN-VQIMIIECSA-N 1 3 298.474 3.755 20 0 CHADHO CC1(C)CC([NH2+][C@@H]2CCC23CCCC3)CC(C)(C)N1 ZINC000189043861 333179020 /nfs/dbraw/zinc/17/90/20/333179020.db2.gz USYCDLCQNHJJIW-CQSZACIVSA-N 1 3 264.457 3.608 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H](C)Cc1ccc(Cl)cc1 ZINC000223011715 333203459 /nfs/dbraw/zinc/20/34/59/333203459.db2.gz HWYKTMRWQWNIRD-AWEZNQCLSA-N 1 3 282.859 3.593 20 0 CHADHO CC[NH+](CC)CCCN[C@@H](C)Cc1ccc(Cl)cc1 ZINC000223011715 333203460 /nfs/dbraw/zinc/20/34/60/333203460.db2.gz HWYKTMRWQWNIRD-AWEZNQCLSA-N 1 3 282.859 3.593 20 0 CHADHO Cc1c[nH+]ccc1N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000192669735 333237571 /nfs/dbraw/zinc/23/75/71/333237571.db2.gz OEPSFQIUQNBUPY-AEFFLSMTSA-N 1 3 295.430 3.855 20 0 CHADHO CCCN1CCC([NH2+]Cc2ccc(C)c(Cl)c2)CC1 ZINC000233020640 333347270 /nfs/dbraw/zinc/34/72/70/333347270.db2.gz MTEPTICIODUSKS-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(CC2CCCC2)C1 ZINC000524356424 333360588 /nfs/dbraw/zinc/36/05/88/333360588.db2.gz OBNCLYCAXKJPHS-WMZOPIPTSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(CC2CCCC2)C1 ZINC000524356424 333360589 /nfs/dbraw/zinc/36/05/89/333360589.db2.gz OBNCLYCAXKJPHS-WMZOPIPTSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@H]1CCCCN1C[C@H]1CCC[N@H+](CC2CCCC2)C1 ZINC000524356424 333360590 /nfs/dbraw/zinc/36/05/90/333360590.db2.gz OBNCLYCAXKJPHS-WMZOPIPTSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@H]1CCCCN1C[C@H]1CCC[N@@H+](CC2CCCC2)C1 ZINC000524356424 333360591 /nfs/dbraw/zinc/36/05/91/333360591.db2.gz OBNCLYCAXKJPHS-WMZOPIPTSA-N 1 3 278.484 3.763 20 0 CHADHO Cc1cccc([C@H](C)NCc2ccc(C[NH+](C)C)cc2)c1 ZINC000173823656 335141642 /nfs/dbraw/zinc/14/16/42/335141642.db2.gz GTFWMRUJHAZEIG-INIZCTEOSA-N 1 3 282.431 3.907 20 0 CHADHO C[NH+]1CCC([C@H]2CCN(Cc3ccc(Cl)s3)C2)CC1 ZINC000576028601 335143207 /nfs/dbraw/zinc/14/32/07/335143207.db2.gz MHCSANQWPISQKZ-ZDUSSCGKSA-N 1 3 298.883 3.565 20 0 CHADHO C[C@@H]1CCC[C@H](N2CCC([NH2+]C[C@H]3CC3(C)C)CC2)C1 ZINC000537976846 333552684 /nfs/dbraw/zinc/55/26/84/333552684.db2.gz LMIHIFPYSJWHRR-INMHGKMJSA-N 1 3 278.484 3.665 20 0 CHADHO C[C@@H](CCc1ccc(Cl)s1)[NH2+]CC1=CCN(C)CC1 ZINC000546656486 334043939 /nfs/dbraw/zinc/04/39/39/334043939.db2.gz PXTWAUCSWWITHM-LBPRGKRZSA-N 1 3 298.883 3.574 20 0 CHADHO C[C@@H]([NH2+]CC1(CN(C)C)CCCC1)c1cc(F)cc(F)c1 ZINC000546932078 334055785 /nfs/dbraw/zinc/05/57/85/334055785.db2.gz LLEIFPOCFZQWFF-CYBMUJFWSA-N 1 3 296.405 3.737 20 0 CHADHO C[C@H]([NH2+]CC[C@@H]1CCCN1C)c1ccc2c(c1)CCCC2 ZINC000546936299 334056620 /nfs/dbraw/zinc/05/66/20/334056620.db2.gz ZJUDOBWAPLXPON-KXBFYZLASA-N 1 3 286.463 3.700 20 0 CHADHO C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C2CCCC2)C1 ZINC000245690001 334212816 /nfs/dbraw/zinc/21/28/16/334212816.db2.gz VVGVLJFAHWKENS-HZPDHXFCSA-N 1 3 264.457 3.515 20 0 CHADHO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(C2CCCC2)C1 ZINC000245690001 334212817 /nfs/dbraw/zinc/21/28/17/334212817.db2.gz VVGVLJFAHWKENS-HZPDHXFCSA-N 1 3 264.457 3.515 20 0 CHADHO C[C@@H]1CCCCN1C[C@H]1CCC[N@@H+](C2CCCC2)C1 ZINC000245690001 334212818 /nfs/dbraw/zinc/21/28/18/334212818.db2.gz VVGVLJFAHWKENS-HZPDHXFCSA-N 1 3 264.457 3.515 20 0 CHADHO C[C@@H]1CCCCN1C[C@H]1CCC[N@H+](C2CCCC2)C1 ZINC000245690001 334212819 /nfs/dbraw/zinc/21/28/19/334212819.db2.gz VVGVLJFAHWKENS-HZPDHXFCSA-N 1 3 264.457 3.515 20 0 CHADHO CC(C)=CCC[C@@H](C)[NH2+]C[C@@H]1CCCN(C(C)C)C1 ZINC000247007048 334273789 /nfs/dbraw/zinc/27/37/89/334273789.db2.gz LYGMBDLOXJPNDT-SJORKVTESA-N 1 3 266.473 3.831 20 0 CHADHO C1CCC(N2CCC([NH2+][C@H]3CC4CCC3CC4)CC2)C1 ZINC000550829982 334229686 /nfs/dbraw/zinc/22/96/86/334229686.db2.gz RYIJZETVAHFZKZ-JMLCCBQJSA-N 1 3 276.468 3.562 20 0 CHADHO CCSc1ccc([C@H](C)N[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000247156221 334276710 /nfs/dbraw/zinc/27/67/10/334276710.db2.gz XLNWJCIKHAXCTA-DZKIICNBSA-N 1 3 292.492 3.932 20 0 CHADHO CCN1CC[C@H]([NH2+]Cc2ccc(C)cc2SC)[C@@H](C)C1 ZINC000246882379 334271140 /nfs/dbraw/zinc/27/11/40/334271140.db2.gz DMQBWLNZMZSTTH-HOCLYGCPSA-N 1 3 292.492 3.537 20 0 CHADHO CCSc1ccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000247156221 334276712 /nfs/dbraw/zinc/27/67/12/334276712.db2.gz XLNWJCIKHAXCTA-DZKIICNBSA-N 1 3 292.492 3.932 20 0 CHADHO CC[C@@H](c1ccccc1)N1CC[C@@H](C[NH+](CC)CC)C1 ZINC000247503803 334283214 /nfs/dbraw/zinc/28/32/14/334283214.db2.gz LYOOWHYPBOQGCH-WMZOPIPTSA-N 1 3 274.452 3.801 20 0 CHADHO CC[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](CN(CC)CC)C1 ZINC000247503803 334283215 /nfs/dbraw/zinc/28/32/15/334283215.db2.gz LYOOWHYPBOQGCH-WMZOPIPTSA-N 1 3 274.452 3.801 20 0 CHADHO CC[C@@H](c1ccccc1)[N@H+]1CC[C@@H](CN(CC)CC)C1 ZINC000247503803 334283216 /nfs/dbraw/zinc/28/32/16/334283216.db2.gz LYOOWHYPBOQGCH-WMZOPIPTSA-N 1 3 274.452 3.801 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)c1ccccc1)[C@H]1CCCN(C2CCC2)C1 ZINC000248397592 334300000 /nfs/dbraw/zinc/30/00/00/334300000.db2.gz ICVXLZSOBBQCCT-JZXOWHBKSA-N 1 3 286.463 3.990 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CC=CCC1)[C@H]1CCCN(C2CCC2)C1 ZINC000248401252 334300313 /nfs/dbraw/zinc/30/03/13/334300313.db2.gz LQSQOFQRMGBBTK-BBWFWOEESA-N 1 3 276.468 3.585 20 0 CHADHO C[C@H](CC[N@@H+]1CC[C@@H]2[C@@H](CCCN2C)C1)c1ccccc1 ZINC000248744291 334315638 /nfs/dbraw/zinc/31/56/38/334315638.db2.gz AQUZMLVODMBMNT-NZSAHSFTSA-N 1 3 286.463 3.596 20 0 CHADHO C[C@H](CC[N@H+]1CC[C@@H]2[C@@H](CCCN2C)C1)c1ccccc1 ZINC000248744291 334315639 /nfs/dbraw/zinc/31/56/39/334315639.db2.gz AQUZMLVODMBMNT-NZSAHSFTSA-N 1 3 286.463 3.596 20 0 CHADHO CC(C)CC1(C[NH2+][C@@H]2CCN3CCC[C@H]3C2)CCCC1 ZINC000251433108 334361482 /nfs/dbraw/zinc/36/14/82/334361482.db2.gz SMZVNUGHTXUUIH-SJORKVTESA-N 1 3 278.484 3.809 20 0 CHADHO CC(C)CC(CC(C)C)[NH2+][C@H]1CCN2CCC[C@H]2C1 ZINC000251441208 334361638 /nfs/dbraw/zinc/36/16/38/334361638.db2.gz VIJHZOKCTOVOJG-RDJZCZTQSA-N 1 3 266.473 3.664 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)N1CC[C@@H]([C@H](C)[NH3+])C1 ZINC000252775780 334392287 /nfs/dbraw/zinc/39/22/87/334392287.db2.gz NVGDUAJFFPGGBT-PMUMKWKESA-N 1 3 268.404 3.570 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)N1CC[C@H]([C@H](C)[NH3+])C1 ZINC000252775779 334392368 /nfs/dbraw/zinc/39/23/68/334392368.db2.gz NVGDUAJFFPGGBT-IYOUNJFTSA-N 1 3 268.404 3.570 20 0 CHADHO CC(C)CC[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)C1CC1 ZINC000555226815 334471726 /nfs/dbraw/zinc/47/17/26/334471726.db2.gz NGAJPDOCRXFWIN-IKGGRYGDSA-N 1 3 266.473 3.664 20 0 CHADHO c1c2ccccc2oc1CNCCCCC[NH+]1CCCC1 ZINC000555612633 334484781 /nfs/dbraw/zinc/48/47/81/334484781.db2.gz WVEJPPDBVSTEIL-UHFFFAOYSA-N 1 3 286.419 3.789 20 0 CHADHO C[C@@H]([NH3+])C[C@H](C)NCc1ccc(-c2ccccc2F)s1 ZINC000566230228 334637093 /nfs/dbraw/zinc/63/70/93/334637093.db2.gz SPIVUZSZQJMXHP-NEPJUHHUSA-N 1 3 292.423 3.770 20 0 CHADHO C[C@@H]([NH2+]C1CCN(C2CCCCC2)CC1)C1(C)CC1 ZINC000157548114 334774672 /nfs/dbraw/zinc/77/46/72/334774672.db2.gz WASUJTKKQRATRH-CQSZACIVSA-N 1 3 264.457 3.562 20 0 CHADHO CC(C)NCCC[NH2+]C1CCC(c2ccccc2)CC1 ZINC000576694541 335235473 /nfs/dbraw/zinc/23/54/73/335235473.db2.gz AUGHNIUHCPASMP-UHFFFAOYSA-N 1 3 274.452 3.691 20 0 CHADHO C[C@@H]1CC[C@H](NCc2ccc(C[NH3+])cc2)c2sccc21 ZINC000578324045 335609228 /nfs/dbraw/zinc/60/92/28/335609228.db2.gz GZJPXSCDPRISFB-WBMJQRKESA-N 1 3 286.444 3.935 20 0 CHADHO Cc1c[nH+]ccc1NC[C@@H](c1cccs1)N1CCCC1 ZINC000195334603 336051803 /nfs/dbraw/zinc/05/18/03/336051803.db2.gz XHRNBXMYMIYNHN-HNNXBMFYSA-N 1 3 287.432 3.701 20 0 CHADHO C[C@H](CC(C)(C)C)[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCCN1 ZINC000384682122 336129023 /nfs/dbraw/zinc/12/90/23/336129023.db2.gz UQEAOUUYLDWFMH-KLHDSHLOSA-N 1 3 266.473 3.712 20 0 CHADHO CC(C)(CN[C@@H]1C[C@@H]([NH3+])c2ccccc21)c1cccs1 ZINC000157473506 519271513 /nfs/dbraw/zinc/27/15/13/519271513.db2.gz XUTRKZJQGLNTDZ-HUUCEWRRSA-N 1 3 286.444 3.760 20 0 CHADHO CC(C)N(Cc1cccc(Cl)c1)C[C@@H]1CCC[NH2+]C1 ZINC000226436082 519655889 /nfs/dbraw/zinc/65/58/89/519655889.db2.gz QBLPSSMMRSAWHB-OAHLLOKOSA-N 1 3 280.843 3.550 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2)C1 ZINC000125946271 519677865 /nfs/dbraw/zinc/67/78/65/519677865.db2.gz UFIIKVQODBVLKB-LSDHHAIUSA-N 1 3 278.415 3.597 20 0 CHADHO CCCOc1ccc([C@H](C)N[C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000156193293 520427448 /nfs/dbraw/zinc/42/74/48/520427448.db2.gz IEQWRASUGHPXSM-VYDXJSESSA-N 1 3 290.451 3.609 20 0 CHADHO CCCOc1ccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000156193293 520427453 /nfs/dbraw/zinc/42/74/53/520427453.db2.gz IEQWRASUGHPXSM-VYDXJSESSA-N 1 3 290.451 3.609 20 0 CHADHO CCCCN1CCC([NH2+][C@H](C)c2ccc(OC)cc2)CC1 ZINC000037150406 520578227 /nfs/dbraw/zinc/57/82/27/520578227.db2.gz CZECTTTYLFARKS-OAHLLOKOSA-N 1 3 290.451 3.610 20 0 CHADHO CC[NH+]1CCC(N[C@@H](C)c2ccc(SC)cc2)CC1 ZINC000036994310 521580790 /nfs/dbraw/zinc/58/07/90/521580790.db2.gz JXTLDIUNVBVUID-ZDUSSCGKSA-N 1 3 278.465 3.543 20 0 CHADHO CCN1CC[C@@H]([N@H+](C)Cc2cnc3ccccc3c2)C[C@@H]1C ZINC000337133578 521713825 /nfs/dbraw/zinc/71/38/25/521713825.db2.gz AZFCAPFYUQYMER-MAUKXSAKSA-N 1 3 297.446 3.539 20 0 CHADHO CCN1CC[C@@H]([N@@H+](C)Cc2cnc3ccccc3c2)C[C@@H]1C ZINC000337133578 521713826 /nfs/dbraw/zinc/71/38/26/521713826.db2.gz AZFCAPFYUQYMER-MAUKXSAKSA-N 1 3 297.446 3.539 20 0 CHADHO C[C@H]1CCC[C@@H]([NH2+]C2CCN(c3ccncc3)CC2)CC1 ZINC000235698805 524152369 /nfs/dbraw/zinc/15/23/69/524152369.db2.gz PMLBMEFQNOKXPY-JKSUJKDBSA-N 1 3 287.451 3.609 20 0 CHADHO C[C@H]([NH3+])[C@H]1CCCN([C@@H](C)c2ccc3ccccc3c2)C1 ZINC000226331177 524860164 /nfs/dbraw/zinc/86/01/64/524860164.db2.gz MLSPGLUPEYHFHD-DOXZYTNZSA-N 1 3 282.431 3.960 20 0 CHADHO C[C@H](N[C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc2ccccc2c1 ZINC000093978079 525616301 /nfs/dbraw/zinc/61/63/01/525616301.db2.gz ZCEYHYFIYXPBTR-DOXZYTNZSA-N 1 3 282.431 3.973 20 0 CHADHO C[C@H](N[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc2ccccc2c1 ZINC000093978079 525616306 /nfs/dbraw/zinc/61/63/06/525616306.db2.gz ZCEYHYFIYXPBTR-DOXZYTNZSA-N 1 3 282.431 3.973 20 0 CHADHO Cc1ccc([C@H](C)NCCCC[N@@H+]2CCCC[C@@H]2C)o1 ZINC000157895339 525918810 /nfs/dbraw/zinc/91/88/10/525918810.db2.gz JKMCDQOPGSZGCJ-HOCLYGCPSA-N 1 3 278.440 3.893 20 0 CHADHO Cc1ccc([C@H](C)NCCCC[N@H+]2CCCC[C@@H]2C)o1 ZINC000157895339 525918816 /nfs/dbraw/zinc/91/88/16/525918816.db2.gz JKMCDQOPGSZGCJ-HOCLYGCPSA-N 1 3 278.440 3.893 20 0 CHADHO C[C@H](c1ccc(F)cc1)N1CCCC2(CC[NH+](C)CC2)C1 ZINC000374074120 526061558 /nfs/dbraw/zinc/06/15/58/526061558.db2.gz IARSHYGCRJJCTG-OAHLLOKOSA-N 1 3 290.426 3.695 20 0 CHADHO CSc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCCN2C)cc1 ZINC000337213791 526061670 /nfs/dbraw/zinc/06/16/70/526061670.db2.gz DFFMKBJVWNKXDF-HIFRSBDPSA-N 1 3 278.465 3.543 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]2[NH2+][C@H]2CCN3CCC[C@@H]3C2)cc1 ZINC000278450927 526490816 /nfs/dbraw/zinc/49/08/16/526490816.db2.gz LLSWZHQRDQURBB-ZSYWTGECSA-N 1 3 284.447 3.539 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]2N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000278450927 526490819 /nfs/dbraw/zinc/49/08/19/526490819.db2.gz LLSWZHQRDQURBB-ZSYWTGECSA-N 1 3 284.447 3.539 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]2N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000278450927 526490824 /nfs/dbraw/zinc/49/08/24/526490824.db2.gz LLSWZHQRDQURBB-ZSYWTGECSA-N 1 3 284.447 3.539 20 0 CHADHO [NH3+]C[C@@H]1CCCN(Cc2ccc(-c3ccccc3)cc2)C1 ZINC000044527777 527212410 /nfs/dbraw/zinc/21/24/10/527212410.db2.gz BTEXDGFMQBTXPR-KRWDZBQOSA-N 1 3 280.415 3.524 20 0 CHADHO [NH3+][C@H]1C[C@@H](NCCc2ccc(Cl)cc2)c2ccccc21 ZINC000157263844 527419467 /nfs/dbraw/zinc/41/94/67/527419467.db2.gz ZSRFUSKSVXTSEQ-DLBZAZTESA-N 1 3 286.806 3.617 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](CCC(C)C)c2ccoc2)C1 ZINC000353437143 527743999 /nfs/dbraw/zinc/74/39/99/527743999.db2.gz DGNSHRISKWBOKU-DOTOQJQBSA-N 1 3 278.440 3.688 20 0 CHADHO CC(C)[C@@H]([NH2+]CC[C@H](C)N1CCCCC1)c1cccnc1 ZINC000346855162 528586862 /nfs/dbraw/zinc/58/68/62/528586862.db2.gz CTCMVWWXABLMTO-FUHWJXTLSA-N 1 3 289.467 3.633 20 0 CHADHO Cc1ccc([C@@H](C)N[C@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000623363272 1117842293 /nfs/dbraw/zinc/84/22/93/1117842293.db2.gz KOYBVPWLEPDAHB-ZBFHGGJFSA-N 1 3 260.425 3.518 20 0 CHADHO Cc1ccc([C@@H](C)N[C@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000623363272 1117842299 /nfs/dbraw/zinc/84/22/99/1117842299.db2.gz KOYBVPWLEPDAHB-ZBFHGGJFSA-N 1 3 260.425 3.518 20 0 CHADHO C[C@@H](CC[NH2+]C1CCC2(CCCCC2)CC1)N(C)C ZINC001179266518 1121866543 /nfs/dbraw/zinc/86/65/43/1121866543.db2.gz PCIOMEBKVUYTNS-HNNXBMFYSA-N 1 3 266.473 3.809 20 0 CHADHO C[C@@H]1C[C@@H]([NH3+])CCN1CCCSc1ccccc1Cl ZINC000516659730 1122619007 /nfs/dbraw/zinc/61/90/07/1122619007.db2.gz CJCANLLJGJSKOZ-OLZOCXBDSA-N 1 3 298.883 3.634 20 0 CHADHO C[C@@H](CC[NH2+][C@H]1CC[C@@H](C)[C@H](C)C1)N1CCCCC1 ZINC001201953999 1123162629 /nfs/dbraw/zinc/16/26/29/1123162629.db2.gz CTLCLIPLHKTQJU-NCOADZHNSA-N 1 3 266.473 3.665 20 0 CHADHO CC1(C)CCC[C@@H]([N@@H+]2CCC[C@]3(CCCCN3)C2)C1 ZINC001246616351 1131719091 /nfs/dbraw/zinc/71/90/91/1131719091.db2.gz WBGDYCUKESNISU-NVXWUHKLSA-N 1 3 264.457 3.563 20 0 CHADHO CC1(C)CCC[C@@H]([N@H+]2CCC[C@]3(CCCCN3)C2)C1 ZINC001246616351 1131719096 /nfs/dbraw/zinc/71/90/96/1131719096.db2.gz WBGDYCUKESNISU-NVXWUHKLSA-N 1 3 264.457 3.563 20 0 CHADHO CC1(C)CCC[C@@H](N2CCC[C@]3(CCCC[NH2+]3)C2)C1 ZINC001246616351 1131719100 /nfs/dbraw/zinc/71/91/00/1131719100.db2.gz WBGDYCUKESNISU-NVXWUHKLSA-N 1 3 264.457 3.563 20 0 CHADHO CC(C)[NH+](Cc1cc(F)cc(CN(C)C)c1)C(C)C ZINC001232145644 1132426844 /nfs/dbraw/zinc/42/68/44/1132426844.db2.gz WLSFPCVTXUMYMG-UHFFFAOYSA-N 1 3 266.404 3.506 20 0 CHADHO CCCN(C)C[C@H]1CC[N@H+](C[C@H]2CCCC(C)(C)C2)C1 ZINC001204161889 1133411399 /nfs/dbraw/zinc/41/13/99/1133411399.db2.gz HNAMINCQACIZNO-DLBZAZTESA-N 1 3 280.500 3.867 20 0 CHADHO CCCN(C)C[C@H]1CC[N@@H+](C[C@H]2CCCC(C)(C)C2)C1 ZINC001204161889 1133411402 /nfs/dbraw/zinc/41/14/02/1133411402.db2.gz HNAMINCQACIZNO-DLBZAZTESA-N 1 3 280.500 3.867 20 0 CHADHO C[C@@H](c1ccc(Cl)cc1)[N@H+](C)CC(C)(C)CN(C)C ZINC001207282349 1133787787 /nfs/dbraw/zinc/78/77/87/1133787787.db2.gz JQFOJHAWKSIQGA-ZDUSSCGKSA-N 1 3 282.859 3.921 20 0 CHADHO C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)CC(C)(C)CN(C)C ZINC001207282349 1133787793 /nfs/dbraw/zinc/78/77/93/1133787793.db2.gz JQFOJHAWKSIQGA-ZDUSSCGKSA-N 1 3 282.859 3.921 20 0 CHADHO C[C@H](NCc1cccc(C[NH+](C)C)c1)c1ccc(F)cc1 ZINC000119596967 1125536264 /nfs/dbraw/zinc/53/62/64/1125536264.db2.gz IIERMLQGGZBIFP-AWEZNQCLSA-N 1 3 286.394 3.738 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1N[C@H]1CCCc2cc(F)ccc21 ZINC000245597624 1125584047 /nfs/dbraw/zinc/58/40/47/1125584047.db2.gz NSNHKKMVHSZSBZ-OSLDLMBLSA-N 1 3 290.426 3.521 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1N[C@H]1CCCc2cc(F)ccc21 ZINC000245597624 1125584052 /nfs/dbraw/zinc/58/40/52/1125584052.db2.gz NSNHKKMVHSZSBZ-OSLDLMBLSA-N 1 3 290.426 3.521 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1ccccc1 ZINC000247069063 1125653178 /nfs/dbraw/zinc/65/31/78/1125653178.db2.gz MWMRQLSHIJQYBL-ZACQAIPSSA-N 1 3 260.425 3.600 20 0 CHADHO C[C@H]([NH2+]CC[C@@H]1C[C@H]1C1CC1)[C@H]1CCCN(C2CCC2)C1 ZINC000886127957 1125654318 /nfs/dbraw/zinc/65/43/18/1125654318.db2.gz YOFYJRLVWKIOFF-RUENVJTFSA-N 1 3 290.495 3.665 20 0 CHADHO C[C@@H]1CC[N@H+](CC[C@H]2CCCN2C)[C@H](c2ccco2)C1 ZINC000248142922 1125663703 /nfs/dbraw/zinc/66/37/03/1125663703.db2.gz ZADSIBSGUHAVKF-OAGGEKHMSA-N 1 3 276.424 3.537 20 0 CHADHO C[C@@H]1CC[N@@H+](CC[C@H]2CCCN2C)[C@H](c2ccco2)C1 ZINC000248142922 1125663704 /nfs/dbraw/zinc/66/37/04/1125663704.db2.gz ZADSIBSGUHAVKF-OAGGEKHMSA-N 1 3 276.424 3.537 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@H]2N(C)C[C@]2(C)CC[NH2+]C2)cc1 ZINC000261703442 1125738899 /nfs/dbraw/zinc/73/88/99/1125738899.db2.gz CPYUYGOSZALLJI-IPMKNSEASA-N 1 3 286.463 3.563 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@H](C)N(C)C[C@@]1(C)CC[NH2+]C1 ZINC000261769225 1125742577 /nfs/dbraw/zinc/74/25/77/1125742577.db2.gz MLWKRTOIMZOASO-ZQIUZPCESA-N 1 3 294.870 3.763 20 0 CHADHO C[C@H](CN(C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc(Cl)c1 ZINC000261985156 1125748763 /nfs/dbraw/zinc/74/87/63/1125748763.db2.gz RWFQJNVJOOFUAT-AJSFGMTHSA-N 1 3 292.854 3.658 20 0 CHADHO C[NH+](C)Cc1ccc(CN[C@@H]2CCc3c2cccc3F)cc1 ZINC000338238821 1126726457 /nfs/dbraw/zinc/72/64/57/1126726457.db2.gz ONBKZMMQZUCVBT-LJQANCHMSA-N 1 3 298.405 3.664 20 0 CHADHO COc1ccc([C@H](C)N[C@@H](CC[NH+](C)C)C(C)(C)C)cc1 ZINC000483200957 1126772287 /nfs/dbraw/zinc/77/22/87/1126772287.db2.gz OBUSFUKKKBVYDA-YOEHRIQHSA-N 1 3 292.467 3.712 20 0 CHADHO Cc1ccccc1[C@@H](C)N1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000483222076 1126773525 /nfs/dbraw/zinc/77/35/25/1126773525.db2.gz SRAAAHIHCBFWPP-SJLPKXTDSA-N 1 3 286.463 3.720 20 0 CHADHO Cc1ccccc1[C@@H](C)N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000483222076 1126773528 /nfs/dbraw/zinc/77/35/28/1126773528.db2.gz SRAAAHIHCBFWPP-SJLPKXTDSA-N 1 3 286.463 3.720 20 0 CHADHO COc1cccc([C@H](C)NCc2cccc(C[NH+](C)C)c2)c1 ZINC000177199532 1126798576 /nfs/dbraw/zinc/79/85/76/1126798576.db2.gz PTRMDLIJLAFCGK-HNNXBMFYSA-N 1 3 298.430 3.608 20 0 CHADHO [NH3+][C@H]1C[C@@H](CN2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000904307659 1126844220 /nfs/dbraw/zinc/84/42/20/1126844220.db2.gz DIWOHZUITWRMSL-IFUGULHKSA-N 1 3 299.245 3.868 20 0 CHADHO [NH3+][C@H]1C[C@@H](CN2CCC[C@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000904307660 1126844346 /nfs/dbraw/zinc/84/43/46/1126844346.db2.gz DIWOHZUITWRMSL-NVBFEUDRSA-N 1 3 299.245 3.868 20 0 CHADHO [NH3+]Cc1ccc(CNCc2ccc(C(F)F)c(F)c2)cc1 ZINC000904373636 1126850163 /nfs/dbraw/zinc/85/01/63/1126850163.db2.gz HFRPMYSAUWUOFS-UHFFFAOYSA-N 1 3 294.320 3.512 20 0 CHADHO Cc1csc(CN(C)CCC2CC[NH2+]CC2)c1Cl ZINC001235715167 1130772506 /nfs/dbraw/zinc/77/25/06/1130772506.db2.gz QNMKIMDKHRUCIN-UHFFFAOYSA-N 1 3 286.872 3.531 20 0 CHADHO CCC[C@H](NC[C@H]1CC[N@H+](CC)C1)c1ccsc1 ZINC000191208486 1126948987 /nfs/dbraw/zinc/94/89/87/1126948987.db2.gz HLCSCXOAOCYUNW-HIFRSBDPSA-N 1 3 266.454 3.521 20 0 CHADHO CCC[C@H](NC[C@H]1CC[N@@H+](CC)C1)c1ccsc1 ZINC000191208486 1126948989 /nfs/dbraw/zinc/94/89/89/1126948989.db2.gz HLCSCXOAOCYUNW-HIFRSBDPSA-N 1 3 266.454 3.521 20 0 CHADHO CCC[C@H]([NH2+]C[C@H]1CCN(CC)C1)c1ccsc1 ZINC000191208486 1126948990 /nfs/dbraw/zinc/94/89/90/1126948990.db2.gz HLCSCXOAOCYUNW-HIFRSBDPSA-N 1 3 266.454 3.521 20 0 CHADHO CCCN(Cc1cc(Cl)ccc1C)C1CC[NH2+]CC1 ZINC001236185142 1130882441 /nfs/dbraw/zinc/88/24/41/1130882441.db2.gz XOQMFDVNSBAXTF-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO CCC[N@H+](Cc1cc(Cl)ccc1C)C1CCNCC1 ZINC001236185142 1130882447 /nfs/dbraw/zinc/88/24/47/1130882447.db2.gz XOQMFDVNSBAXTF-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO CCC[N@@H+](Cc1cc(Cl)ccc1C)C1CCNCC1 ZINC001236185142 1130882455 /nfs/dbraw/zinc/88/24/55/1130882455.db2.gz XOQMFDVNSBAXTF-UHFFFAOYSA-N 1 3 280.843 3.612 20 0 CHADHO C[C@@H](CC[NH+](C)C)N[C@@H](C)c1cccc(-c2ccncc2)c1 ZINC000268807057 1127024480 /nfs/dbraw/zinc/02/44/80/1127024480.db2.gz ABNFGWWOIOFAMD-HOTGVXAUSA-N 1 3 297.446 3.739 20 0 CHADHO Cc1cccc([C@@H](C)NC2CC[NH+](C3CCC3)CC2)c1C ZINC000269003768 1127031458 /nfs/dbraw/zinc/03/14/58/1127031458.db2.gz MENGLDGYJIXQKM-MRXNPFEDSA-N 1 3 286.463 3.971 20 0 CHADHO Cc1oc2ccccc2c1CN1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000354177507 1127297477 /nfs/dbraw/zinc/29/74/77/1127297477.db2.gz QLPBCEYRDLKPNE-LJQANCHMSA-N 1 3 298.430 3.659 20 0 CHADHO Cc1oc2ccccc2c1CN1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC000354177507 1127297480 /nfs/dbraw/zinc/29/74/80/1127297480.db2.gz QLPBCEYRDLKPNE-LJQANCHMSA-N 1 3 298.430 3.659 20 0 CHADHO Cc1cccnc1[C@H](N[C@@H]1C[C@H]([NH3+])CC(C)(C)C1)C(C)C ZINC000925497807 1127486264 /nfs/dbraw/zinc/48/62/64/1127486264.db2.gz KESCINGYQRGVJT-ARFHVFGLSA-N 1 3 289.467 3.583 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H]2CCCCc3ccccc32)C1 ZINC000360233682 1127493447 /nfs/dbraw/zinc/49/34/47/1127493447.db2.gz JHDJXUCXYBQPQT-VQIMIIECSA-N 1 3 286.463 3.776 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H]2CCCCc3ccccc32)C1 ZINC000360233682 1127493451 /nfs/dbraw/zinc/49/34/51/1127493451.db2.gz JHDJXUCXYBQPQT-VQIMIIECSA-N 1 3 286.463 3.776 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2CCCCc3ccccc32)C1 ZINC000360233682 1127493453 /nfs/dbraw/zinc/49/34/53/1127493453.db2.gz JHDJXUCXYBQPQT-VQIMIIECSA-N 1 3 286.463 3.776 20 0 CHADHO CC[C@H](N[C@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(C)cc1 ZINC000361970963 1127603627 /nfs/dbraw/zinc/60/36/27/1127603627.db2.gz JPTLQFVIQXLPOJ-BZSNNMDCSA-N 1 3 274.452 3.909 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)c1ccc(C)cc1 ZINC000361970963 1127603631 /nfs/dbraw/zinc/60/36/31/1127603631.db2.gz JPTLQFVIQXLPOJ-BZSNNMDCSA-N 1 3 274.452 3.909 20 0 CHADHO CCN(CC)CC[C@H](C)[NH2+][C@H]1C[C@H](OC(C)(C)C)C1(C)C ZINC001308987530 1127638367 /nfs/dbraw/zinc/63/83/67/1127638367.db2.gz PTAYJXGFHCVSAC-JYJNAYRXSA-N 1 3 298.515 3.679 20 0 CHADHO CCc1ccc2nccc(N3CCC([NH2+]C(C)C)CC3)c2c1 ZINC000295605922 1127647585 /nfs/dbraw/zinc/64/75/85/1127647585.db2.gz UWSRVTXMONRPML-UHFFFAOYSA-N 1 3 297.446 3.764 20 0 CHADHO CC[C@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)c1ccsc1 ZINC000297645660 1127702898 /nfs/dbraw/zinc/70/28/98/1127702898.db2.gz JXTVZHRFDSSKNA-HOCLYGCPSA-N 1 3 280.481 3.909 20 0 CHADHO C[C@@H](N[C@H](CC[NH+](C)C)C(C)(C)C)c1ccc(F)cc1 ZINC000604773718 1127714807 /nfs/dbraw/zinc/71/48/07/1127714807.db2.gz ZXWNNJHXHQEWCV-CZUORRHYSA-N 1 3 280.431 3.843 20 0 CHADHO C[C@H](CN[C@H]1CC[N@@H+]2CCC[C@H]2C1)c1cccc(Cl)c1 ZINC000372459309 1127800124 /nfs/dbraw/zinc/80/01/24/1127800124.db2.gz BVYJZJYUNYHRCO-COXVUDFISA-N 1 3 292.854 3.660 20 0 CHADHO C[C@H](CN[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cccc(Cl)c1 ZINC000372459309 1127800128 /nfs/dbraw/zinc/80/01/28/1127800128.db2.gz BVYJZJYUNYHRCO-COXVUDFISA-N 1 3 292.854 3.660 20 0 CHADHO CCc1ccc(CN2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000539895814 1127952134 /nfs/dbraw/zinc/95/21/34/1127952134.db2.gz XNLIIBRCDHBQDC-QUCCMNQESA-N 1 3 298.474 3.698 20 0 CHADHO CCc1ccc(CN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000539895814 1127952137 /nfs/dbraw/zinc/95/21/37/1127952137.db2.gz XNLIIBRCDHBQDC-QUCCMNQESA-N 1 3 298.474 3.698 20 0 CHADHO C[C@@H]1C[C@H](NCc2ccc(C3CCCC3)cc2)CC[N@@H+]1C ZINC000462780435 1127955209 /nfs/dbraw/zinc/95/52/09/1127955209.db2.gz WJYPSCOHQAUVGD-DNVCBOLYSA-N 1 3 286.463 3.917 20 0 CHADHO C[C@@H]1C[C@H](NCc2ccc(C3CCCC3)cc2)CC[N@H+]1C ZINC000462780435 1127955213 /nfs/dbraw/zinc/95/52/13/1127955213.db2.gz WJYPSCOHQAUVGD-DNVCBOLYSA-N 1 3 286.463 3.917 20 0 CHADHO CC/C=C\CC[NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000467187790 1127958445 /nfs/dbraw/zinc/95/84/45/1127958445.db2.gz SJFIIVHANRBROK-KSLSASGISA-N 1 3 264.457 3.585 20 0 CHADHO C[C@@H]1C[C@H](NCc2cccc(-c3ccccc3)c2)CC[N@@H+]1C ZINC000540606900 1127985865 /nfs/dbraw/zinc/98/58/65/1127985865.db2.gz INVUPOGQARTBOV-OXQOHEQNSA-N 1 3 294.442 3.926 20 0 CHADHO C[C@@H]1C[C@H](NCc2cccc(-c3ccccc3)c2)CC[N@H+]1C ZINC000540606900 1127985867 /nfs/dbraw/zinc/98/58/67/1127985867.db2.gz INVUPOGQARTBOV-OXQOHEQNSA-N 1 3 294.442 3.926 20 0 CHADHO Cc1ccccc1[C@@H](C(C)C)[N@H+](C)C[C@@H]1CCCNC1 ZINC000469972477 1128060137 /nfs/dbraw/zinc/06/01/37/1128060137.db2.gz LKHPRDWKOCQIHE-SJLPKXTDSA-N 1 3 274.452 3.624 20 0 CHADHO Cc1ccccc1[C@@H](C(C)C)[N@@H+](C)C[C@@H]1CCCNC1 ZINC000469972477 1128060142 /nfs/dbraw/zinc/06/01/42/1128060142.db2.gz LKHPRDWKOCQIHE-SJLPKXTDSA-N 1 3 274.452 3.624 20 0 CHADHO Cc1ccccc1-c1cccc(CN2CC[C@@H]([NH3+])[C@@H](C)C2)c1 ZINC000469991651 1128061464 /nfs/dbraw/zinc/06/14/64/1128061464.db2.gz NCGPMTWWBNVFAO-OXJNMPFZSA-N 1 3 294.442 3.831 20 0 CHADHO CC(C)c1ccc(CCN[C@H]2CC[N@@H+]3CCCC[C@@H]23)cc1 ZINC000470103639 1128063513 /nfs/dbraw/zinc/06/35/13/1128063513.db2.gz GXGBBELPGMIIQX-OALUTQOASA-N 1 3 286.463 3.569 20 0 CHADHO CC(C)c1ccc(CCN[C@H]2CC[N@H+]3CCCC[C@@H]23)cc1 ZINC000470103639 1128063517 /nfs/dbraw/zinc/06/35/17/1128063517.db2.gz GXGBBELPGMIIQX-OALUTQOASA-N 1 3 286.463 3.569 20 0 CHADHO C[C@H](C[NH2+][C@H]1CCC[C@H](N(C)C)C1)c1cccc(Cl)c1 ZINC000470363498 1128069839 /nfs/dbraw/zinc/06/98/39/1128069839.db2.gz RKRVTNOWHRKFKQ-COXVUDFISA-N 1 3 294.870 3.906 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NCC[C@H]2CCCC2(F)F)c2ccccc21 ZINC000925734862 1128138978 /nfs/dbraw/zinc/13/89/78/1128138978.db2.gz BZNAONSPXJUKEQ-KCPJHIHWSA-N 1 3 280.362 3.546 20 0 CHADHO CCCc1ccc([C@H](C)[NH2+]C[C@@H]2CNCCC2(F)F)cc1 ZINC000925781728 1128142571 /nfs/dbraw/zinc/14/25/71/1128142571.db2.gz ZXOUCLSEKKVGAO-BBRMVZONSA-N 1 3 296.405 3.535 20 0 CHADHO Cc1cc(Cl)ccc1CN1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000219569463 1128164340 /nfs/dbraw/zinc/16/43/40/1128164340.db2.gz DNVBRRWFSSFVBV-KRWDZBQOSA-N 1 3 292.854 3.612 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+]C[C@H]2CCCC[C@H]2C)C1 ZINC001649175989 1128403678 /nfs/dbraw/zinc/40/36/78/1128403678.db2.gz SYKFQDQYBBGOPE-BRWVUGGUSA-N 1 3 266.473 3.523 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H](C)c2ccc(CC(C)C)cc2)C1 ZINC000037644107 1128433847 /nfs/dbraw/zinc/43/38/47/1128433847.db2.gz QIKIPVNJQLYJAN-FUHWJXTLSA-N 1 3 288.479 3.878 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H](C)c2ccc(CC(C)C)cc2)C1 ZINC000037644107 1128433849 /nfs/dbraw/zinc/43/38/49/1128433849.db2.gz QIKIPVNJQLYJAN-FUHWJXTLSA-N 1 3 288.479 3.878 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)c2ccc(CC(C)C)cc2)C1 ZINC000037644107 1128433850 /nfs/dbraw/zinc/43/38/50/1128433850.db2.gz QIKIPVNJQLYJAN-FUHWJXTLSA-N 1 3 288.479 3.878 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@@H](C)c2ccc3c(c2)CCCC3)C1 ZINC000037644196 1128434162 /nfs/dbraw/zinc/43/41/62/1128434162.db2.gz ZZFBGADWBLBXJW-HOTGVXAUSA-N 1 3 286.463 3.558 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@@H](C)c2ccc3c(c2)CCCC3)C1 ZINC000037644196 1128434164 /nfs/dbraw/zinc/43/41/64/1128434164.db2.gz ZZFBGADWBLBXJW-HOTGVXAUSA-N 1 3 286.463 3.558 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2ccc3c(c2)CCCC3)C1 ZINC000037644196 1128434167 /nfs/dbraw/zinc/43/41/67/1128434167.db2.gz ZZFBGADWBLBXJW-HOTGVXAUSA-N 1 3 286.463 3.558 20 0 CHADHO C[C@@H](C[NH2+]C[C@H](C)CN1CCCCC1)c1ccccc1 ZINC000037997575 1128438216 /nfs/dbraw/zinc/43/82/16/1128438216.db2.gz HAKFHFURGFSVKZ-IRXDYDNUSA-N 1 3 274.452 3.502 20 0 CHADHO CCC[C@@H](C)CC[C@@H](C)[NH+]1CCC2(CN(C)C2)CC1 ZINC001257485191 1128503691 /nfs/dbraw/zinc/50/36/91/1128503691.db2.gz JIMUVXLSJUDYGZ-HZPDHXFCSA-N 1 3 266.473 3.619 20 0 CHADHO CCCN1CC[C@@H](C[NH2+]C2CCC3(CCCC3)CC2)C1 ZINC000564415451 1128507673 /nfs/dbraw/zinc/50/76/73/1128507673.db2.gz PXXXAEIBSFITOR-INIZCTEOSA-N 1 3 278.484 3.811 20 0 CHADHO CCCCC[C@H](C)[NH+]1C(C)(C)CC(N)CC1(C)C ZINC001257501677 1128511848 /nfs/dbraw/zinc/51/18/48/1128511848.db2.gz KSHHMVWNJVOTIZ-ZDUSSCGKSA-N 1 3 254.462 3.936 20 0 CHADHO CC1=C[C@@H](C)C[C@H](C[N@@H+]2CCCC23CCN(C)CC3)C1 ZINC000565140319 1128520544 /nfs/dbraw/zinc/52/05/44/1128520544.db2.gz LIZCCAWBCBUXHL-WBVHZDCISA-N 1 3 276.468 3.539 20 0 CHADHO CC1=C[C@@H](C)C[C@H](C[N@H+]2CCCC23CCN(C)CC3)C1 ZINC000565140319 1128520545 /nfs/dbraw/zinc/52/05/45/1128520545.db2.gz LIZCCAWBCBUXHL-WBVHZDCISA-N 1 3 276.468 3.539 20 0 CHADHO C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(CC2(C)CCC2)C1 ZINC000556105232 1128547141 /nfs/dbraw/zinc/54/71/41/1128547141.db2.gz VDJDHWVMNDNXAQ-IRXDYDNUSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(CC2(C)CCC2)C1 ZINC000556105232 1128547143 /nfs/dbraw/zinc/54/71/43/1128547143.db2.gz VDJDHWVMNDNXAQ-IRXDYDNUSA-N 1 3 278.484 3.763 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC000130139984 1128567923 /nfs/dbraw/zinc/56/79/23/1128567923.db2.gz DJKARLMOZLEMSD-RFQIPJPRSA-N 1 3 292.389 3.570 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@@H]2CCCc3c(Cl)cccc32)C1 ZINC000568801507 1128592072 /nfs/dbraw/zinc/59/20/72/1128592072.db2.gz XQIQNLYGOLPVIP-SUMWQHHRSA-N 1 3 292.854 3.649 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@@H]2CCCc3c(Cl)cccc32)C1 ZINC000568801507 1128592074 /nfs/dbraw/zinc/59/20/74/1128592074.db2.gz XQIQNLYGOLPVIP-SUMWQHHRSA-N 1 3 292.854 3.649 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H]2CCCc3c(Cl)cccc32)C1 ZINC000568801507 1128592078 /nfs/dbraw/zinc/59/20/78/1128592078.db2.gz XQIQNLYGOLPVIP-SUMWQHHRSA-N 1 3 292.854 3.649 20 0 CHADHO CC[NH+]1CCC(N[C@H]2C[C@@H](C)c3c2cccc3C)CC1 ZINC000152627521 1128615188 /nfs/dbraw/zinc/61/51/88/1128615188.db2.gz AMGMWHGOZXHJQP-PBHICJAKSA-N 1 3 272.436 3.617 20 0 CHADHO CCC[N@H+](Cc1ccccc1C(C)C)C1CCNCC1 ZINC001236184756 1128599383 /nfs/dbraw/zinc/59/93/83/1128599383.db2.gz NTXUOGAWRFXLJD-UHFFFAOYSA-N 1 3 274.452 3.774 20 0 CHADHO CCC[N@@H+](Cc1ccccc1C(C)C)C1CCNCC1 ZINC001236184756 1128599385 /nfs/dbraw/zinc/59/93/85/1128599385.db2.gz NTXUOGAWRFXLJD-UHFFFAOYSA-N 1 3 274.452 3.774 20 0 CHADHO CCCN(Cc1ccccc1C(C)C)C1CC[NH2+]CC1 ZINC001236184756 1128599388 /nfs/dbraw/zinc/59/93/88/1128599388.db2.gz NTXUOGAWRFXLJD-UHFFFAOYSA-N 1 3 274.452 3.774 20 0 CHADHO [NH3+]C[C@@H]1CCCN(Cc2ccc(-c3ccccc3)s2)C1 ZINC000570965642 1128635585 /nfs/dbraw/zinc/63/55/85/1128635585.db2.gz LTUNSCLNJUNOJR-AWEZNQCLSA-N 1 3 286.444 3.586 20 0 CHADHO CC[N@H+](C)C[C@H]1CCN(Cc2cccc3ccccc32)C1 ZINC000072857772 1128634741 /nfs/dbraw/zinc/63/47/41/1128634741.db2.gz IIKFLZYYPXAWQF-MRXNPFEDSA-N 1 3 282.431 3.613 20 0 CHADHO CC[N@@H+](C)C[C@H]1CCN(Cc2cccc3ccccc32)C1 ZINC000072857772 1128634744 /nfs/dbraw/zinc/63/47/44/1128634744.db2.gz IIKFLZYYPXAWQF-MRXNPFEDSA-N 1 3 282.431 3.613 20 0 CHADHO CCN(C)C[C@H]1CC[N@H+](Cc2cccc3ccccc32)C1 ZINC000072857772 1128634745 /nfs/dbraw/zinc/63/47/45/1128634745.db2.gz IIKFLZYYPXAWQF-MRXNPFEDSA-N 1 3 282.431 3.613 20 0 CHADHO CCN(C)C[C@H]1CC[N@@H+](Cc2cccc3ccccc32)C1 ZINC000072857772 1128634748 /nfs/dbraw/zinc/63/47/48/1128634748.db2.gz IIKFLZYYPXAWQF-MRXNPFEDSA-N 1 3 282.431 3.613 20 0 CHADHO CN1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccc3ccccc3c2)C1 ZINC000571924242 1128639484 /nfs/dbraw/zinc/63/94/84/1128639484.db2.gz FRIPYTIHRPDDTL-UXHICEINSA-N 1 3 294.442 3.756 20 0 CHADHO CN1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccc3ccccc3c2)C1 ZINC000571924242 1128639487 /nfs/dbraw/zinc/63/94/87/1128639487.db2.gz FRIPYTIHRPDDTL-UXHICEINSA-N 1 3 294.442 3.756 20 0 CHADHO C[C@H](N[C@H](c1cccc(F)c1)C(C)(C)C)[C@@H]1CCC[NH2+]C1 ZINC000515828813 1128684075 /nfs/dbraw/zinc/68/40/75/1128684075.db2.gz YDROVNURPBVTEA-YSVLISHTSA-N 1 3 292.442 3.891 20 0 CHADHO CC(C)C[C@H](C)C[C@@H](C)[NH2+]CC[C@@H]1CCCN1C ZINC001258056471 1128714120 /nfs/dbraw/zinc/71/41/20/1128714120.db2.gz PKZDFKPVILAWFX-XHSDSOJGSA-N 1 3 254.462 3.521 20 0 CHADHO CC1=CC[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000578385632 1128716020 /nfs/dbraw/zinc/71/60/20/1128716020.db2.gz UNABESFUDCFPJJ-MRXNPFEDSA-N 1 3 276.468 3.872 20 0 CHADHO C[C@@H]1C[C@@H]1c1ccc(CNCCCCC[NH+]2CCCC2)o1 ZINC000339496545 1117808959 /nfs/dbraw/zinc/80/89/59/1117808959.db2.gz CCYKJPFASOWGDX-WBVHZDCISA-N 1 3 290.451 3.759 20 0 CHADHO CC[C@@H]([NH2+][C@@H]1CCN(C)C(C)(C)C1)c1ccc(F)cc1F ZINC000623426460 1117853570 /nfs/dbraw/zinc/85/35/70/1117853570.db2.gz MNRNYZOXSRKUGD-CZUORRHYSA-N 1 3 296.405 3.878 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCN(C)C(C)(C)C1)c1ccc(F)cc1F ZINC000623426458 1117854379 /nfs/dbraw/zinc/85/43/79/1117854379.db2.gz MNRNYZOXSRKUGD-BBRMVZONSA-N 1 3 296.405 3.878 20 0 CHADHO C[NH+](C)CC[C@@H](NCc1ccc2cc[nH]c2c1)C(C)(C)C ZINC000623422450 1117854698 /nfs/dbraw/zinc/85/46/98/1117854698.db2.gz WYNCHVGOQBDFOL-QGZVFWFLSA-N 1 3 287.451 3.624 20 0 CHADHO C[NH2+]C[C@@H]1CCCN(C2c3ccccc3-c3ccccc32)C1 ZINC000261948122 1117905989 /nfs/dbraw/zinc/90/59/89/1117905989.db2.gz MQKIGCAOMSNKEK-HNNXBMFYSA-N 1 3 292.426 3.688 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N[C@@H]1CCCc2scnc21 ZINC000623848857 1117943077 /nfs/dbraw/zinc/94/30/77/1117943077.db2.gz NFJRSPRTAOYESN-ZIAGYGMSSA-N 1 3 295.496 3.621 20 0 CHADHO CN1CCCC[C@@H](C[NH2+][C@H]2CCSc3ccccc32)C1 ZINC000624119850 1117983361 /nfs/dbraw/zinc/98/33/61/1117983361.db2.gz KWEXDPSTKDUESQ-HOCLYGCPSA-N 1 3 290.476 3.545 20 0 CHADHO Cc1cccc(CC[C@@H](C)[NH2+]C[C@H]2CCCCN(C)C2)c1 ZINC000624120666 1117984740 /nfs/dbraw/zinc/98/47/40/1117984740.db2.gz DPHCEYKUJMPWOZ-IEBWSBKVSA-N 1 3 288.479 3.638 20 0 CHADHO C[C@H](CCC(C)(C)C)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000624123961 1117985746 /nfs/dbraw/zinc/98/57/46/1117985746.db2.gz UTJJDTVWQWYLBJ-HUUCEWRRSA-N 1 3 254.462 3.523 20 0 CHADHO CN1CCCC[C@H](C[NH2+][C@@H](c2ccc(F)cc2)C2CC2)C1 ZINC000624121735 1117985880 /nfs/dbraw/zinc/98/58/80/1117985880.db2.gz CCCZGZBHLWIZEQ-RDTXWAMCSA-N 1 3 290.426 3.598 20 0 CHADHO CC[C@@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1cccc(C)c1 ZINC000624124004 1117985988 /nfs/dbraw/zinc/98/59/88/1117985988.db2.gz VLVUKYKWQUGAFS-FUHWJXTLSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@@H](NC[C@@H]1CCCC[N@H+](C)C1)c1cccc(C)c1 ZINC000624124004 1117985992 /nfs/dbraw/zinc/98/59/92/1117985992.db2.gz VLVUKYKWQUGAFS-FUHWJXTLSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@@H](NC[C@@H]1CCCC[N@@H+](C)C1)c1cccc(C)c1 ZINC000624124004 1117985994 /nfs/dbraw/zinc/98/59/94/1117985994.db2.gz VLVUKYKWQUGAFS-FUHWJXTLSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1cccc(C)c1 ZINC000624124005 1117987483 /nfs/dbraw/zinc/98/74/83/1117987483.db2.gz VLVUKYKWQUGAFS-SJLPKXTDSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@@H](NC[C@H]1CCCC[N@H+](C)C1)c1cccc(C)c1 ZINC000624124005 1117987487 /nfs/dbraw/zinc/98/74/87/1117987487.db2.gz VLVUKYKWQUGAFS-SJLPKXTDSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@@H](NC[C@H]1CCCC[N@@H+](C)C1)c1cccc(C)c1 ZINC000624124005 1117987490 /nfs/dbraw/zinc/98/74/90/1117987490.db2.gz VLVUKYKWQUGAFS-SJLPKXTDSA-N 1 3 274.452 3.768 20 0 CHADHO C[C@H]([NH2+]CCCN1CCCC1)c1cccc(C2CC2)c1 ZINC000340183015 1118103093 /nfs/dbraw/zinc/10/30/93/1118103093.db2.gz SMOWSXYYAJWVMF-HNNXBMFYSA-N 1 3 272.436 3.701 20 0 CHADHO CN1CCCC[C@@H](C[NH2+][C@H]2CCCCC23CCCC3)C1 ZINC000706071847 1118140989 /nfs/dbraw/zinc/14/09/89/1118140989.db2.gz WHNAEVLDRASGCO-IRXDYDNUSA-N 1 3 278.484 3.811 20 0 CHADHO CCC[NH+]1CCC(Nc2ccnc3cc(OC)ccc32)CC1 ZINC000765457372 1118152838 /nfs/dbraw/zinc/15/28/38/1118152838.db2.gz ZTGHPYVGOVNEHC-UHFFFAOYSA-N 1 3 299.418 3.530 20 0 CHADHO CC[C@@H]([NH2+]C1CCN(CC2CCCCC2)CC1)C1CC1 ZINC000765453660 1118152992 /nfs/dbraw/zinc/15/29/92/1118152992.db2.gz QJEZIJRCPNZXOX-GOSISDBHSA-N 1 3 278.484 3.809 20 0 CHADHO Cc1cccc([C@@H](C)[NH2+]CCCN2CCCC[C@@H]2C)c1 ZINC000037200201 1118229170 /nfs/dbraw/zinc/22/91/70/1118229170.db2.gz STIGOBVCIFICMA-DLBZAZTESA-N 1 3 274.452 3.910 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]C2CCC(=C3CCC3)CC2)C1 ZINC000639170329 1118250018 /nfs/dbraw/zinc/25/00/18/1118250018.db2.gz SZNGMEZDPZLRCU-OAHLLOKOSA-N 1 3 276.468 3.729 20 0 CHADHO Cc1cccc(CNCCC[N@@H+](C)Cc2ccccc2)c1C ZINC000061556876 1118307639 /nfs/dbraw/zinc/30/76/39/1118307639.db2.gz YXCCJQQXYDAHPZ-UHFFFAOYSA-N 1 3 296.458 3.915 20 0 CHADHO Cc1cccc(CNCCC[N@H+](C)Cc2ccccc2)c1C ZINC000061556876 1118307644 /nfs/dbraw/zinc/30/76/44/1118307644.db2.gz YXCCJQQXYDAHPZ-UHFFFAOYSA-N 1 3 296.458 3.915 20 0 CHADHO [NH3+][C@H]1CCC[C@@H](NC2(c3cccc(Cl)c3)CCC2)C1 ZINC000656200203 1118439920 /nfs/dbraw/zinc/43/99/20/1118439920.db2.gz HBJMPKZWEZHCFW-LSDHHAIUSA-N 1 3 278.827 3.579 20 0 CHADHO CC(C)[C@H](N[C@@H]1CC[NH2+]C[C@@H]1C)c1ccc(Cl)cc1 ZINC000261582903 1118462893 /nfs/dbraw/zinc/46/28/93/1118462893.db2.gz GVTGEANQRANKJS-MAZHCROVSA-N 1 3 280.843 3.625 20 0 CHADHO Cc1[nH+]c2ccccc2c(N2CCN(C3CCC3)CC2)c1C ZINC000580915769 1118521483 /nfs/dbraw/zinc/52/14/83/1118521483.db2.gz BFSRJRTUEGBUNU-UHFFFAOYSA-N 1 3 295.430 3.526 20 0 CHADHO CC(C)C1CCC(C[NH2+]C[C@@H]2CCN(C(C)C)C2)CC1 ZINC000394285348 1118680782 /nfs/dbraw/zinc/68/07/82/1118680782.db2.gz JQLWFODSFLOCFG-ADKAHSJRSA-N 1 3 280.500 3.769 20 0 CHADHO C[NH+](C)CCCN[C@@H](CCc1ccccc1)c1ccccc1 ZINC000341569675 1118742767 /nfs/dbraw/zinc/74/27/67/1118742767.db2.gz CVINBBWNJWFQKU-FQEVSTJZSA-N 1 3 296.458 3.902 20 0 CHADHO CC1CCC(C[NH2+]C2CCN(C(C)(C)C)CC2)CC1 ZINC000089576704 1118794003 /nfs/dbraw/zinc/79/40/03/1118794003.db2.gz DRBSEKYEEUVTQG-UHFFFAOYSA-N 1 3 266.473 3.665 20 0 CHADHO Clc1ccc2c(c1)[C@@H]([NH2+]CCCN1CCCC1)CCC2 ZINC000535687381 1118877391 /nfs/dbraw/zinc/87/73/91/1118877391.db2.gz VTASHGJIFHNZEV-KRWDZBQOSA-N 1 3 292.854 3.793 20 0 CHADHO CCC(C)(C)[C@@H](C)[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663465536 1119146537 /nfs/dbraw/zinc/14/65/37/1119146537.db2.gz KJHNKASHMWVBFK-ZBFHGGJFSA-N 1 3 266.473 3.523 20 0 CHADHO CC1(C)C[C@@]1(C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000657761653 1119358536 /nfs/dbraw/zinc/35/85/36/1119358536.db2.gz QKVWCPGJTREEMP-QGZVFWFLSA-N 1 3 264.457 3.562 20 0 CHADHO CC1CCN(CCC[NH2+][C@H]2CCc3c2cccc3F)CC1 ZINC000147617853 1119388868 /nfs/dbraw/zinc/38/88/68/1119388868.db2.gz OZJXKWGMGCFOSI-SFHVURJKSA-N 1 3 290.426 3.525 20 0 CHADHO CC[C@H](NCc1ccccc1C[NH2+]C)c1ccsc1 ZINC000650755279 1119413536 /nfs/dbraw/zinc/41/35/36/1119413536.db2.gz BALYFAPNZOYDJF-INIZCTEOSA-N 1 3 274.433 3.708 20 0 CHADHO C[NH2+]Cc1ccccc1CN[C@@H]1CCCc2cc(F)ccc21 ZINC000650756660 1119414279 /nfs/dbraw/zinc/41/42/79/1119414279.db2.gz HEWWORKVVPVGML-LJQANCHMSA-N 1 3 298.405 3.712 20 0 CHADHO C[C@H]([NH2+]CCCN1CCCC[C@@H]1C)C(C)(C)C(F)F ZINC000657824548 1119468793 /nfs/dbraw/zinc/46/87/93/1119468793.db2.gz UOCTXSGOHRWBDX-STQMWFEESA-N 1 3 276.415 3.520 20 0 CHADHO C(C1CCCC1)N1CCC([NH2+][C@H]2CCCSCC2)CC1 ZINC000657858591 1119532866 /nfs/dbraw/zinc/53/28/66/1119532866.db2.gz JDUDDHHDEJRKJT-INIZCTEOSA-N 1 3 296.524 3.516 20 0 CHADHO C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1N[C@@H]1CCCc2ccc(F)cc21 ZINC000089213920 1119537836 /nfs/dbraw/zinc/53/78/36/1119537836.db2.gz QCJRJQAEKILSNT-OBQMCUGOSA-N 1 3 290.426 3.521 20 0 CHADHO C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1N[C@@H]1CCCc2ccc(F)cc21 ZINC000089213920 1119537838 /nfs/dbraw/zinc/53/78/38/1119537838.db2.gz QCJRJQAEKILSNT-OBQMCUGOSA-N 1 3 290.426 3.521 20 0 CHADHO CC(C)[NH+](CCCN[C@@H](C)C(C)(C)C(F)F)C(C)C ZINC000657901215 1119619360 /nfs/dbraw/zinc/61/93/60/1119619360.db2.gz XBXSJSVITNFFJO-ZDUSSCGKSA-N 1 3 278.431 3.765 20 0 CHADHO C[C@H](CC[NH2+]C[C@@H]1CCCCN(C)C1)c1ccccc1 ZINC000628425642 1128859716 /nfs/dbraw/zinc/85/97/16/1128859716.db2.gz QUNOLUZZODMMGD-SJORKVTESA-N 1 3 274.452 3.502 20 0 CHADHO Cc1ccc2c(c1)[C@H](NC1CC[NH+](C(C)C)CC1)[C@@H](C)C2 ZINC000658244675 1119711228 /nfs/dbraw/zinc/71/12/28/1119711228.db2.gz DFZKZHQBDOAAER-HNAYVOBHSA-N 1 3 286.463 3.691 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@@H]2C[C@H](C)CC(C)(C)C2)C1 ZINC000708768910 1119808925 /nfs/dbraw/zinc/80/89/25/1119808925.db2.gz YNFSTVGYGWQPQL-HRCADAONSA-N 1 3 266.473 3.523 20 0 CHADHO COc1cccc(CN[C@@H](C)c2cccc(C[NH+](C)C)c2)c1 ZINC000924565477 1119865345 /nfs/dbraw/zinc/86/53/45/1119865345.db2.gz UDQDDHNBNXAHEI-HNNXBMFYSA-N 1 3 298.430 3.608 20 0 CHADHO CCCC[N@H+](C)CC1CCN(Cc2ccc(F)cc2)CC1 ZINC000613491408 1119939534 /nfs/dbraw/zinc/93/95/34/1119939534.db2.gz QHBJCHUAIGTOFU-UHFFFAOYSA-N 1 3 292.442 3.770 20 0 CHADHO CCCC[N@@H+](C)CC1CCN(Cc2ccc(F)cc2)CC1 ZINC000613491408 1119939537 /nfs/dbraw/zinc/93/95/37/1119939537.db2.gz QHBJCHUAIGTOFU-UHFFFAOYSA-N 1 3 292.442 3.770 20 0 CHADHO C[C@@H]1C[C@H](NC2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)CS1 ZINC000414223166 1119946272 /nfs/dbraw/zinc/94/62/72/1119946272.db2.gz GDNDQSNKEYYJCU-JHNDHUHGSA-N 1 3 296.524 3.513 20 0 CHADHO C[C@@H]1C[C@H]([NH2+]C2CCN([C@H]3CCC[C@@H](C)C3)CC2)CS1 ZINC000414223166 1119946273 /nfs/dbraw/zinc/94/62/73/1119946273.db2.gz GDNDQSNKEYYJCU-JHNDHUHGSA-N 1 3 296.524 3.513 20 0 CHADHO CC[C@H](C[C@@H](C)CC)[NH2+]C[C@H]1CCCCN(C)C1 ZINC000624119502 1120051510 /nfs/dbraw/zinc/05/15/10/1120051510.db2.gz DGAGCGGXFAHHBB-ARFHVFGLSA-N 1 3 254.462 3.523 20 0 CHADHO C[C@@H]1[C@H]([NH2+]C[C@@H]2CCCCN(C)C2)C[C@H]1c1ccccc1 ZINC000624122315 1120103936 /nfs/dbraw/zinc/10/39/36/1120103936.db2.gz OCFFNVKPZWAHKS-RNIPGJKVSA-N 1 3 286.463 3.500 20 0 CHADHO CCCC1CCC([NH2+][C@H]2CCC[C@@H](N(C)C)C2)CC1 ZINC000715541008 1120109962 /nfs/dbraw/zinc/10/99/62/1120109962.db2.gz GUXRDCDCIKBPQN-SJJHQCBESA-N 1 3 266.473 3.808 20 0 CHADHO CCC[N@H+](Cc1csc2ccccc12)C1CCNCC1 ZINC000111312753 1120145074 /nfs/dbraw/zinc/14/50/74/1120145074.db2.gz XXTVUYAVSNMWKN-UHFFFAOYSA-N 1 3 288.460 3.865 20 0 CHADHO CCC[N@@H+](Cc1csc2ccccc12)C1CCNCC1 ZINC000111312753 1120145077 /nfs/dbraw/zinc/14/50/77/1120145077.db2.gz XXTVUYAVSNMWKN-UHFFFAOYSA-N 1 3 288.460 3.865 20 0 CHADHO CCCN(Cc1csc2ccccc12)C1CC[NH2+]CC1 ZINC000111312753 1120145078 /nfs/dbraw/zinc/14/50/78/1120145078.db2.gz XXTVUYAVSNMWKN-UHFFFAOYSA-N 1 3 288.460 3.865 20 0 CHADHO C[C@@H](c1cccc(F)c1)[N@H+](C)CC[C@@H]1CCCCN1C ZINC000472774031 1120172106 /nfs/dbraw/zinc/17/21/06/1120172106.db2.gz RKJABCCTQNBIJL-YOEHRIQHSA-N 1 3 278.415 3.693 20 0 CHADHO C[C@@H](c1cccc(F)c1)[N@@H+](C)CC[C@@H]1CCCCN1C ZINC000472774031 1120172108 /nfs/dbraw/zinc/17/21/08/1120172108.db2.gz RKJABCCTQNBIJL-YOEHRIQHSA-N 1 3 278.415 3.693 20 0 CHADHO c1ccc2c(c1)nccc2NCCC[NH+]1CCCCC1 ZINC000013472652 1120293276 /nfs/dbraw/zinc/29/32/76/1120293276.db2.gz BVSJYYGMUXJMTE-UHFFFAOYSA-N 1 3 269.392 3.523 20 0 CHADHO CC[C@@H](CC(F)F)CN1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000659945181 1120300805 /nfs/dbraw/zinc/30/08/05/1120300805.db2.gz SYPRBKRUEYIMKL-LSDHHAIUSA-N 1 3 288.426 3.618 20 0 CHADHO CC1(C)[C@H](N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C[C@H]1c1ccccc1 ZINC000364071032 1120423769 /nfs/dbraw/zinc/42/37/69/1120423769.db2.gz DMTJBAVXCCKSOG-AKHDSKFASA-N 1 3 298.474 3.785 20 0 CHADHO CC1(C)[C@H](N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)C[C@H]1c1ccccc1 ZINC000364071032 1120423772 /nfs/dbraw/zinc/42/37/72/1120423772.db2.gz DMTJBAVXCCKSOG-AKHDSKFASA-N 1 3 298.474 3.785 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2cccs2)C1 ZINC000417336392 1120429645 /nfs/dbraw/zinc/42/96/45/1120429645.db2.gz HWQFPYVZLFMLLV-XUWVNRHRSA-N 1 3 292.492 3.562 20 0 CHADHO Cc1cc(C)c(C[N@H+]2CCC[C@H]3CN(C)CC[C@@H]32)cc1C ZINC000584866053 1120472379 /nfs/dbraw/zinc/47/23/79/1120472379.db2.gz NEMCKMKHGORESP-HKUYNNGSSA-N 1 3 286.463 3.528 20 0 CHADHO Cc1cc(C)c(C[N@@H+]2CCC[C@H]3CN(C)CC[C@@H]32)cc1C ZINC000584866053 1120472382 /nfs/dbraw/zinc/47/23/82/1120472382.db2.gz NEMCKMKHGORESP-HKUYNNGSSA-N 1 3 286.463 3.528 20 0 CHADHO Cc1cc(C)c(C[N@H+]2CCC[C@@H]3CN(C)CC[C@@H]32)cc1C ZINC000584866060 1120472525 /nfs/dbraw/zinc/47/25/25/1120472525.db2.gz NEMCKMKHGORESP-MJGOQNOKSA-N 1 3 286.463 3.528 20 0 CHADHO Cc1cc(C)c(C[N@@H+]2CCC[C@@H]3CN(C)CC[C@@H]32)cc1C ZINC000584866060 1120472529 /nfs/dbraw/zinc/47/25/29/1120472529.db2.gz NEMCKMKHGORESP-MJGOQNOKSA-N 1 3 286.463 3.528 20 0 CHADHO CSCCCCCC[NH2+][C@@H]1CCNC[C@@H]1C1CCCC1 ZINC000925637736 1120501709 /nfs/dbraw/zinc/50/17/09/1120501709.db2.gz QVZHUDRTXOYSHP-IAGOWNOFSA-N 1 3 298.540 3.668 20 0 CHADHO CN(C)CC1(C[NH2+][C@H]2CCc3ccc(F)cc32)CCCC1 ZINC000545520860 1120502606 /nfs/dbraw/zinc/50/26/06/1120502606.db2.gz WMOHNQRTSSYWQQ-KRWDZBQOSA-N 1 3 290.426 3.525 20 0 CHADHO CC[C@H](c1ccc(F)cc1)[N@@H+]1CCC[C@@]2(CCN(C)C2)C1 ZINC000660658600 1120674241 /nfs/dbraw/zinc/67/42/41/1120674241.db2.gz HUGWAQJHTTVYIF-MSOLQXFVSA-N 1 3 290.426 3.695 20 0 CHADHO CC[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@@]2(CCN(C)C2)C1 ZINC000660658600 1120674242 /nfs/dbraw/zinc/67/42/42/1120674242.db2.gz HUGWAQJHTTVYIF-MSOLQXFVSA-N 1 3 290.426 3.695 20 0 CHADHO CC[C@H](c1ccc(F)cc1)[N@@H+]1CCC[C@]2(CCN(C)C2)C1 ZINC000660658602 1120674789 /nfs/dbraw/zinc/67/47/89/1120674789.db2.gz HUGWAQJHTTVYIF-QZTJIDSGSA-N 1 3 290.426 3.695 20 0 CHADHO CC[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@]2(CCN(C)C2)C1 ZINC000660658602 1120674794 /nfs/dbraw/zinc/67/47/94/1120674794.db2.gz HUGWAQJHTTVYIF-QZTJIDSGSA-N 1 3 290.426 3.695 20 0 CHADHO CC[C@]1(C)CCC[C@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000651731547 1120729285 /nfs/dbraw/zinc/72/92/85/1120729285.db2.gz RROIHQUERDSFFU-QZTJIDSGSA-N 1 3 278.484 3.952 20 0 CHADHO CC(C)CC(CC(C)C)[N@@H+]1CCC[C@@]2(CCCNC2)C1 ZINC000228079878 1120732492 /nfs/dbraw/zinc/73/24/92/1120732492.db2.gz CLRHIHRGDZXQPE-GOSISDBHSA-N 1 3 280.500 3.913 20 0 CHADHO CC(C)CC(CC(C)C)[N@H+]1CCC[C@@]2(CCCNC2)C1 ZINC000228079878 1120732496 /nfs/dbraw/zinc/73/24/96/1120732496.db2.gz CLRHIHRGDZXQPE-GOSISDBHSA-N 1 3 280.500 3.913 20 0 CHADHO C[C@@H]1C[C@H]([N@@H+]2CCC[C@@]3(CCCNC3)C2)CC(C)(C)C1 ZINC000228080076 1120735056 /nfs/dbraw/zinc/73/50/56/1120735056.db2.gz XGVHUPSBOPHRGU-SOLBZPMBSA-N 1 3 278.484 3.667 20 0 CHADHO C[C@@H]1C[C@H]([N@H+]2CCC[C@@]3(CCCNC3)C2)CC(C)(C)C1 ZINC000228080076 1120735059 /nfs/dbraw/zinc/73/50/59/1120735059.db2.gz XGVHUPSBOPHRGU-SOLBZPMBSA-N 1 3 278.484 3.667 20 0 CHADHO CSc1ccc([C@H](C)[NH2+]CCCN2CCCCC2)cc1 ZINC000020546021 1120894825 /nfs/dbraw/zinc/89/48/25/1120894825.db2.gz RQXVDMPVGKKMAB-HNNXBMFYSA-N 1 3 292.492 3.935 20 0 CHADHO CCC1([NH3+])CCN([C@@H](c2ccc(OC)cc2)C(C)C)CC1 ZINC000925756642 1120902384 /nfs/dbraw/zinc/90/23/84/1120902384.db2.gz NSOGBADSJZZMQF-QGZVFWFLSA-N 1 3 290.451 3.596 20 0 CHADHO CC(C)C[C@H]([NH2+]C[C@H](C)CN(C)C)c1ccccc1 ZINC000311870685 1120970724 /nfs/dbraw/zinc/97/07/24/1120970724.db2.gz WUTRMHJNBODUHT-RDJZCZTQSA-N 1 3 262.441 3.561 20 0 CHADHO CC(C)C[C@H](NC[C@H](C)C[NH+](C)C)c1ccccc1 ZINC000311870685 1120970728 /nfs/dbraw/zinc/97/07/28/1120970728.db2.gz WUTRMHJNBODUHT-RDJZCZTQSA-N 1 3 262.441 3.561 20 0 CHADHO CC(C)C[C@@H]([NH2+]C[C@H](C)CN(C)C)c1ccccc1 ZINC000311870682 1120971181 /nfs/dbraw/zinc/97/11/81/1120971181.db2.gz WUTRMHJNBODUHT-DOTOQJQBSA-N 1 3 262.441 3.561 20 0 CHADHO CC(C)C[C@@H](NC[C@H](C)C[NH+](C)C)c1ccccc1 ZINC000311870682 1120971184 /nfs/dbraw/zinc/97/11/84/1120971184.db2.gz WUTRMHJNBODUHT-DOTOQJQBSA-N 1 3 262.441 3.561 20 0 CHADHO C([NH2+][C@H]1CCCC12CCCC2)[C@@H]1CCCN(CC2CC2)C1 ZINC000663465867 1120981104 /nfs/dbraw/zinc/98/11/04/1120981104.db2.gz LZOXZLRPPWCMRC-ROUUACIJSA-N 1 3 290.495 3.811 20 0 CHADHO CC[C@H]([NH2+]C[C@H]1CCCN(CC2CC2)C1)C1CCCC1 ZINC000663466624 1120983107 /nfs/dbraw/zinc/98/31/07/1120983107.db2.gz WCTQJMLGVSYBPD-AEFFLSMTSA-N 1 3 278.484 3.667 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCN(CC2CC2)C1)C1CCCCC1 ZINC000663466952 1120983183 /nfs/dbraw/zinc/98/31/83/1120983183.db2.gz BWKCXDSWMIXZNA-RDJZCZTQSA-N 1 3 278.484 3.667 20 0 CHADHO CC[C@H](NC[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccccc1 ZINC000663470177 1120985149 /nfs/dbraw/zinc/98/51/49/1120985149.db2.gz SSKHBUYHOKMJMM-HKUYNNGSSA-N 1 3 286.463 3.849 20 0 CHADHO CC[C@H](NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1 ZINC000663470177 1120985152 /nfs/dbraw/zinc/98/51/52/1120985152.db2.gz SSKHBUYHOKMJMM-HKUYNNGSSA-N 1 3 286.463 3.849 20 0 CHADHO C[C@H](N[C@H]1CC12CC[NH2+]CC2)c1ccc(Cl)cc1Cl ZINC000643533894 1121009606 /nfs/dbraw/zinc/00/96/06/1121009606.db2.gz HOYFMNWFNFGSSJ-HZMBPMFUSA-N 1 3 299.245 3.786 20 0 CHADHO CCCC[N@H+](CCC(C)(C)O)C1CC(C)(C)NC(C)(C)C1 ZINC001174983304 1121141562 /nfs/dbraw/zinc/14/15/62/1121141562.db2.gz GKWGFCKZMRTQKE-UHFFFAOYSA-N 1 3 298.515 3.559 20 0 CHADHO CCCC[N@@H+](CCC(C)(C)O)C1CC(C)(C)NC(C)(C)C1 ZINC001174983304 1121141564 /nfs/dbraw/zinc/14/15/64/1121141564.db2.gz GKWGFCKZMRTQKE-UHFFFAOYSA-N 1 3 298.515 3.559 20 0 CHADHO CCC1CCC([NH2+]CCCN2C[C@@H](C)C[C@H](C)C2)CC1 ZINC001177295008 1121720669 /nfs/dbraw/zinc/72/06/69/1121720669.db2.gz WAGFALRNLAIJAH-VYMRPNJYSA-N 1 3 280.500 3.913 20 0 CHADHO CCCC1CCC(C[NH2+]C[C@H](C)CN2CCCC2)CC1 ZINC001177328931 1121724764 /nfs/dbraw/zinc/72/47/64/1121724764.db2.gz WAGCMNAOLWSVMC-AOCRQIFASA-N 1 3 280.500 3.914 20 0 CHADHO CC[N@H+](CCC1CCN(C/C=C\Cl)CC1)CC(C)C ZINC000773733390 1121773593 /nfs/dbraw/zinc/77/35/93/1121773593.db2.gz ZNQXIXGMKQROIF-UITAMQMPSA-N 1 3 286.891 3.819 20 0 CHADHO CC[N@@H+](CCC1CCN(C/C=C\Cl)CC1)CC(C)C ZINC000773733390 1121773601 /nfs/dbraw/zinc/77/36/01/1121773601.db2.gz ZNQXIXGMKQROIF-UITAMQMPSA-N 1 3 286.891 3.819 20 0 CHADHO CC[N@H+](Cc1ccccc1)C1CCN([C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167939623 1121776378 /nfs/dbraw/zinc/77/63/78/1121776378.db2.gz MXVMBHRHFYIYCG-RUYXUALKSA-N 1 3 298.474 3.771 20 0 CHADHO CC[N@@H+](Cc1ccccc1)C1CCN([C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167939623 1121776384 /nfs/dbraw/zinc/77/63/84/1121776384.db2.gz MXVMBHRHFYIYCG-RUYXUALKSA-N 1 3 298.474 3.771 20 0 CHADHO CC1(C)CCC[C@@H](C[N@@H+]2CC[C@@H](CN3CCCC3)C2)C1 ZINC001179873174 1121922449 /nfs/dbraw/zinc/92/24/49/1121922449.db2.gz FANLFAHEOHCCFK-SJORKVTESA-N 1 3 278.484 3.621 20 0 CHADHO CC1(C)CCC[C@@H](C[N@H+]2CC[C@@H](CN3CCCC3)C2)C1 ZINC001179873174 1121922457 /nfs/dbraw/zinc/92/24/57/1121922457.db2.gz FANLFAHEOHCCFK-SJORKVTESA-N 1 3 278.484 3.621 20 0 CHADHO Clc1ccc([C@@H](NC[C@@H]2CCC[NH2+]C2)C2CCC2)cc1 ZINC000420399049 1122003555 /nfs/dbraw/zinc/00/35/55/1122003555.db2.gz HMPSPKYYSRYSBV-DYVFJYSZSA-N 1 3 292.854 3.770 20 0 CHADHO C[C@H](N)C[NH2+][C@H](c1cccc(Cl)c1)C1CCCC1 ZINC000420422763 1122006113 /nfs/dbraw/zinc/00/61/13/1122006113.db2.gz ZNVXOJFWPPEIIX-NHYWBVRUSA-N 1 3 266.816 3.508 20 0 CHADHO C1CC2(C1)CC[C@@H]2[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000502475845 1122089278 /nfs/dbraw/zinc/08/92/78/1122089278.db2.gz WWCWIRGQQJCYFT-KRWDZBQOSA-N 1 3 276.468 3.706 20 0 CHADHO CN1CCC2(CCC[N@@H+]2Cc2cccc(C3CC3)c2)CC1 ZINC000421391179 1122111323 /nfs/dbraw/zinc/11/13/23/1122111323.db2.gz NCDKQGQWZRRQNF-UHFFFAOYSA-N 1 3 284.447 3.624 20 0 CHADHO CN1CCC2(CCC[N@H+]2Cc2cccc(C3CC3)c2)CC1 ZINC000421391179 1122111328 /nfs/dbraw/zinc/11/13/28/1122111328.db2.gz NCDKQGQWZRRQNF-UHFFFAOYSA-N 1 3 284.447 3.624 20 0 CHADHO CN1CCC[C@H]1CC[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000502721297 1122141791 /nfs/dbraw/zinc/14/17/91/1122141791.db2.gz IPDYHIFIXGMJKG-DLBZAZTESA-N 1 3 292.854 3.961 20 0 CHADHO CN1CCC[C@H]1CC[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000502721297 1122141794 /nfs/dbraw/zinc/14/17/94/1122141794.db2.gz IPDYHIFIXGMJKG-DLBZAZTESA-N 1 3 292.854 3.961 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+]CC[C@H](C)N(C)C ZINC001183105146 1122207364 /nfs/dbraw/zinc/20/73/64/1122207364.db2.gz ZEPIVJITDKOWFR-FUHWJXTLSA-N 1 3 276.468 3.718 20 0 CHADHO CN1C[C@@H]2CC[C@H]([NH2+]C3CCC(c4ccccc4)CC3)[C@@H]2C1 ZINC001184387483 1122272527 /nfs/dbraw/zinc/27/25/27/1122272527.db2.gz LFGSNAGWLOPSSI-ROOBUULFSA-N 1 3 298.474 3.643 20 0 CHADHO CCN(CC)CC[C@@H](C)[NH2+]C1CC(c2ccccc2C)C1 ZINC001184418958 1122275383 /nfs/dbraw/zinc/27/53/83/1122275383.db2.gz WMTCRPQKBANUHA-WWDZGPRUSA-N 1 3 288.479 3.951 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](C)c2cccc(CC(C)C)c2)C1 ZINC000514104974 1122375768 /nfs/dbraw/zinc/37/57/68/1122375768.db2.gz NWEFUJBQPDIATK-AEFFLSMTSA-N 1 3 288.479 3.878 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](C)c2cccc(CC(C)C)c2)C1 ZINC000514104974 1122375772 /nfs/dbraw/zinc/37/57/72/1122375772.db2.gz NWEFUJBQPDIATK-AEFFLSMTSA-N 1 3 288.479 3.878 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](C)c2cccc(CC(C)C)c2)C1 ZINC000514104974 1122375777 /nfs/dbraw/zinc/37/57/77/1122375777.db2.gz NWEFUJBQPDIATK-AEFFLSMTSA-N 1 3 288.479 3.878 20 0 CHADHO CCCC[NH2+][C@@H](C)c1ccc(OC)c(CN(CC)CC)c1 ZINC000775366635 1122528988 /nfs/dbraw/zinc/52/89/88/1122528988.db2.gz ZGOPPTWTTFGUGQ-HNNXBMFYSA-N 1 3 292.467 3.988 20 0 CHADHO CCN(CC)Cc1cc([C@H](C)[NH2+]C2CCC2)ccc1OC ZINC000775407203 1122551505 /nfs/dbraw/zinc/55/15/05/1122551505.db2.gz NGFXLECZZBIIDE-AWEZNQCLSA-N 1 3 290.451 3.740 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+][C@@H]2CCC(C)(C)C2)C1 ZINC000516038657 1122564628 /nfs/dbraw/zinc/56/46/28/1122564628.db2.gz WVUHWDXTIGIHKM-HZPDHXFCSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@H]1C[C@@H]([NH3+])CCN1CCCSc1ccccc1Cl ZINC000516659732 1122619085 /nfs/dbraw/zinc/61/90/85/1122619085.db2.gz CJCANLLJGJSKOZ-STQMWFEESA-N 1 3 298.883 3.634 20 0 CHADHO C[C@@H](C[NH2+][C@@H](CC1CCC1)c1ccccc1)CN(C)C ZINC000425916478 1122658545 /nfs/dbraw/zinc/65/85/45/1122658545.db2.gz FQXCFOVJEBYCRL-YJBOKZPZSA-N 1 3 274.452 3.705 20 0 CHADHO C[C@@H](CN[C@@H](CC1CCC1)c1ccccc1)C[NH+](C)C ZINC000425916478 1122658547 /nfs/dbraw/zinc/65/85/47/1122658547.db2.gz FQXCFOVJEBYCRL-YJBOKZPZSA-N 1 3 274.452 3.705 20 0 CHADHO C[C@@H](C[NH2+][C@@H](C)c1ccc(OC(C)(C)C)cc1)CN(C)C ZINC000425947102 1122675735 /nfs/dbraw/zinc/67/57/35/1122675735.db2.gz ZHISNVOOKZCYCW-GJZGRUSLSA-N 1 3 292.467 3.712 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H](C)c2cc3ccccc3[nH]2)C1 ZINC000775626772 1122830492 /nfs/dbraw/zinc/83/04/92/1122830492.db2.gz JNDOUINVPDDDOB-HOTGVXAUSA-N 1 3 299.462 3.939 20 0 CHADHO CC[C@H](C)C[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167966599 1122838286 /nfs/dbraw/zinc/83/82/86/1122838286.db2.gz XFGUAJSRWFLBBU-COSYGPSOSA-N 1 3 278.484 3.806 20 0 CHADHO CCC[N@H+](CC1CC1)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167981772 1122897465 /nfs/dbraw/zinc/89/74/65/1122897465.db2.gz JGKIOSDWAWYNGI-JWTNVVGKSA-N 1 3 276.468 3.514 20 0 CHADHO CCC[N@@H+](CC1CC1)C1C[C@H]2CC[C@@H](C1)N2CC1CC1 ZINC001167981772 1122897469 /nfs/dbraw/zinc/89/74/69/1122897469.db2.gz JGKIOSDWAWYNGI-JWTNVVGKSA-N 1 3 276.468 3.514 20 0 CHADHO CC[C@@H](c1ccccc1)N(C)CC[C@H]1CCCC[N@@H+]1C ZINC000441342231 1123080457 /nfs/dbraw/zinc/08/04/57/1123080457.db2.gz YDGIDQNXYXRKFQ-MSOLQXFVSA-N 1 3 274.452 3.944 20 0 CHADHO CC[C@@H](c1ccccc1)N(C)CC[C@H]1CCCC[N@H+]1C ZINC000441342231 1123080460 /nfs/dbraw/zinc/08/04/60/1123080460.db2.gz YDGIDQNXYXRKFQ-MSOLQXFVSA-N 1 3 274.452 3.944 20 0 CHADHO Cc1cc(C)cc(C[N@@H+](C)CC[C@@H]2CCCCN2C)c1 ZINC000441371939 1123081717 /nfs/dbraw/zinc/08/17/17/1123081717.db2.gz NSBNTAFDDBINMT-SFHVURJKSA-N 1 3 274.452 3.610 20 0 CHADHO Cc1cc(C)cc(C[N@H+](C)CC[C@@H]2CCCCN2C)c1 ZINC000441371939 1123081722 /nfs/dbraw/zinc/08/17/22/1123081722.db2.gz NSBNTAFDDBINMT-SFHVURJKSA-N 1 3 274.452 3.610 20 0 CHADHO C[C@@H]1[C@@H](C[NH3+])CCCN1Cc1ccc(C2CCC2)cc1 ZINC001205915238 1123087064 /nfs/dbraw/zinc/08/70/64/1123087064.db2.gz OXIFHRMDRZMHKQ-RDTXWAMCSA-N 1 3 272.436 3.513 20 0 CHADHO CC(C)(C)CN1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001201442896 1123105734 /nfs/dbraw/zinc/10/57/34/1123105734.db2.gz LRFWTIOQNBLKSY-UHFFFAOYSA-N 1 3 286.463 3.555 20 0 CHADHO CC(C)(C)CN1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001201442896 1123105738 /nfs/dbraw/zinc/10/57/38/1123105738.db2.gz LRFWTIOQNBLKSY-UHFFFAOYSA-N 1 3 286.463 3.555 20 0 CHADHO c1ccc(CC[N@H+]2CCCC[C@H]2CCN2CCCC2)cc1 ZINC001201602901 1123130666 /nfs/dbraw/zinc/13/06/66/1123130666.db2.gz DNEHDMCESDHZDK-IBGZPJMESA-N 1 3 286.463 3.570 20 0 CHADHO c1ccc(CC[N@@H+]2CCCC[C@H]2CCN2CCCC2)cc1 ZINC001201602901 1123130667 /nfs/dbraw/zinc/13/06/67/1123130667.db2.gz DNEHDMCESDHZDK-IBGZPJMESA-N 1 3 286.463 3.570 20 0 CHADHO c1ccc(CCN2CCCC[C@H]2CC[NH+]2CCCC2)cc1 ZINC001201602901 1123130668 /nfs/dbraw/zinc/13/06/68/1123130668.db2.gz DNEHDMCESDHZDK-IBGZPJMESA-N 1 3 286.463 3.570 20 0 CHADHO Cc1cc(N2CC[NH+](CCC(C)C)CC2)c2ccccc2n1 ZINC001201613611 1123131849 /nfs/dbraw/zinc/13/18/49/1123131849.db2.gz UOIOBDZAOQXVOI-UHFFFAOYSA-N 1 3 297.446 3.711 20 0 CHADHO Cc1c(CN(C(C)C)[C@H]2CCC[NH2+]CC2)ccc(F)c1F ZINC001206598767 1129101509 /nfs/dbraw/zinc/10/15/09/1129101509.db2.gz MLAFVPDQFFMQRJ-HNNXBMFYSA-N 1 3 296.405 3.626 20 0 CHADHO CCCCCC[N@@H+]1CCCC[C@H]1C[C@@H]1CCCN1C ZINC001201754153 1123146391 /nfs/dbraw/zinc/14/63/91/1123146391.db2.gz OQXUEUNKCCJUTP-IRXDYDNUSA-N 1 3 266.473 3.906 20 0 CHADHO CCCCCC[N@H+]1CCCC[C@H]1C[C@@H]1CCCN1C ZINC001201754153 1123146392 /nfs/dbraw/zinc/14/63/92/1123146392.db2.gz OQXUEUNKCCJUTP-IRXDYDNUSA-N 1 3 266.473 3.906 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](NCc2ccc(-c3cccs3)cc2)C1 ZINC000665238513 1123241315 /nfs/dbraw/zinc/24/13/15/1123241315.db2.gz ZXEUCOLERXXIMY-HZPDHXFCSA-N 1 3 286.444 3.775 20 0 CHADHO CC(C)[C@H](Cc1ccccc1)[NH2+][C@H]1CCC[C@H](N(C)C)C1 ZINC000427695294 1123242038 /nfs/dbraw/zinc/24/20/38/1123242038.db2.gz LSHIHNONSAEYOE-FHWLQOOXSA-N 1 3 288.479 3.716 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]C[C@H]1C[C@H](C)C[C@H](C)C1 ZINC000665239644 1123243963 /nfs/dbraw/zinc/24/39/63/1123243963.db2.gz WHYTXIOQZOKASO-KNCOVGOOSA-N 1 3 289.467 3.572 20 0 CHADHO C[C@@H]([NH2+]CC1(N)CCCC1)c1cccc2ccccc21 ZINC000665250673 1123265414 /nfs/dbraw/zinc/26/54/14/1123265414.db2.gz ZCFRAWZXSHHGDT-CQSZACIVSA-N 1 3 268.404 3.762 20 0 CHADHO CCSc1ccc([C@@H](C)NCC[C@@H]([NH3+])C(C)C)cc1 ZINC000665280792 1123312503 /nfs/dbraw/zinc/31/25/03/1123312503.db2.gz LUIOIJNACBRVQZ-CZUORRHYSA-N 1 3 280.481 3.823 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2NCC[C@@H]([NH3+])C(C)C ZINC000665280664 1123313640 /nfs/dbraw/zinc/31/36/40/1123313640.db2.gz INWJGWNQCAJPJX-BMFZPTHFSA-N 1 3 260.425 3.506 20 0 CHADHO CSc1ccccc1[C@@H](C)[NH2+]CCCN1CCCCC1 ZINC000442642169 1123332043 /nfs/dbraw/zinc/33/20/43/1123332043.db2.gz DWJARSURPGUELE-OAHLLOKOSA-N 1 3 292.492 3.935 20 0 CHADHO C[C@H](CSC(C)(C)C)[NH2+]C[C@H]1CCCN(CC2CC2)C1 ZINC000853239625 1123429353 /nfs/dbraw/zinc/42/93/53/1123429353.db2.gz ITIVZORDYWKPIR-GDBMZVCRSA-N 1 3 298.540 3.618 20 0 CHADHO CCC1([NH+]2CCC2)CCN(C[C@H]2C[C@H]2c2ccccc2)CC1 ZINC000895827015 1123516937 /nfs/dbraw/zinc/51/69/37/1123516937.db2.gz BBLXCLMBQQPAAD-MOPGFXCFSA-N 1 3 298.474 3.740 20 0 CHADHO CCC1(N2CCC2)CC[NH+](C[C@H]2C[C@H]2c2ccccc2)CC1 ZINC000895827015 1123516942 /nfs/dbraw/zinc/51/69/42/1123516942.db2.gz BBLXCLMBQQPAAD-MOPGFXCFSA-N 1 3 298.474 3.740 20 0 CHADHO Cc1cc(C)c(C[N@H+]2CCC[C@@H](N(C)C)CC2)c(C)c1 ZINC000429533153 1123563850 /nfs/dbraw/zinc/56/38/50/1123563850.db2.gz ZICLNDPGPQVAAD-QGZVFWFLSA-N 1 3 274.452 3.528 20 0 CHADHO Cc1cc(C)c(C[N@@H+]2CCC[C@@H](N(C)C)CC2)c(C)c1 ZINC000429533153 1123563853 /nfs/dbraw/zinc/56/38/53/1123563853.db2.gz ZICLNDPGPQVAAD-QGZVFWFLSA-N 1 3 274.452 3.528 20 0 CHADHO Cc1cc(C)c(CN2CCC[C@@H]([NH+](C)C)CC2)c(C)c1 ZINC000429533153 1123563856 /nfs/dbraw/zinc/56/38/56/1123563856.db2.gz ZICLNDPGPQVAAD-QGZVFWFLSA-N 1 3 274.452 3.528 20 0 CHADHO CN(C)[C@@H]1CCC[N@H+](CC2CCC(C)(C)CC2)CC1 ZINC000429541297 1123595233 /nfs/dbraw/zinc/59/52/33/1123595233.db2.gz OHXJNGZJELDBDN-MRXNPFEDSA-N 1 3 266.473 3.619 20 0 CHADHO CN(C)[C@@H]1CCC[N@@H+](CC2CCC(C)(C)CC2)CC1 ZINC000429541297 1123595237 /nfs/dbraw/zinc/59/52/37/1123595237.db2.gz OHXJNGZJELDBDN-MRXNPFEDSA-N 1 3 266.473 3.619 20 0 CHADHO C[C@H]([NH3+])[C@H]1CCN(Cc2ccc(-c3ccccc3)s2)C1 ZINC000346694002 1123706752 /nfs/dbraw/zinc/70/67/52/1123706752.db2.gz RBFYYLJRRZIMIO-ZFWWWQNUSA-N 1 3 286.444 3.584 20 0 CHADHO [NH3+][C@@H]1CC[C@@H]2CN(Cc3cc(-c4ccccc4)cs3)C[C@@H]12 ZINC000346826982 1123724248 /nfs/dbraw/zinc/72/42/48/1123724248.db2.gz FMBMURKANLASKO-ZTFGCOKTSA-N 1 3 298.455 3.584 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]([NH2+][C@H]3CCNC34CCC4)C2)cc1 ZINC000863543353 1123875829 /nfs/dbraw/zinc/87/58/29/1123875829.db2.gz YKQIDYRPBLJYHX-SQNIBIBYSA-N 1 3 284.447 3.587 20 0 CHADHO Cc1ccc2c(c1)[C@H](NC1CC[NH+](C3CCC3)CC1)CCC2 ZINC000339071893 1123971646 /nfs/dbraw/zinc/97/16/46/1123971646.db2.gz VELSONQZWJCGGF-HXUWFJFHSA-N 1 3 298.474 3.979 20 0 CHADHO CS[C@H]1C[C@H](NC2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)C1 ZINC000866486343 1124071876 /nfs/dbraw/zinc/07/18/76/1124071876.db2.gz FDHHQFWLVLLPNH-HJWJTTGWSA-N 1 3 296.524 3.513 20 0 CHADHO CS[C@H]1C[C@H]([NH2+]C2CCN([C@H]3CCC[C@H](C)C3)CC2)C1 ZINC000866486343 1124071880 /nfs/dbraw/zinc/07/18/80/1124071880.db2.gz FDHHQFWLVLLPNH-HJWJTTGWSA-N 1 3 296.524 3.513 20 0 CHADHO CN1CCC[C@H](C[N@H+](C)C/C=C\c2ccc(Cl)cc2)C1 ZINC000508568626 1124115542 /nfs/dbraw/zinc/11/55/42/1124115542.db2.gz KWFHHMHNTFYKSM-OICCZTGUSA-N 1 3 292.854 3.627 20 0 CHADHO CN1CCC[C@H](C[N@@H+](C)C/C=C\c2ccc(Cl)cc2)C1 ZINC000508568626 1124115543 /nfs/dbraw/zinc/11/55/43/1124115543.db2.gz KWFHHMHNTFYKSM-OICCZTGUSA-N 1 3 292.854 3.627 20 0 CHADHO c1cc2c(cccc2CN[C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)[nH]1 ZINC000635011989 1129170016 /nfs/dbraw/zinc/17/00/16/1129170016.db2.gz IOXCMPBXMKVRIN-QXAKKESOSA-N 1 3 297.446 3.568 20 0 CHADHO CCN1CCC[C@@H](C[NH2+]CC[C@@H](C)c2ccccc2)C1 ZINC000447820971 1124528029 /nfs/dbraw/zinc/52/80/29/1124528029.db2.gz IUUAGFILIKDIEB-SJORKVTESA-N 1 3 274.452 3.502 20 0 CHADHO C[NH+](C)Cc1ccc(CNCc2cccc3ccoc32)cc1 ZINC000449059345 1124639744 /nfs/dbraw/zinc/63/97/44/1124639744.db2.gz BLPJQEMRLMVGJH-UHFFFAOYSA-N 1 3 294.398 3.784 20 0 CHADHO C(=C/c1ccccc1)\CCN1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000450437942 1125025523 /nfs/dbraw/zinc/02/55/23/1125025523.db2.gz LQNHEUVIEPBHOJ-KKSMZRNKSA-N 1 3 298.474 3.898 20 0 CHADHO CCC(F)(F)C(C)(C)C[NH2+][C@H]1C[C@@H](N)c2ccccc21 ZINC000530218445 1125134657 /nfs/dbraw/zinc/13/46/57/1125134657.db2.gz MLSGIQKDULDOJO-KGLIPLIRSA-N 1 3 282.378 3.792 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)CCc2ccccc2Cl)C[C@H]1C ZINC000531140590 1125196654 /nfs/dbraw/zinc/19/66/54/1125196654.db2.gz DKIUCFMUTWDKLI-GDBMZVCRSA-N 1 3 294.870 3.687 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)CCc2ccccc2Cl)C[C@H]1C ZINC000531140590 1125196658 /nfs/dbraw/zinc/19/66/58/1125196658.db2.gz DKIUCFMUTWDKLI-GDBMZVCRSA-N 1 3 294.870 3.687 20 0 CHADHO CCSc1ccc(C[NH2+]C2CCN(C(C)C)CC2)cc1 ZINC000883244487 1125383014 /nfs/dbraw/zinc/38/30/14/1125383014.db2.gz OGUSQANTRJZLFQ-UHFFFAOYSA-N 1 3 292.492 3.761 20 0 CHADHO CC(C)[N@@H+]1CC[C@H](CNCc2cccc3ccccc32)C1 ZINC000040620679 1125388784 /nfs/dbraw/zinc/38/87/84/1125388784.db2.gz BEKQGWDPRUEEBI-MRXNPFEDSA-N 1 3 282.431 3.660 20 0 CHADHO CC(C)[N@H+]1CC[C@H](CNCc2cccc3ccccc32)C1 ZINC000040620679 1125388787 /nfs/dbraw/zinc/38/87/87/1125388787.db2.gz BEKQGWDPRUEEBI-MRXNPFEDSA-N 1 3 282.431 3.660 20 0 CHADHO CCCC1CCC([NH2+]C[C@@H]2CCN(C(C)C)C2)CC1 ZINC000040622257 1125389350 /nfs/dbraw/zinc/38/93/50/1125389350.db2.gz NRMRCCBXMMZXAO-CGZBRXJRSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)CC(CC(C)C)[NH2+]C[C@H]1CCN(C(C)C)C1 ZINC000040622370 1125389405 /nfs/dbraw/zinc/38/94/05/1125389405.db2.gz OBLHIZKPGXVSSZ-MRXNPFEDSA-N 1 3 268.489 3.767 20 0 CHADHO CCC[NH+]1CCC(N[C@H](c2ccc(F)cc2)C(C)C)CC1 ZINC000035016578 1125422208 /nfs/dbraw/zinc/42/22/08/1125422208.db2.gz WPBFRKBUYMDSDX-SFHVURJKSA-N 1 3 292.442 3.987 20 0 CHADHO Cc1ccc([C@@H]2CCCN2CC[C@@H]2CCC[N@H+]2C)s1 ZINC000124020199 1125434253 /nfs/dbraw/zinc/43/42/53/1125434253.db2.gz CKIIULIKIXGELX-GJZGRUSLSA-N 1 3 278.465 3.678 20 0 CHADHO Cc1ccc([C@@H]2CCCN2CC[C@@H]2CCC[N@@H+]2C)s1 ZINC000124020199 1125434254 /nfs/dbraw/zinc/43/42/54/1125434254.db2.gz CKIIULIKIXGELX-GJZGRUSLSA-N 1 3 278.465 3.678 20 0 CHADHO C[C@@H](c1ccccc1Cl)N(C)CC1CC[NH+](C)CC1 ZINC000738312098 1129393209 /nfs/dbraw/zinc/39/32/09/1129393209.db2.gz OFAPMXVOYXYMNZ-ZDUSSCGKSA-N 1 3 280.843 3.675 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCCN1)c1cc2ccccc2s1 ZINC000643502297 1129443210 /nfs/dbraw/zinc/44/32/10/1129443210.db2.gz CDWSMIWQBRZLSU-GXTWGEPZSA-N 1 3 274.433 3.694 20 0 CHADHO COc1ccc([C@H](C)N[C@H]2CCC[NH2+]CC2)c2ccccc12 ZINC000643521475 1129444122 /nfs/dbraw/zinc/44/41/22/1129444122.db2.gz KOKKSWNCVUQOFE-GJZGRUSLSA-N 1 3 298.430 3.641 20 0 CHADHO C[C@@H](N[C@@H]1CCC[NH2+]CC1)c1cccc(-c2ccncc2)c1 ZINC000643522914 1129444152 /nfs/dbraw/zinc/44/41/52/1129444152.db2.gz USJOTOGRSXIGNI-DNVCBOLYSA-N 1 3 295.430 3.541 20 0 CHADHO C[N@H+](CCCN1CCCC1)[C@H]1CCc2cc(Cl)ccc21 ZINC000796055724 1129463901 /nfs/dbraw/zinc/46/39/01/1129463901.db2.gz DRJDISQQXPHDTN-KRWDZBQOSA-N 1 3 292.854 3.745 20 0 CHADHO C[N@@H+](CCCN1CCCC1)[C@H]1CCc2cc(Cl)ccc21 ZINC000796055724 1129463902 /nfs/dbraw/zinc/46/39/02/1129463902.db2.gz DRJDISQQXPHDTN-KRWDZBQOSA-N 1 3 292.854 3.745 20 0 CHADHO C(CN1CCC(C2CC2)CC1)C[NH+]1CCC(C2CC2)CC1 ZINC000644719765 1129476684 /nfs/dbraw/zinc/47/66/84/1129476684.db2.gz HHWWNLIXEFRELF-UHFFFAOYSA-N 1 3 290.495 3.621 20 0 CHADHO C[C@@H]1CCC[C@H](N2CCC([NH2+][C@@H]3CC[C@@H]4C[C@@H]4C3)CC2)C1 ZINC000647355866 1129574689 /nfs/dbraw/zinc/57/46/89/1129574689.db2.gz DHUDVRUHRPRSPI-RTYCURFASA-N 1 3 290.495 3.808 20 0 CHADHO C[C@@H]1CC[C@H](N[C@H](C[NH3+])c2ccc3ccccc3c2)C1 ZINC000253259718 1129624436 /nfs/dbraw/zinc/62/44/36/1129624436.db2.gz HOPZDBDYOOZPMX-JEBQAFNWSA-N 1 3 268.404 3.618 20 0 CHADHO CCC[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccs1 ZINC001169096065 1129696163 /nfs/dbraw/zinc/69/61/63/1129696163.db2.gz UJPJZIHJCKCRPY-LXTVHRRPSA-N 1 3 278.465 3.804 20 0 CHADHO CCC[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccs1 ZINC001169096065 1129696164 /nfs/dbraw/zinc/69/61/64/1129696164.db2.gz UJPJZIHJCKCRPY-LXTVHRRPSA-N 1 3 278.465 3.804 20 0 CHADHO CCc1ccc([C@@H](CC)N[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC001169120164 1129699792 /nfs/dbraw/zinc/69/97/92/1129699792.db2.gz YZOONMLALYTORT-FCGDIQPGSA-N 1 3 286.463 3.915 20 0 CHADHO CCc1ccc([C@@H](CC)N[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC001169120164 1129699794 /nfs/dbraw/zinc/69/97/94/1129699794.db2.gz YZOONMLALYTORT-FCGDIQPGSA-N 1 3 286.463 3.915 20 0 CHADHO CN(Cc1cccc2ccccc21)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169140215 1129699817 /nfs/dbraw/zinc/69/98/17/1129699817.db2.gz JBEWJOISIFYIPK-BWTSREIZSA-N 1 3 294.442 3.897 20 0 CHADHO CN(Cc1cccc2ccccc21)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169140215 1129699818 /nfs/dbraw/zinc/69/98/18/1129699818.db2.gz JBEWJOISIFYIPK-BWTSREIZSA-N 1 3 294.442 3.897 20 0 CHADHO CC(C)C[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC001169090659 1129699901 /nfs/dbraw/zinc/69/99/01/1129699901.db2.gz KEBYDGAQFKFIGX-FCGDIQPGSA-N 1 3 286.463 3.989 20 0 CHADHO CC(C)C[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC001169090659 1129699902 /nfs/dbraw/zinc/69/99/02/1129699902.db2.gz KEBYDGAQFKFIGX-FCGDIQPGSA-N 1 3 286.463 3.989 20 0 CHADHO CC[NH+]1CCC(N[C@@H](CC(C)C)c2cccc(F)c2)CC1 ZINC001169230064 1129710766 /nfs/dbraw/zinc/71/07/66/1129710766.db2.gz MSYAIYXONUNJKU-SFHVURJKSA-N 1 3 292.442 3.987 20 0 CHADHO CC[NH+]1CCC(N[C@@H](C)c2ccc(Cl)c(C)c2)CC1 ZINC001169233135 1129711082 /nfs/dbraw/zinc/71/10/82/1129711082.db2.gz MLHSLKQFUICKKB-ZDUSSCGKSA-N 1 3 280.843 3.783 20 0 CHADHO CC(C)[C@H]([NH2+]CCCN1CCCCC1)c1ccc(F)cc1 ZINC001169754111 1129754140 /nfs/dbraw/zinc/75/41/40/1129754140.db2.gz GKOONIISSFIBLB-SFHVURJKSA-N 1 3 292.442 3.988 20 0 CHADHO CC(C)[C@H](NCCC[NH+]1CCCCC1)c1ccc(F)cc1 ZINC001169754111 1129754141 /nfs/dbraw/zinc/75/41/41/1129754141.db2.gz GKOONIISSFIBLB-SFHVURJKSA-N 1 3 292.442 3.988 20 0 CHADHO CC(C)C[C@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccc(F)cc1 ZINC000652151431 1129758969 /nfs/dbraw/zinc/75/89/69/1129758969.db2.gz SLWSAVXHLGMNOW-YJBOKZPZSA-N 1 3 292.442 3.844 20 0 CHADHO CC(C)C[C@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccc(F)cc1 ZINC000652151431 1129758971 /nfs/dbraw/zinc/75/89/71/1129758971.db2.gz SLWSAVXHLGMNOW-YJBOKZPZSA-N 1 3 292.442 3.844 20 0 CHADHO C[C@H]1CCC[C@H](N2CCC([NH2+]C3(C4CCC4)CC3)CC2)C1 ZINC000652272769 1129761904 /nfs/dbraw/zinc/76/19/04/1129761904.db2.gz VYMQBCZPISNQGN-YJBOKZPZSA-N 1 3 290.495 3.952 20 0 CHADHO Cc1ccsc1CN(C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768199020 1129838724 /nfs/dbraw/zinc/83/87/24/1129838724.db2.gz SKPPLPVYRCWMDI-UHFFFAOYSA-N 1 3 288.460 3.750 20 0 CHADHO CCCCCC1CCC([NH2+][C@@H]2CCNC[C@@H]2C)CC1 ZINC001246211263 1131401074 /nfs/dbraw/zinc/40/10/74/1131401074.db2.gz QDHSTUFRWVWEFV-ZGRYLRDCSA-N 1 3 266.473 3.713 20 0 CHADHO CCCC[C@H](CC)COCCC[NH2+][C@@H]1CCN[C@H](CC)C1 ZINC001246215031 1131404280 /nfs/dbraw/zinc/40/42/80/1131404280.db2.gz HUVYOVDOWGTARX-RCCFBDPRSA-N 1 3 298.515 3.730 20 0 CHADHO C[C@@]1(C[NH3+])CCCCN(Cc2ccc3ccsc3c2)C1 ZINC001206563934 1129996704 /nfs/dbraw/zinc/99/67/04/1129996704.db2.gz KYSYUSRKHQFTQM-KRWDZBQOSA-N 1 3 288.460 3.852 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NCCC2CCC(F)(F)CC2)c2ccccc21 ZINC000902456692 1130012661 /nfs/dbraw/zinc/01/26/61/1130012661.db2.gz QPFOOQFAWTWDHT-HZPDHXFCSA-N 1 3 294.389 3.936 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC2C[C@H]3CC[C@@H](C2)S3)CC1 ZINC000903159181 1130120386 /nfs/dbraw/zinc/12/03/86/1130120386.db2.gz IIDYZPHWXDWLCR-VHRNVKJDSA-N 1 3 296.524 3.513 20 0 CHADHO C[C@H](N[C@H](CC[NH+](C)C)c1cccnc1)C1CCCCC1 ZINC000903383578 1130168634 /nfs/dbraw/zinc/16/86/34/1130168634.db2.gz NOBUUAHUYWLOCD-MAUKXSAKSA-N 1 3 289.467 3.633 20 0 CHADHO CCN(Cc1ccccc1Cl)CC1CC[NH+](C)CC1 ZINC000788475606 1130189057 /nfs/dbraw/zinc/18/90/57/1130189057.db2.gz QRAFQCCAPPBPMB-UHFFFAOYSA-N 1 3 280.843 3.504 20 0 CHADHO Cc1c(Cl)ccc(CN2CCC[C@@H](C[NH3+])[C@H](C)C2)c1F ZINC001206036777 1130254019 /nfs/dbraw/zinc/25/40/19/1130254019.db2.gz PVYQVPFSPFEVNG-YPMHNXCESA-N 1 3 298.833 3.594 20 0 CHADHO C[N@H+]1CCC[C@@H]1CCN[C@@H](CC1CC1)c1ccccc1 ZINC000678776496 1130453761 /nfs/dbraw/zinc/45/37/61/1130453761.db2.gz GAJHQLLQWAQNMV-MSOLQXFVSA-N 1 3 272.436 3.602 20 0 CHADHO CN1CCC[C@@H]1CC[NH2+][C@@H](CC1CC1)c1ccccc1 ZINC000678776496 1130453752 /nfs/dbraw/zinc/45/37/52/1130453752.db2.gz GAJHQLLQWAQNMV-MSOLQXFVSA-N 1 3 272.436 3.602 20 0 CHADHO C[N@@H+]1CCC[C@@H]1CCN[C@@H](CC1CC1)c1ccccc1 ZINC000678776496 1130453757 /nfs/dbraw/zinc/45/37/57/1130453757.db2.gz GAJHQLLQWAQNMV-MSOLQXFVSA-N 1 3 272.436 3.602 20 0 CHADHO CN(CC[C@H]1CCCC[N@@H+]1C)C[C@H]1CCc2ccccc21 ZINC000679535072 1130536067 /nfs/dbraw/zinc/53/60/67/1130536067.db2.gz UNUNPVHNIZIAJU-QZTJIDSGSA-N 1 3 286.463 3.523 20 0 CHADHO CN(CC[C@H]1CCCC[N@H+]1C)C[C@H]1CCc2ccccc21 ZINC000679535072 1130536070 /nfs/dbraw/zinc/53/60/70/1130536070.db2.gz UNUNPVHNIZIAJU-QZTJIDSGSA-N 1 3 286.463 3.523 20 0 CHADHO CCC(CC)C[NH2+][C@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000679738936 1130553057 /nfs/dbraw/zinc/55/30/57/1130553057.db2.gz GVHQFAIWSVLKPB-ZBFHGGJFSA-N 1 3 266.473 3.665 20 0 CHADHO c1ccc2cc(CN3CCC[C@]4(CCC[NH2+]4)CC3)ccc2c1 ZINC001235039895 1130704580 /nfs/dbraw/zinc/70/45/80/1130704580.db2.gz JBEGMJPFUCBHOJ-HXUWFJFHSA-N 1 3 294.442 3.948 20 0 CHADHO Cc1csc(CN2CCC3(CC[NH2+]CC3)CC2)c1Cl ZINC001235136259 1130712835 /nfs/dbraw/zinc/71/28/35/1130712835.db2.gz VACQBHCRIVOKNV-UHFFFAOYSA-N 1 3 298.883 3.676 20 0 CHADHO CC(C)Cc1ccc(C[N@@H+]2CCCC23CCNCC3)cc1 ZINC001235145891 1130714744 /nfs/dbraw/zinc/71/47/44/1130714744.db2.gz XPMYDGNYIRRZGP-UHFFFAOYSA-N 1 3 286.463 3.603 20 0 CHADHO CC(C)Cc1ccc(C[N@H+]2CCCC23CCNCC3)cc1 ZINC001235145891 1130714747 /nfs/dbraw/zinc/71/47/47/1130714747.db2.gz XPMYDGNYIRRZGP-UHFFFAOYSA-N 1 3 286.463 3.603 20 0 CHADHO C[C@H](CC[N@@H+]1CCCC12CCNCC2)CC(C)(C)C ZINC001235141324 1130715061 /nfs/dbraw/zinc/71/50/61/1130715061.db2.gz QZEHIZXNPAQNRM-OAHLLOKOSA-N 1 3 266.473 3.667 20 0 CHADHO C[C@H](CC[N@H+]1CCCC12CCNCC2)CC(C)(C)C ZINC001235141324 1130715064 /nfs/dbraw/zinc/71/50/64/1130715064.db2.gz QZEHIZXNPAQNRM-OAHLLOKOSA-N 1 3 266.473 3.667 20 0 CHADHO CCCC[C@H](CC)C[N@@H+]1CCCC[C@@]12CCCNC2 ZINC001235176033 1130718662 /nfs/dbraw/zinc/71/86/62/1130718662.db2.gz YXBANSHTHHZJJA-IRXDYDNUSA-N 1 3 266.473 3.811 20 0 CHADHO CCCC[C@H](CC)C[N@H+]1CCCC[C@@]12CCCNC2 ZINC001235176033 1130718667 /nfs/dbraw/zinc/71/86/67/1130718667.db2.gz YXBANSHTHHZJJA-IRXDYDNUSA-N 1 3 266.473 3.811 20 0 CHADHO CCCC[C@H](CC)CN1CCCC[C@@]12CCC[NH2+]C2 ZINC001235176033 1130718670 /nfs/dbraw/zinc/71/86/70/1130718670.db2.gz YXBANSHTHHZJJA-IRXDYDNUSA-N 1 3 266.473 3.811 20 0 CHADHO C[C@H](CN1CC[C@H]2[NH2+]CC[C@@H]2C1)c1cccc2ccccc21 ZINC001235257015 1130730448 /nfs/dbraw/zinc/73/04/48/1130730448.db2.gz WMYAUSKRLFFIST-WRWLIDTKSA-N 1 3 294.442 3.627 20 0 CHADHO CN(CCC[NH2+]C1CCCCC1)CCCc1ccccc1 ZINC001235669736 1130763833 /nfs/dbraw/zinc/76/38/33/1130763833.db2.gz JFXRONDFVSYOQU-UHFFFAOYSA-N 1 3 288.479 3.863 20 0 CHADHO Cc1ccc([C@H]2CCCN2CC[C@H]2CCCC[NH2+]2)cc1 ZINC001235679045 1130767651 /nfs/dbraw/zinc/76/76/51/1130767651.db2.gz OFJJMJOVAMCLLW-QZTJIDSGSA-N 1 3 272.436 3.664 20 0 CHADHO C[NH2+]C1CCN(C[C@@H](C)Cc2ccc(C(C)C)cc2)CC1 ZINC001235789942 1130779718 /nfs/dbraw/zinc/77/97/18/1130779718.db2.gz XKNGFMDJVZPQIW-INIZCTEOSA-N 1 3 288.479 3.672 20 0 CHADHO C[C@@H]1CC[C@@H](N)C[N@@H+]1Cc1cccc2c3ccccc3oc21 ZINC001235906829 1130803795 /nfs/dbraw/zinc/80/37/95/1130803795.db2.gz OVTLRNBVSYZYEZ-UKRRQHHQSA-N 1 3 294.398 3.898 20 0 CHADHO C[C@@H]1CC[C@@H](N)C[N@H+]1Cc1cccc2c3ccccc3oc21 ZINC001235906829 1130803799 /nfs/dbraw/zinc/80/37/99/1130803799.db2.gz OVTLRNBVSYZYEZ-UKRRQHHQSA-N 1 3 294.398 3.898 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CCC[C@H]1CCN ZINC001235925537 1130805833 /nfs/dbraw/zinc/80/58/33/1130805833.db2.gz TXHYIYRYYWHIDL-HOTGVXAUSA-N 1 3 252.446 3.572 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CCC[C@H]1CCN ZINC001235925537 1130805837 /nfs/dbraw/zinc/80/58/37/1130805837.db2.gz TXHYIYRYYWHIDL-HOTGVXAUSA-N 1 3 252.446 3.572 20 0 CHADHO CCCCCC[NH+](CCCCCC)CC1CNC1 ZINC001235948828 1130813886 /nfs/dbraw/zinc/81/38/86/1130813886.db2.gz SMKXXOFASDDQKB-UHFFFAOYSA-N 1 3 254.462 3.668 20 0 CHADHO COC(C)(C)CCC[C@@H](C)CC[N@H+](C)C[C@@H]1CCCNC1 ZINC001235952428 1130815276 /nfs/dbraw/zinc/81/52/76/1130815276.db2.gz XQNZIJOVSYBHRL-IAGOWNOFSA-N 1 3 298.515 3.539 20 0 CHADHO COC(C)(C)CCC[C@@H](C)CC[N@@H+](C)C[C@@H]1CCCNC1 ZINC001235952428 1130815279 /nfs/dbraw/zinc/81/52/79/1130815279.db2.gz XQNZIJOVSYBHRL-IAGOWNOFSA-N 1 3 298.515 3.539 20 0 CHADHO Cc1c(C)c(C)c(CN(C)C[C@H]2CCC[NH2+]C2)c(C)c1C ZINC001235956790 1130816969 /nfs/dbraw/zinc/81/69/69/1130816969.db2.gz IIGHFORZUHHXKV-SFHVURJKSA-N 1 3 288.479 3.660 20 0 CHADHO CN1C(C)(C)CC([NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1(C)C ZINC001170728784 1130832257 /nfs/dbraw/zinc/83/22/57/1130832257.db2.gz YCDONKOUVACKKK-XMQYKBBCSA-N 1 3 278.484 3.662 20 0 CHADHO C[C@@H]1C[C@H](N)C[N@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001236046409 1130837073 /nfs/dbraw/zinc/83/70/73/1130837073.db2.gz GGPOLPFVGNTJHF-QAPCUYQASA-N 1 3 280.415 3.523 20 0 CHADHO C[C@@H]1C[C@H](N)C[N@@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001236046409 1130837079 /nfs/dbraw/zinc/83/70/79/1130837079.db2.gz GGPOLPFVGNTJHF-QAPCUYQASA-N 1 3 280.415 3.523 20 0 CHADHO C[NH2+]C[C@H]1CCN(Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001236066017 1130846252 /nfs/dbraw/zinc/84/62/52/1130846252.db2.gz GLWBFPJCEISZEB-OAHLLOKOSA-N 1 3 298.405 3.534 20 0 CHADHO C[C@H]1C[N@H+](Cc2ccc(-c3ccccc3)cc2)CCCN1 ZINC001236094402 1130857411 /nfs/dbraw/zinc/85/74/11/1130857411.db2.gz DMLYMYPZQWIBOS-INIZCTEOSA-N 1 3 280.415 3.537 20 0 CHADHO C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3)cc2)CCCN1 ZINC001236094402 1130857419 /nfs/dbraw/zinc/85/74/19/1130857419.db2.gz DMLYMYPZQWIBOS-INIZCTEOSA-N 1 3 280.415 3.537 20 0 CHADHO CSc1ccccc1[C@H]1CCCN1C[C@H]1CCC[NH2+]C1 ZINC001236109670 1130866756 /nfs/dbraw/zinc/86/67/56/1130866756.db2.gz VNVLVDJVOLGJEG-GOEBONIOSA-N 1 3 290.476 3.545 20 0 CHADHO C[N@H+](Cc1ccc(C(C)(C)C)cc1)[C@@H]1CCCC[C@@H]1N ZINC001236211414 1130887900 /nfs/dbraw/zinc/88/79/00/1130887900.db2.gz HWMNYBZHMSXAHL-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO C[N@@H+](Cc1ccc(C(C)(C)C)cc1)[C@@H]1CCCC[C@@H]1N ZINC001236211414 1130887908 /nfs/dbraw/zinc/88/79/08/1130887908.db2.gz HWMNYBZHMSXAHL-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO Cc1c[nH+]c(-c2ccc(CN3CCCCC3)c(F)c2)cc1N ZINC001236244386 1130903680 /nfs/dbraw/zinc/90/36/80/1130903680.db2.gz KPXIRQAAJGUFOO-UHFFFAOYSA-N 1 3 299.393 3.764 20 0 CHADHO CCN(Cc1ccc(C(C)(C)CC)cc1)C[C@H]1CC[NH2+]C1 ZINC001236407407 1130931009 /nfs/dbraw/zinc/93/10/09/1130931009.db2.gz FAHAZOAMARSDSK-KRWDZBQOSA-N 1 3 288.479 3.806 20 0 CHADHO Cc1c(C)c(C)c(C[N@H+]2CCC[C@H](N)[C@H]2C)c(C)c1C ZINC001236421396 1130935866 /nfs/dbraw/zinc/93/58/66/1130935866.db2.gz QRRJPLBXVFBYAG-AEFFLSMTSA-N 1 3 274.452 3.540 20 0 CHADHO Cc1c(C)c(C)c(C[N@@H+]2CCC[C@H](N)[C@H]2C)c(C)c1C ZINC001236421396 1130935868 /nfs/dbraw/zinc/93/58/68/1130935868.db2.gz QRRJPLBXVFBYAG-AEFFLSMTSA-N 1 3 274.452 3.540 20 0 CHADHO CC(C)(C)C[N@H+](Cc1ccc2cc[nH]c2c1)C1CCNCC1 ZINC001236456299 1130946012 /nfs/dbraw/zinc/94/60/12/1130946012.db2.gz BCUUPVCYUZBWBK-UHFFFAOYSA-N 1 3 299.462 3.768 20 0 CHADHO CC(C)(C)C[N@@H+](Cc1ccc2cc[nH]c2c1)C1CCNCC1 ZINC001236456299 1130946018 /nfs/dbraw/zinc/94/60/18/1130946018.db2.gz BCUUPVCYUZBWBK-UHFFFAOYSA-N 1 3 299.462 3.768 20 0 CHADHO Cc1cc(C[N@H+](CC(C)(C)C)C2CCNCC2)sc1C ZINC001236459679 1130946083 /nfs/dbraw/zinc/94/60/83/1130946083.db2.gz XGJHERXHWAJLFU-UHFFFAOYSA-N 1 3 294.508 3.965 20 0 CHADHO Cc1cc(C[N@@H+](CC(C)(C)C)C2CCNCC2)sc1C ZINC001236459679 1130946087 /nfs/dbraw/zinc/94/60/87/1130946087.db2.gz XGJHERXHWAJLFU-UHFFFAOYSA-N 1 3 294.508 3.965 20 0 CHADHO CC(C)(C)C[N@H+](Cc1occc1[S-])[C@H]1CC[C@H]([NH3+])CC1 ZINC001236780461 1131007457 /nfs/dbraw/zinc/00/74/57/1131007457.db2.gz RUAGNEBPGDXSFA-JOCQHMNTSA-N 1 3 296.480 3.686 20 0 CHADHO CC(C)(C)C[N@@H+](Cc1occc1[S-])[C@H]1CC[C@H]([NH3+])CC1 ZINC001236780461 1131007462 /nfs/dbraw/zinc/00/74/62/1131007462.db2.gz RUAGNEBPGDXSFA-JOCQHMNTSA-N 1 3 296.480 3.686 20 0 CHADHO c1ccc(C2(CN3CC[C@@H]4[NH2+]CCC[C@@H]4C3)CCCC2)cc1 ZINC001237381236 1131092689 /nfs/dbraw/zinc/09/26/89/1131092689.db2.gz IIISACWTQMMXLP-MJGOQNOKSA-N 1 3 298.474 3.572 20 0 CHADHO CC(C)C1=NCCc2ccc(C[NH+]3C[C@@H]4CCC[C@H]4C3)cc21 ZINC001237880079 1131147957 /nfs/dbraw/zinc/14/79/57/1131147957.db2.gz CPRLZLZBBYAGNF-ROUUACIJSA-N 1 3 296.458 3.920 20 0 CHADHO C[C@@H](N[C@@H](c1ccccc1)C1CCCCC1)C1C[NH2+]C1 ZINC000817909101 1131188340 /nfs/dbraw/zinc/18/83/40/1131188340.db2.gz XULLHUZBBPOQIN-KDOFPFPSSA-N 1 3 272.436 3.506 20 0 CHADHO CC[C@@H]([NH2+][C@@H]1CCNC2(CCC2)C1)C1CCCCC1 ZINC000817987173 1131195080 /nfs/dbraw/zinc/19/50/80/1131195080.db2.gz XIFLMYSOMGVFGA-HZPDHXFCSA-N 1 3 264.457 3.610 20 0 CHADHO C[NH2+][C@@H](C)CCN[C@H](c1cccs1)C1CCCC1 ZINC001118121865 1131211095 /nfs/dbraw/zinc/21/10/95/1131211095.db2.gz KCMURVMZGJTQPY-WFASDCNBSA-N 1 3 266.454 3.567 20 0 CHADHO CCCC[C@H](CC)C[NH2+][C@@H]1CCN[C@H](C(C)(C)C)C1 ZINC001246235104 1131419784 /nfs/dbraw/zinc/41/97/84/1131419784.db2.gz XUESOEVXLKWPKY-XHSDSOJGSA-N 1 3 268.489 3.959 20 0 CHADHO CC[C@]1([NH2+]C2CCC3(CCCCC3)CC2)CCNC1 ZINC001246456448 1131505729 /nfs/dbraw/zinc/50/57/29/1131505729.db2.gz AOKPHYVRCKKHQK-KRWDZBQOSA-N 1 3 264.457 3.611 20 0 CHADHO CCCCCC[C@@H](CC)[NH2+][C@@H](C(C)C)C1CNC1 ZINC001246519213 1131545347 /nfs/dbraw/zinc/54/53/47/1131545347.db2.gz QYTFGLMZJQLENO-CVEARBPZSA-N 1 3 254.462 3.569 20 0 CHADHO CCCCCC1CCC([N@@H+]2CCC[C@@H](N)CC2)CC1 ZINC001246548426 1131598435 /nfs/dbraw/zinc/59/84/35/1131598435.db2.gz TYUGEMXOJROGGV-AQFXKWCLSA-N 1 3 266.473 3.939 20 0 CHADHO CCCCCC1CCC([N@H+]2CCC[C@@H](N)CC2)CC1 ZINC001246548426 1131598440 /nfs/dbraw/zinc/59/84/40/1131598440.db2.gz TYUGEMXOJROGGV-AQFXKWCLSA-N 1 3 266.473 3.939 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[N@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001246567228 1131634539 /nfs/dbraw/zinc/63/45/39/1131634539.db2.gz WHJDCOWCJYNWRL-VGWMRTNUSA-N 1 3 254.462 3.506 20 0 CHADHO CCCCC[C@H](CCC)[N@@H+]1CCC[C@H](CN)[C@@H]1C ZINC001246564312 1131628468 /nfs/dbraw/zinc/62/84/68/1131628468.db2.gz MNHZRLPECFKWPV-XHSDSOJGSA-N 1 3 254.462 3.795 20 0 CHADHO CCCCC[C@H](CCC)[N@H+]1CCC[C@H](CN)[C@@H]1C ZINC001246564312 1131628469 /nfs/dbraw/zinc/62/84/69/1131628469.db2.gz MNHZRLPECFKWPV-XHSDSOJGSA-N 1 3 254.462 3.795 20 0 CHADHO CCCC[C@H](CC(C)C)[N@@H+]1CCC[C@H](CN)[C@H]1C ZINC001246566716 1131633747 /nfs/dbraw/zinc/63/37/47/1131633747.db2.gz UYZUMAIXQIOVLP-BZUAXINKSA-N 1 3 254.462 3.651 20 0 CHADHO CCCC[C@H](CC(C)C)[N@H+]1CCC[C@H](CN)[C@H]1C ZINC001246566716 1131633750 /nfs/dbraw/zinc/63/37/50/1131633750.db2.gz UYZUMAIXQIOVLP-BZUAXINKSA-N 1 3 254.462 3.651 20 0 CHADHO CC(C)C[C@H](C)C[C@H](C)[N@@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001246567228 1131634537 /nfs/dbraw/zinc/63/45/37/1131634537.db2.gz WHJDCOWCJYNWRL-VGWMRTNUSA-N 1 3 254.462 3.506 20 0 CHADHO CCCC[C@H](CC(C)C)[N@@H+]1C[C@H](CF)[C@H](C2(N)CC2)C1 ZINC001246689308 1131780636 /nfs/dbraw/zinc/78/06/36/1131780636.db2.gz INTDLKHXRBRWHH-ARFHVFGLSA-N 1 3 284.463 3.600 20 0 CHADHO CCCC[C@H](CC(C)C)[N@H+]1C[C@H](CF)[C@H](C2(N)CC2)C1 ZINC001246689308 1131780644 /nfs/dbraw/zinc/78/06/44/1131780644.db2.gz INTDLKHXRBRWHH-ARFHVFGLSA-N 1 3 284.463 3.600 20 0 CHADHO CCCC[C@H]1C[C@H]([N@H+](C)CC2CCCCC2)CCN1 ZINC001246843471 1131786612 /nfs/dbraw/zinc/78/66/12/1131786612.db2.gz CPGDQZZKGHKDLV-DLBZAZTESA-N 1 3 266.473 3.809 20 0 CHADHO CCCC[C@H]1C[C@H]([N@@H+](C)CC2CCCCC2)CCN1 ZINC001246843471 1131786619 /nfs/dbraw/zinc/78/66/19/1131786619.db2.gz CPGDQZZKGHKDLV-DLBZAZTESA-N 1 3 266.473 3.809 20 0 CHADHO CC[C@@H]1CCC[N@@H+]([C@@H]2CCNC3(CCCCC3)C2)C1 ZINC001246850028 1131789733 /nfs/dbraw/zinc/78/97/33/1131789733.db2.gz SYRFPBGFVILXKP-HZPDHXFCSA-N 1 3 264.457 3.563 20 0 CHADHO CC[C@@H]1CCC[N@H+]([C@@H]2CCNC3(CCCCC3)C2)C1 ZINC001246850028 1131789736 /nfs/dbraw/zinc/78/97/36/1131789736.db2.gz SYRFPBGFVILXKP-HZPDHXFCSA-N 1 3 264.457 3.563 20 0 CHADHO CC(C)(C)[C@@H]1C[C@H]([NH+]2CCCCCCCC2)CCN1 ZINC001246920297 1131817350 /nfs/dbraw/zinc/81/73/50/1131817350.db2.gz MEKIOXYNERZKIJ-CVEARBPZSA-N 1 3 266.473 3.809 20 0 CHADHO CC1(C)CC[C@H]([N@H+](C[C@H]2CCCNC2)C2CCCC2)C1 ZINC001246937897 1131823141 /nfs/dbraw/zinc/82/31/41/1131823141.db2.gz NKAOUUKGIWWSBA-RDJZCZTQSA-N 1 3 278.484 3.809 20 0 CHADHO CC1(C)CC[C@H]([N@@H+](C[C@H]2CCCNC2)C2CCCC2)C1 ZINC001246937897 1131823148 /nfs/dbraw/zinc/82/31/48/1131823148.db2.gz NKAOUUKGIWWSBA-RDJZCZTQSA-N 1 3 278.484 3.809 20 0 CHADHO CN1CC2(C1)CC[NH+](Cc1cccc(C(C)(C)C)c1)CC2 ZINC001141106058 1132018910 /nfs/dbraw/zinc/01/89/10/1132018910.db2.gz LZDQAKJKFDFXFG-UHFFFAOYSA-N 1 3 286.463 3.512 20 0 CHADHO C[C@H]([NH2+][C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2)C1CCC1 ZINC000716634469 1132028675 /nfs/dbraw/zinc/02/86/75/1132028675.db2.gz BDVIMWUFTWKQQP-UUXHPUJUSA-N 1 3 298.474 3.818 20 0 CHADHO Cc1ccccc1CC[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001171613492 1132066110 /nfs/dbraw/zinc/06/61/10/1132066110.db2.gz LPMFUDBAMCVUIH-UHFFFAOYSA-N 1 3 288.479 3.779 20 0 CHADHO CC[C@@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001172107592 1132130043 /nfs/dbraw/zinc/13/00/43/1132130043.db2.gz FPFSCUJUAXIAIS-XMTFNYHQSA-N 1 3 290.426 3.882 20 0 CHADHO CC[C@@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001172107592 1132130044 /nfs/dbraw/zinc/13/00/44/1132130044.db2.gz FPFSCUJUAXIAIS-XMTFNYHQSA-N 1 3 290.426 3.882 20 0 CHADHO CN(C1CC1)C1CC[NH+]([C@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172567409 1132273264 /nfs/dbraw/zinc/27/32/64/1132273264.db2.gz DCGVFSMUEKYODC-XLIONFOSSA-N 1 3 298.474 3.881 20 0 CHADHO CCC[N@H+](CCCN)[C@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172538835 1132275812 /nfs/dbraw/zinc/27/58/12/1132275812.db2.gz UQNFAHMBDANJFQ-MSOLQXFVSA-N 1 3 274.452 3.774 20 0 CHADHO CCC[N@@H+](CCCN)[C@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172538835 1132275819 /nfs/dbraw/zinc/27/58/19/1132275819.db2.gz UQNFAHMBDANJFQ-MSOLQXFVSA-N 1 3 274.452 3.774 20 0 CHADHO CN(C)Cc1cc(F)cc(C[NH+]2CCC3(CCC3)CC2)c1 ZINC001232144995 1132427314 /nfs/dbraw/zinc/42/73/14/1132427314.db2.gz RCTLCNJGHUXZAG-UHFFFAOYSA-N 1 3 290.426 3.653 20 0 CHADHO CCCC[C@@H](CC(C)C)[NH+]1CCC2(CN(C)C2)CC1 ZINC001173259157 1132427838 /nfs/dbraw/zinc/42/78/38/1132427838.db2.gz HDIYXEVZMNGWBU-INIZCTEOSA-N 1 3 266.473 3.619 20 0 CHADHO CCCC[C@H](CC(C)C)[NH+]1CCC2(CN(C)C2)CC1 ZINC001173259158 1132428264 /nfs/dbraw/zinc/42/82/64/1132428264.db2.gz HDIYXEVZMNGWBU-MRXNPFEDSA-N 1 3 266.473 3.619 20 0 CHADHO C[C@H]1CCC[N@H+](Cc2cc(F)cc(CN(C)C)c2)[C@H]1C ZINC001232146774 1132428095 /nfs/dbraw/zinc/42/80/95/1132428095.db2.gz HCSJBNQUHHQBSA-KBPBESRZSA-N 1 3 278.415 3.508 20 0 CHADHO C[C@H]1CCC[N@@H+](Cc2cc(F)cc(CN(C)C)c2)[C@H]1C ZINC001232146774 1132428098 /nfs/dbraw/zinc/42/80/98/1132428098.db2.gz HCSJBNQUHHQBSA-KBPBESRZSA-N 1 3 278.415 3.508 20 0 CHADHO CC[C@@H]1CC[C@@H](N2CCC([NH3+])(c3cccc(F)c3)CC2)C1 ZINC001173269033 1132434431 /nfs/dbraw/zinc/43/44/31/1132434431.db2.gz FSFZCJQNLGOCLI-RHSMWYFYSA-N 1 3 290.426 3.654 20 0 CHADHO CC[C@@H]1CC[C@H](N2CCC([NH3+])(c3ccc(F)cc3)CC2)C1 ZINC001173270597 1132435662 /nfs/dbraw/zinc/43/56/62/1132435662.db2.gz NWOYBUFDCUSRDD-PBHICJAKSA-N 1 3 290.426 3.654 20 0 CHADHO CC[C@@H]1CC[C@H]([N@@H+](Cc2ccccc2)C[C@@H](C)CN)C1 ZINC001173272851 1132437561 /nfs/dbraw/zinc/43/75/61/1132437561.db2.gz LNLCIFRWRUKATM-JZXOWHBKSA-N 1 3 274.452 3.662 20 0 CHADHO CC[C@@H]1CC[C@H]([N@H+](Cc2ccccc2)C[C@@H](C)CN)C1 ZINC001173272851 1132437563 /nfs/dbraw/zinc/43/75/63/1132437563.db2.gz LNLCIFRWRUKATM-JZXOWHBKSA-N 1 3 274.452 3.662 20 0 CHADHO Cc1cnccc1Nc1ccc(C[NH+]2CCCCC2)cc1 ZINC001174537494 1132897201 /nfs/dbraw/zinc/89/72/01/1132897201.db2.gz HVKXKAFTACSFGU-UHFFFAOYSA-N 1 3 281.403 3.541 20 0 CHADHO CC(C)C[N@@H+]1CCCC2=C[C@H]3C[C@H](CN4CCCC[C@H]34)[C@@H]21 ZINC000299822549 1132992473 /nfs/dbraw/zinc/99/24/73/1132992473.db2.gz AJOIBIIICFESCC-WJFTUGDTSA-N 1 3 288.479 3.537 20 0 CHADHO CC(C)C[N@H+]1CCCC2=C[C@H]3C[C@H](CN4CCCC[C@H]34)[C@@H]21 ZINC000299822549 1132992475 /nfs/dbraw/zinc/99/24/75/1132992475.db2.gz AJOIBIIICFESCC-WJFTUGDTSA-N 1 3 288.479 3.537 20 0 CHADHO Cc1cc2cc(NC[C@@H]3CCC[NH2+]C[C@H]3C)ccc2cn1 ZINC001162472911 1133081095 /nfs/dbraw/zinc/08/10/95/1133081095.db2.gz ZQCBDYCTAAMBEL-HIFRSBDPSA-N 1 3 283.419 3.591 20 0 CHADHO C[NH+]1CCC2(CCN(Cc3ccccc3Cl)CC2)CC1 ZINC001203385054 1133321213 /nfs/dbraw/zinc/32/12/13/1133321213.db2.gz IFHMMHCJVKORIH-UHFFFAOYSA-N 1 3 292.854 3.648 20 0 CHADHO Cc1cc(C)c(C[N@H+](C)CCCN2CCCC2)c(C)c1 ZINC001203745049 1133363356 /nfs/dbraw/zinc/36/33/56/1133363356.db2.gz LKMDJXHEAFUWSD-UHFFFAOYSA-N 1 3 274.452 3.530 20 0 CHADHO Cc1cc(C)c(C[N@@H+](C)CCCN2CCCC2)c(C)c1 ZINC001203745049 1133363360 /nfs/dbraw/zinc/36/33/60/1133363360.db2.gz LKMDJXHEAFUWSD-UHFFFAOYSA-N 1 3 274.452 3.530 20 0 CHADHO CCCCN1CCC([N@@H+](C)Cc2sccc2C)CC1 ZINC001204024083 1133400861 /nfs/dbraw/zinc/40/08/61/1133400861.db2.gz VESWYIXSHNSFFL-UHFFFAOYSA-N 1 3 280.481 3.753 20 0 CHADHO CCCCN1CCC([N@H+](C)Cc2sccc2C)CC1 ZINC001204024083 1133400855 /nfs/dbraw/zinc/40/08/55/1133400855.db2.gz VESWYIXSHNSFFL-UHFFFAOYSA-N 1 3 280.481 3.753 20 0 CHADHO C[C@]1(N)CC[N@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001204782258 1133485814 /nfs/dbraw/zinc/48/58/14/1133485814.db2.gz BJCKNUSESSBTRP-SFHVURJKSA-N 1 3 280.371 3.509 20 0 CHADHO C[C@]1(N)CC[N@@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001204782258 1133485817 /nfs/dbraw/zinc/48/58/17/1133485817.db2.gz BJCKNUSESSBTRP-SFHVURJKSA-N 1 3 280.371 3.509 20 0 CHADHO CC(C)=CCCC1=CC[C@@H](CN2CC[C@@H]([NH3+])[C@H]2C)CC1 ZINC001205171143 1133541108 /nfs/dbraw/zinc/54/11/08/1133541108.db2.gz LEKJLOMJEGASQT-KBAYOESNSA-N 1 3 276.468 3.881 20 0 CHADHO CC(C)Cc1ccc(CN2CCC[C@](C)([NH3+])CC2)cc1 ZINC001205280746 1133554816 /nfs/dbraw/zinc/55/48/16/1133554816.db2.gz HSMKJQXJZKVBIJ-SFHVURJKSA-N 1 3 274.452 3.588 20 0 CHADHO C[C@]1([NH3+])CCCN(Cc2ccc3ccsc3c2)CC1 ZINC001205281520 1133555097 /nfs/dbraw/zinc/55/50/97/1133555097.db2.gz UIXATDJABFCJAS-INIZCTEOSA-N 1 3 274.433 3.605 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@@H+]1CC[C@@H](C)[C@H](CN)C1 ZINC001205296201 1133555924 /nfs/dbraw/zinc/55/59/24/1133555924.db2.gz ITFUAHIOUPJRRA-GVDBMIGSSA-N 1 3 298.515 3.525 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@H+]1CC[C@@H](C)[C@H](CN)C1 ZINC001205296201 1133555930 /nfs/dbraw/zinc/55/59/30/1133555930.db2.gz ITFUAHIOUPJRRA-GVDBMIGSSA-N 1 3 298.515 3.525 20 0 CHADHO C[C@H](C[N@@H+]1CC[C@H](C)[C@@H](CN)C1)c1cccc2ccccc21 ZINC001205296077 1133556254 /nfs/dbraw/zinc/55/62/54/1133556254.db2.gz GEVJZTLDRKQFBH-JZXOWHBKSA-N 1 3 296.458 3.860 20 0 CHADHO C[C@H](C[N@H+]1CC[C@H](C)[C@@H](CN)C1)c1cccc2ccccc21 ZINC001205296077 1133556256 /nfs/dbraw/zinc/55/62/56/1133556256.db2.gz GEVJZTLDRKQFBH-JZXOWHBKSA-N 1 3 296.458 3.860 20 0 CHADHO C[C@H]1CCN(Cc2cccc(-c3ccccc3)c2)C[C@H]1C[NH3+] ZINC001205305033 1133558216 /nfs/dbraw/zinc/55/82/16/1133558216.db2.gz QOTXRWUJYAUALK-OXJNMPFZSA-N 1 3 294.442 3.770 20 0 CHADHO Cc1ccc(F)c(CN2CC[C@@H](C)[C@H](C[NH3+])CC2)c1Cl ZINC001205617233 1133594953 /nfs/dbraw/zinc/59/49/53/1133594953.db2.gz INOPYZKAIWAQLW-YPMHNXCESA-N 1 3 298.833 3.594 20 0 CHADHO CC[C@@H](CCC(F)(F)F)[NH2+]CC(C)(C)CN1CCCC1 ZINC001205646044 1133598190 /nfs/dbraw/zinc/59/81/90/1133598190.db2.gz XGDKSNLOTGPFJO-ZDUSSCGKSA-N 1 3 294.405 3.819 20 0 CHADHO C[C@@H]1CCC[C@H](C[NH2+]CC(C)(C)CN2CCCC2)C1 ZINC001205646156 1133598860 /nfs/dbraw/zinc/59/88/60/1133598860.db2.gz YRMYFNLMUGMGJS-CVEARBPZSA-N 1 3 266.473 3.524 20 0 CHADHO C[C@H]1CCC[C@H](C[NH2+]CC(C)(C)CN2CCCC2)C1 ZINC001205646157 1133598990 /nfs/dbraw/zinc/59/89/90/1133598990.db2.gz YRMYFNLMUGMGJS-HOTGVXAUSA-N 1 3 266.473 3.524 20 0 CHADHO C[C@H]1CC[C@@H](CN)[N@H+](Cc2cccc3c(F)cccc23)C1 ZINC001205856558 1133623552 /nfs/dbraw/zinc/62/35/52/1133623552.db2.gz WUUWVUPEXPADRT-ZFWWWQNUSA-N 1 3 286.394 3.538 20 0 CHADHO C[C@H]1CC[C@@H](CN)[N@@H+](Cc2cccc3c(F)cccc23)C1 ZINC001205856558 1133623554 /nfs/dbraw/zinc/62/35/54/1133623554.db2.gz WUUWVUPEXPADRT-ZFWWWQNUSA-N 1 3 286.394 3.538 20 0 CHADHO C[C@@H]1CC[N@H+](Cc2cccc3c4ccccc4oc32)C[C@@H]1N ZINC001205872256 1133625350 /nfs/dbraw/zinc/62/53/50/1133625350.db2.gz JCCITYYVZFXMEH-DYVFJYSZSA-N 1 3 294.398 3.755 20 0 CHADHO C[C@@H]1CC[N@@H+](Cc2cccc3c4ccccc4oc32)C[C@@H]1N ZINC001205872256 1133625352 /nfs/dbraw/zinc/62/53/52/1133625352.db2.gz JCCITYYVZFXMEH-DYVFJYSZSA-N 1 3 294.398 3.755 20 0 CHADHO CC(C)(C)c1[nH]c2ccccc2c1C[N@@H+]1CCCC[C@@H](N)C1 ZINC001205930554 1133631720 /nfs/dbraw/zinc/63/17/20/1133631720.db2.gz ALCUITPXGAPUIJ-CQSZACIVSA-N 1 3 299.462 3.779 20 0 CHADHO CC(C)(C)c1[nH]c2ccccc2c1C[N@H+]1CCCC[C@@H](N)C1 ZINC001205930554 1133631724 /nfs/dbraw/zinc/63/17/24/1133631724.db2.gz ALCUITPXGAPUIJ-CQSZACIVSA-N 1 3 299.462 3.779 20 0 CHADHO N[C@H]1CCCC[N@H+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC001205932263 1133633345 /nfs/dbraw/zinc/63/33/45/1133633345.db2.gz PEWRLOMWHCXCTN-IBGZPJMESA-N 1 3 280.415 3.667 20 0 CHADHO N[C@H]1CCCC[N@@H+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC001205932263 1133633348 /nfs/dbraw/zinc/63/33/48/1133633348.db2.gz PEWRLOMWHCXCTN-IBGZPJMESA-N 1 3 280.415 3.667 20 0 CHADHO NC[C@@]1(F)CCCC[N@H+](Cc2ccc(C3CCC3)cc2)C1 ZINC001206370665 1133695486 /nfs/dbraw/zinc/69/54/86/1133695486.db2.gz OOUBPMWFEAHMDL-SFHVURJKSA-N 1 3 290.426 3.607 20 0 CHADHO NC[C@@]1(F)CCCC[N@@H+](Cc2ccc(C3CCC3)cc2)C1 ZINC001206370665 1133695488 /nfs/dbraw/zinc/69/54/88/1133695488.db2.gz OOUBPMWFEAHMDL-SFHVURJKSA-N 1 3 290.426 3.607 20 0 CHADHO CSc1ccc(Cl)cc1CN1CCC(CC[NH3+])CC1 ZINC001206507081 1133712197 /nfs/dbraw/zinc/71/21/97/1133712197.db2.gz ZVPXSAQOLWNRJF-UHFFFAOYSA-N 1 3 298.883 3.623 20 0 CHADHO CCc1ccc(CN(C(C)C)[C@@H]2CCC[NH2+]CC2)s1 ZINC001206592225 1133724300 /nfs/dbraw/zinc/72/43/00/1133724300.db2.gz YUNUPSOFQJEXDH-CQSZACIVSA-N 1 3 280.481 3.663 20 0 CHADHO Cc1c2ccccc2[nH]c1CN(C(C)C)[C@@H]1CCC[NH2+]CC1 ZINC001206591652 1133724607 /nfs/dbraw/zinc/72/46/07/1133724607.db2.gz URWOMQBCWFZACM-MRXNPFEDSA-N 1 3 299.462 3.829 20 0 CHADHO [NH3+]C[C@H]1CCCCN(Cc2ccc(F)c3ccccc23)C1 ZINC001206624260 1133729250 /nfs/dbraw/zinc/72/92/50/1133729250.db2.gz SFGNFRDDQANOPZ-CQSZACIVSA-N 1 3 286.394 3.540 20 0 CHADHO C1=C[C@@H]2C[C@H]1C[C@@H]2C[N@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001207627230 1133832628 /nfs/dbraw/zinc/83/26/28/1133832628.db2.gz UNYOHMFZXPXQFZ-WJFTUGDTSA-N 1 3 288.479 3.539 20 0 CHADHO C1=C[C@@H]2C[C@H]1C[C@@H]2C[N@@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001207627230 1133832634 /nfs/dbraw/zinc/83/26/34/1133832634.db2.gz UNYOHMFZXPXQFZ-WJFTUGDTSA-N 1 3 288.479 3.539 20 0 CHADHO CC[N@H+](CCCN1CCCCC1)Cc1ccc(F)cc1 ZINC001209449864 1134025027 /nfs/dbraw/zinc/02/50/27/1134025027.db2.gz BMWDNYJIJGBKPZ-UHFFFAOYSA-N 1 3 278.415 3.524 20 0 CHADHO CC[N@@H+](CCCN1CCCCC1)Cc1ccc(F)cc1 ZINC001209449864 1134025031 /nfs/dbraw/zinc/02/50/31/1134025031.db2.gz BMWDNYJIJGBKPZ-UHFFFAOYSA-N 1 3 278.415 3.524 20 0 CHADHO C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]23)C1 ZINC000309931838 1135118855 /nfs/dbraw/zinc/11/88/55/1135118855.db2.gz WPFPVZLIVCWSDY-XIKSMUEASA-N 1 3 298.474 3.675 20 0 CHADHO C[C@H]1CCN(Cc2ccc(-c3ccccc3)cc2)C[C@H]1C[NH3+] ZINC000317926504 1135176052 /nfs/dbraw/zinc/17/60/52/1135176052.db2.gz PFMAPLDZXNPKBZ-OXJNMPFZSA-N 1 3 294.442 3.770 20 0 CHADHO Cc1ccc2[nH]c(CN3CCC[C@@]34CCC[NH2+]CC4)cc2c1 ZINC001222316100 1135224156 /nfs/dbraw/zinc/22/41/56/1135224156.db2.gz SMKCKSPMCWLLRF-LJQANCHMSA-N 1 3 297.446 3.584 20 0 CHADHO Cc1cc(CN2CCC[C@]23CCC[NH2+]CC3)cc(C)c1F ZINC001222316802 1135225291 /nfs/dbraw/zinc/22/52/91/1135225291.db2.gz YOQNUAMXGVOFJT-SFHVURJKSA-N 1 3 290.426 3.551 20 0 CHADHO CC(C)(CC[N@@H+]1CC[C@@]2(C1)CCCCN2)c1ccccc1 ZINC001222420825 1135239753 /nfs/dbraw/zinc/23/97/53/1135239753.db2.gz HCXZZHQPGPLCEY-LJQANCHMSA-N 1 3 286.463 3.572 20 0 CHADHO CC(C)(CC[N@H+]1CC[C@@]2(C1)CCCCN2)c1ccccc1 ZINC001222420825 1135239758 /nfs/dbraw/zinc/23/97/58/1135239758.db2.gz HCXZZHQPGPLCEY-LJQANCHMSA-N 1 3 286.463 3.572 20 0 CHADHO C[C@H](NCc1ccc(C[NH+](C)C)cc1)c1cccs1 ZINC000171126806 335055911 /nfs/dbraw/zinc/05/59/11/335055911.db2.gz UPJJOIFMJPAITA-ZDUSSCGKSA-N 1 3 274.433 3.661 20 0 CHADHO Cc1cc([C@H](C)[NH2+]CCCN2CCCC2)c(C)s1 ZINC000020129215 171017539 /nfs/dbraw/zinc/01/75/39/171017539.db2.gz FEPFWDCUDLPOCO-ZDUSSCGKSA-N 1 3 266.454 3.501 20 0 CHADHO CN(C)CC(C)(C)C[NH2+]Cc1cc(Cl)cc(Cl)c1 ZINC000037423340 173198089 /nfs/dbraw/zinc/19/80/89/173198089.db2.gz FHYXYAYHMBPAQW-UHFFFAOYSA-N 1 3 289.250 3.671 20 0 CHADHO CCC(C)(C)C1CCC([N@@H+]2CC[C@H](CNC)C2)CC1 ZINC000071142140 176039998 /nfs/dbraw/zinc/03/99/98/176039998.db2.gz ROPBJJMRBUTBQK-QQFBHYJXSA-N 1 3 266.473 3.523 20 0 CHADHO CCC(C)(C)C1CCC([N@H+]2CC[C@H](CNC)C2)CC1 ZINC000071142140 176039999 /nfs/dbraw/zinc/03/99/99/176039999.db2.gz ROPBJJMRBUTBQK-QQFBHYJXSA-N 1 3 266.473 3.523 20 0 CHADHO CCC(C)(C)C1CCC(N2CC[C@H](C[NH2+]C)C2)CC1 ZINC000071142140 176040000 /nfs/dbraw/zinc/04/00/00/176040000.db2.gz ROPBJJMRBUTBQK-QQFBHYJXSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@H]([NH3+])[C@@H]1CCCN(Cc2cccc(-c3ccccc3)c2)C1 ZINC000347045666 226026979 /nfs/dbraw/zinc/02/69/79/226026979.db2.gz NVFQACYZBBMNPR-OXJNMPFZSA-N 1 3 294.442 3.913 20 0 CHADHO Cc1cc(NC[C@H](c2cccs2)N2CCCC2)cc[nH+]1 ZINC000302282536 227835872 /nfs/dbraw/zinc/83/58/72/227835872.db2.gz JKFUXFCKMQVISF-OAHLLOKOSA-N 1 3 287.432 3.701 20 0 CHADHO CSC1(C[NH2+][C@H](C)c2ccc(C)s2)CCN(C)CC1 ZINC000353632126 228136097 /nfs/dbraw/zinc/13/60/97/228136097.db2.gz RQXYDBRTSCZGAO-CYBMUJFWSA-N 1 3 298.521 3.535 20 0 CHADHO C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000193140380 228139351 /nfs/dbraw/zinc/13/93/51/228139351.db2.gz QIPZDVLCZASBJC-PBHICJAKSA-N 1 3 278.484 3.808 20 0 CHADHO Cc1oc2ccccc2c1CN[C@@H]1CC[N@@H+](C)[C@@H]2CCC[C@@H]21 ZINC000353679006 228143755 /nfs/dbraw/zinc/14/37/55/228143755.db2.gz FRHKATPLFHUVEH-KBAYOESNSA-N 1 3 298.430 3.704 20 0 CHADHO Cc1oc2ccccc2c1CN[C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21 ZINC000353679006 228143757 /nfs/dbraw/zinc/14/37/57/228143757.db2.gz FRHKATPLFHUVEH-KBAYOESNSA-N 1 3 298.430 3.704 20 0 CHADHO Cc1oc2ccccc2c1C[NH2+][C@@H]1CCN(C)[C@@H]2CCC[C@@H]21 ZINC000353679006 228143758 /nfs/dbraw/zinc/14/37/58/228143758.db2.gz FRHKATPLFHUVEH-KBAYOESNSA-N 1 3 298.430 3.704 20 0 CHADHO C[C@@H](C[NH2+]C1CCC(c2ccccc2)CC1)CN(C)C ZINC000312566867 260150814 /nfs/dbraw/zinc/15/08/14/260150814.db2.gz UHMAJFUYUDDPJC-ZLPCBKJTSA-N 1 3 274.452 3.500 20 0 CHADHO C[NH2+]C[C@H]1CCN([C@H](C)c2ccc(C(C)(C)C)cc2)C1 ZINC000071141970 260159718 /nfs/dbraw/zinc/15/97/18/260159718.db2.gz ZQYGNDAMHTVBMV-HUUCEWRRSA-N 1 3 274.452 3.586 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC2CCCCCC2)CC1 ZINC000089559869 260187789 /nfs/dbraw/zinc/18/77/89/260187789.db2.gz ADBBMPSYWSJGTF-UHFFFAOYSA-N 1 3 266.473 3.809 20 0 CHADHO C[C@H]1CC[C@H](NCCC[NH+]2CCCC2)c2ccccc21 ZINC000126474495 260353603 /nfs/dbraw/zinc/35/36/03/260353603.db2.gz HSVYGUZZRBZOFC-YJBOKZPZSA-N 1 3 272.436 3.701 20 0 CHADHO C[C@H]1CC[C@H]([NH2+]CCCN2CCCC2)c2ccccc21 ZINC000126474495 260353604 /nfs/dbraw/zinc/35/36/04/260353604.db2.gz HSVYGUZZRBZOFC-YJBOKZPZSA-N 1 3 272.436 3.701 20 0 CHADHO CC(C)c1ccc([C@H](C)N[C@@H]2CCC[NH2+]CC2)cc1 ZINC000129024127 260381059 /nfs/dbraw/zinc/38/10/59/260381059.db2.gz WOKIJJNWYVJXJN-WMLDXEAASA-N 1 3 260.425 3.603 20 0 CHADHO CCCC[C@H](CCC)[NH2+][C@@H]1CCN2CCC[C@@H]2C1 ZINC000161610130 261099022 /nfs/dbraw/zinc/09/90/22/261099022.db2.gz BHKFMHSGXPIIIX-ARFHVFGLSA-N 1 3 252.446 3.562 20 0 CHADHO C[C@@H]1CC[C@@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc21 ZINC000249059466 261239201 /nfs/dbraw/zinc/23/92/01/261239201.db2.gz ZQCLAHPYVPZRTG-UVKRDEOUSA-N 1 3 284.447 3.840 20 0 CHADHO C[C@@H]1CC[C@@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc21 ZINC000249059466 261239204 /nfs/dbraw/zinc/23/92/04/261239204.db2.gz ZQCLAHPYVPZRTG-UVKRDEOUSA-N 1 3 284.447 3.840 20 0 CHADHO CC1(C)CCCC[C@@H]1[NH2+]C1CCN(c2ccncc2)CC1 ZINC000094323920 261372286 /nfs/dbraw/zinc/37/22/86/261372286.db2.gz GZDPSCQUZSEJHK-KRWDZBQOSA-N 1 3 287.451 3.609 20 0 CHADHO CN(CCC1CCCCCC1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000394551384 261587937 /nfs/dbraw/zinc/58/79/37/261587937.db2.gz AOAVTIJWCUEIAA-SJPCQFCGSA-N 1 3 264.457 3.562 20 0 CHADHO C[C@@H](CCCC[NH3+])N[C@@H](C)c1ccccc1Br ZINC000310500489 262161798 /nfs/dbraw/zinc/16/17/98/262161798.db2.gz HTIZENCTGZIJQR-RYUDHWBXSA-N 1 3 299.256 3.617 20 0 CHADHO C[C@H](CCCC[NH3+])N[C@@H](C)c1ccccc1Br ZINC000310500487 262162024 /nfs/dbraw/zinc/16/20/24/262162024.db2.gz HTIZENCTGZIJQR-NEPJUHHUSA-N 1 3 299.256 3.617 20 0 CHADHO CC(C)c1ccc([C@H](C)N2CC[C@H]([NH3+])[C@H](C)C2)cc1 ZINC000094339105 262197832 /nfs/dbraw/zinc/19/78/32/262197832.db2.gz XTZFYPMPALEZND-KEYYUXOJSA-N 1 3 260.425 3.540 20 0 CHADHO CC(C)C[C@H](C)C[NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000499627023 262204670 /nfs/dbraw/zinc/20/46/70/262204670.db2.gz RETPPRISYJQMIG-YESZJQIVSA-N 1 3 280.500 3.911 20 0 CHADHO CSc1ccc([C@@H](C)[NH2+]CCCN2CCCCC2)cc1 ZINC000020546020 262249129 /nfs/dbraw/zinc/24/91/29/262249129.db2.gz RQXVDMPVGKKMAB-OAHLLOKOSA-N 1 3 292.492 3.935 20 0 CHADHO CC(C)c1ccc(C[NH2+]CCCN2CCCCC2)cc1 ZINC000021507794 262389728 /nfs/dbraw/zinc/38/97/28/262389728.db2.gz FNSASEILTVIJOI-UHFFFAOYSA-N 1 3 274.452 3.776 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@H]1CC[C@H](c2ccccc2)C1 ZINC000436283363 262818213 /nfs/dbraw/zinc/81/82/13/262818213.db2.gz UUHBLQLMKRDMPY-ROUUACIJSA-N 1 3 274.452 3.643 20 0 CHADHO CC(C)C[C@@H]([NH3+])CNC(C)(C)Cc1ccccc1Cl ZINC000414699081 263033245 /nfs/dbraw/zinc/03/32/45/263033245.db2.gz DXSNWPDLMQERCR-CQSZACIVSA-N 1 3 282.859 3.624 20 0 CHADHO C[C@H](C[NH2+]C1CCNCC1)Cc1ccc(C(C)(C)C)cc1 ZINC000414783109 263046893 /nfs/dbraw/zinc/04/68/93/263046893.db2.gz GEQYEPWGNGHOMF-HNNXBMFYSA-N 1 3 288.479 3.504 20 0 CHADHO CC(C)C[C@@H](Cc1cccc(Cl)c1)NCC(C)(C)[NH3+] ZINC000414797436 263050562 /nfs/dbraw/zinc/05/05/62/263050562.db2.gz DDOYCAUDKIZKCT-HNNXBMFYSA-N 1 3 282.859 3.624 20 0 CHADHO CC[C@H](Cc1ccc(Cl)cc1Cl)NCC(C)(C)[NH3+] ZINC000414811702 263052948 /nfs/dbraw/zinc/05/29/48/263052948.db2.gz ZUGVIRJEGUBVFF-GFCCVEGCSA-N 1 3 289.250 3.641 20 0 CHADHO CCC([NH3+])(CC)CN[C@@H](C)CCc1ccc(Cl)s1 ZINC000414811585 263053252 /nfs/dbraw/zinc/05/32/52/263053252.db2.gz PTTAMPVIWVMKTR-NSHDSACASA-N 1 3 288.888 3.830 20 0 CHADHO NC[C@H]1CCC[C@@H]1[NH2+]C1CCC(c2ccc(F)cc2)CC1 ZINC000414812589 263053416 /nfs/dbraw/zinc/05/34/16/263053416.db2.gz XMTZEOYXNWATKR-NRLXWARBSA-N 1 3 290.426 3.569 20 0 CHADHO C[C@H](CCC1CCCCC1)NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414840297 263057418 /nfs/dbraw/zinc/05/74/18/263057418.db2.gz YNFHAZYBXBOFHK-KTFSGNIMSA-N 1 3 264.457 3.608 20 0 CHADHO C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@H]1CCC[C@@H](N)C1 ZINC000414925104 263129719 /nfs/dbraw/zinc/12/97/19/263129719.db2.gz KZWPNQPHAAAKKZ-OIISXLGYSA-N 1 3 274.452 3.602 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@H]2c2ccc(Cl)cc2)C1 ZINC000414928129 263134599 /nfs/dbraw/zinc/13/45/99/263134599.db2.gz PWEMPLRMDAXYQO-QZWWFDLISA-N 1 3 292.854 3.836 20 0 CHADHO Cc1ccccc1-c1cccc(C[NH2+][C@H]2CCN[C@H](C)C2)c1 ZINC000414952886 263158062 /nfs/dbraw/zinc/15/80/62/263158062.db2.gz REHCRGSQSPKAQC-APWZRJJASA-N 1 3 294.442 3.892 20 0 CHADHO Cc1ccc(-c2ccc(C[NH2+][C@@H](C)[C@H](C)N)s2)cc1 ZINC000415002024 263202471 /nfs/dbraw/zinc/20/24/71/263202471.db2.gz DEBRKLJLOOVIGJ-STQMWFEESA-N 1 3 274.433 3.549 20 0 CHADHO [NH3+][C@H]1CCC[C@H](CNCc2csc(Cl)c2Cl)C1 ZINC000415002933 263204304 /nfs/dbraw/zinc/20/43/04/263204304.db2.gz MQWJCZWDXGRKHI-WPRPVWTQSA-N 1 3 293.263 3.662 20 0 CHADHO CCn1c2ccccc2c2cc(C[NH2+][C@H](C)[C@H](C)N)ccc21 ZINC000415006647 263218530 /nfs/dbraw/zinc/21/85/30/263218530.db2.gz KUFHYLQQAPKPCE-UONOGXRCSA-N 1 3 295.430 3.640 20 0 CHADHO C[C@@H](CCC[NH3+])NCc1ccc(-c2ccccc2)cc1F ZINC000415026413 263256325 /nfs/dbraw/zinc/25/63/25/263256325.db2.gz UHBBSGCMZBYDQQ-AWEZNQCLSA-N 1 3 286.394 3.710 20 0 CHADHO [NH3+]CCC[C@@H](NCc1ccccc1Cl)c1ccccc1 ZINC000415047103 263258319 /nfs/dbraw/zinc/25/83/19/263258319.db2.gz DTFZRCOORBIKOS-QGZVFWFLSA-N 1 3 288.822 3.910 20 0 CHADHO Cc1cccc(CN[C@H](CCC[NH3+])c2ccccc2)c1C ZINC000415068880 263259865 /nfs/dbraw/zinc/25/98/65/263259865.db2.gz RPRXCJGDXCOXBR-LJQANCHMSA-N 1 3 282.431 3.873 20 0 CHADHO Cc1ccc(CN[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)s1 ZINC000415086960 263271279 /nfs/dbraw/zinc/27/12/79/263271279.db2.gz SILJKQGHXCRXNP-DOTOQJQBSA-N 1 3 286.444 3.639 20 0 CHADHO c1ccc(C[C@@H](N[C@H]2CCC[NH2+]CC2)c2ccccc2)cc1 ZINC000415088420 263271640 /nfs/dbraw/zinc/27/16/40/263271640.db2.gz LYEYWNNDXOXJJU-VQTJNVASSA-N 1 3 294.442 3.702 20 0 CHADHO CC(C)SCCNC1CC[NH+](C2CCCCC2)CC1 ZINC000368572054 267187846 /nfs/dbraw/zinc/18/78/46/267187846.db2.gz AOMKBOVTXVWKNY-UHFFFAOYSA-N 1 3 284.513 3.515 20 0 CHADHO CC(C)SCC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000368572054 267187848 /nfs/dbraw/zinc/18/78/48/267187848.db2.gz AOMKBOVTXVWKNY-UHFFFAOYSA-N 1 3 284.513 3.515 20 0 CHADHO COc1ccc([C@@H](C)NCc2ccc(C[NH+](C)C)cc2)cc1 ZINC000171133136 327651442 /nfs/dbraw/zinc/65/14/42/327651442.db2.gz MUCQJEPCEVXVRY-OAHLLOKOSA-N 1 3 298.430 3.608 20 0 CHADHO c1ccc([C@@H](CC2CC2)NC2CC[NH+](CC3CC3)CC2)cc1 ZINC000531700335 328025642 /nfs/dbraw/zinc/02/56/42/328025642.db2.gz JQGVXEMTAXQVTC-HXUWFJFHSA-N 1 3 298.474 3.992 20 0 CHADHO CCC[NH+]1CCC(N[C@@H](C)c2ccc(CC)s2)CC1 ZINC000041203141 328030139 /nfs/dbraw/zinc/03/01/39/328030139.db2.gz GRUATQAODUSWIH-ZDUSSCGKSA-N 1 3 280.481 3.836 20 0 CHADHO CC[C@@H]1CCC[C@@H](C[NH2+]C[C@H]2CCN(C(C)C)C2)C1 ZINC000394505769 329124377 /nfs/dbraw/zinc/12/43/77/329124377.db2.gz GIRWECUMJCKKRF-BRWVUGGUSA-N 1 3 266.473 3.523 20 0 CHADHO COc1ccccc1-c1ccc([C@@H](C)N(C)CCC[NH3+])cc1 ZINC000414750766 328219082 /nfs/dbraw/zinc/21/90/82/328219082.db2.gz YROGHGOWTBSJQW-OAHLLOKOSA-N 1 3 298.430 3.704 20 0 CHADHO c1ccc(C2CCC(CN3CC[C@]4(CC[NH2+]C4)C3)CC2)cc1 ZINC000414769700 328221671 /nfs/dbraw/zinc/22/16/71/328221671.db2.gz XBODRHNEZBWPQL-UUKMXZOPSA-N 1 3 298.474 3.646 20 0 CHADHO Cc1ccc(-c2ccc(C[NH2+]CC(C)(C)N)s2)cc1 ZINC000414800824 328230656 /nfs/dbraw/zinc/23/06/56/328230656.db2.gz IUUWDYHVDZBWDY-UHFFFAOYSA-N 1 3 274.433 3.550 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H](CNCc2cc(Cl)ccc2Cl)C1 ZINC000414998967 328292376 /nfs/dbraw/zinc/29/23/76/328292376.db2.gz RFKYXFFTXJKCFR-ZWNOBZJWSA-N 1 3 287.234 3.601 20 0 CHADHO CCOc1ccc(CN[C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000415052003 328299066 /nfs/dbraw/zinc/29/90/66/328299066.db2.gz KOQDGRVRIXBOAU-IBGZPJMESA-N 1 3 298.430 3.655 20 0 CHADHO CC(C)CC[C@H]([NH2+][C@H]1CCCNCC1)C(C)(C)C ZINC000415083528 328302567 /nfs/dbraw/zinc/30/25/67/328302567.db2.gz NOSRDBFHPBFIAS-GJZGRUSLSA-N 1 3 254.462 3.569 20 0 CHADHO CCC[NH+]1CCC(N[C@@H](CC2CC2)c2ccccc2)CC1 ZINC000531944837 328323938 /nfs/dbraw/zinc/32/39/38/328323938.db2.gz UBLFJUDKOOOGGO-IBGZPJMESA-N 1 3 286.463 3.992 20 0 CHADHO C[C@@H](c1cccc(Cl)c1)[N@H+](C)CC[C@H]1CCCN1C ZINC000534757888 328360368 /nfs/dbraw/zinc/36/03/68/328360368.db2.gz DQUHVGOGBBLCPR-XJKSGUPXSA-N 1 3 280.843 3.817 20 0 CHADHO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)CC[C@H]1CCCN1C ZINC000534757888 328360370 /nfs/dbraw/zinc/36/03/70/328360370.db2.gz DQUHVGOGBBLCPR-XJKSGUPXSA-N 1 3 280.843 3.817 20 0 CHADHO C[C@@H](N[C@@H](C)CC[NH+](C)C)c1cccc2ccccc21 ZINC000049552002 328371567 /nfs/dbraw/zinc/37/15/67/328371567.db2.gz NPAAAPTVQYYQAA-LSDHHAIUSA-N 1 3 270.420 3.831 20 0 CHADHO Cc1ccsc1[C@H](C)[NH2+]CCCN1CCCC[C@@H]1C ZINC000070089655 328381859 /nfs/dbraw/zinc/38/18/59/328381859.db2.gz KPOUILXTPVQOBA-GJZGRUSLSA-N 1 3 280.481 3.972 20 0 CHADHO CN1CCC[C@H]2C[N@H+](Cc3cccc4ccccc43)CC[C@H]21 ZINC000531988603 328383043 /nfs/dbraw/zinc/38/30/43/328383043.db2.gz LLLHCOHOUZQLPK-AZUAARDMSA-N 1 3 294.442 3.756 20 0 CHADHO CN1CCC[C@H]2C[N@@H+](Cc3cccc4ccccc43)CC[C@H]21 ZINC000531988603 328383044 /nfs/dbraw/zinc/38/30/44/328383044.db2.gz LLLHCOHOUZQLPK-AZUAARDMSA-N 1 3 294.442 3.756 20 0 CHADHO C[N@@H+]1CCC[C@H]2CN(Cc3cccc4ccccc43)CC[C@H]21 ZINC000531988603 328383045 /nfs/dbraw/zinc/38/30/45/328383045.db2.gz LLLHCOHOUZQLPK-AZUAARDMSA-N 1 3 294.442 3.756 20 0 CHADHO C[N@H+]1CCC[C@H]2CN(Cc3cccc4ccccc43)CC[C@H]21 ZINC000531988603 328383046 /nfs/dbraw/zinc/38/30/46/328383046.db2.gz LLLHCOHOUZQLPK-AZUAARDMSA-N 1 3 294.442 3.756 20 0 CHADHO C[C@@H]1CCC[C@@H]([NH2+]C2CC(C)(C)NC(C)(C)C2)[C@@H]1C ZINC000070243480 328519242 /nfs/dbraw/zinc/51/92/42/328519242.db2.gz FZCGOMNBVSJLRZ-UMVBOHGHSA-N 1 3 266.473 3.710 20 0 CHADHO C[C@H]1CCC[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000152427568 328545630 /nfs/dbraw/zinc/54/56/30/328545630.db2.gz PDEAFKUNOWOAKZ-YOEHRIQHSA-N 1 3 264.457 3.562 20 0 CHADHO C[C@@H]1CCC[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000152427662 328545733 /nfs/dbraw/zinc/54/57/33/328545733.db2.gz PDEAFKUNOWOAKZ-RHSMWYFYSA-N 1 3 264.457 3.562 20 0 CHADHO CC(C)(CC[NH3+])NCc1ccc(-c2ccccc2)cc1 ZINC000258753734 326879615 /nfs/dbraw/zinc/87/96/15/326879615.db2.gz GNRUOEGMAQYKNF-UHFFFAOYSA-N 1 3 268.404 3.571 20 0 CHADHO C[C@@H](c1ccc(C(C)(C)C)cc1)N1CC[C@@](C)(C[NH3+])C1 ZINC000261732281 327080890 /nfs/dbraw/zinc/08/08/90/327080890.db2.gz LGZIJESIBKIAQI-KSSFIOAISA-N 1 3 274.452 3.716 20 0 CHADHO C[C@@H](c1ccc(C(C)(C)C)cc1)[N@@H+]1CC[C@@](C)(CN)C1 ZINC000261732281 327080891 /nfs/dbraw/zinc/08/08/91/327080891.db2.gz LGZIJESIBKIAQI-KSSFIOAISA-N 1 3 274.452 3.716 20 0 CHADHO C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@@](C)(CN)C1 ZINC000261732281 327080892 /nfs/dbraw/zinc/08/08/92/327080892.db2.gz LGZIJESIBKIAQI-KSSFIOAISA-N 1 3 274.452 3.716 20 0 CHADHO C[C@@H](c1ccc(C(C)(C)C)cc1)N1CC[C@](C)(C[NH3+])C1 ZINC000261732274 327081005 /nfs/dbraw/zinc/08/10/05/327081005.db2.gz LGZIJESIBKIAQI-KBXCAEBGSA-N 1 3 274.452 3.716 20 0 CHADHO C[C@@H](c1ccc(C(C)(C)C)cc1)[N@@H+]1CC[C@](C)(CN)C1 ZINC000261732274 327081007 /nfs/dbraw/zinc/08/10/07/327081007.db2.gz LGZIJESIBKIAQI-KBXCAEBGSA-N 1 3 274.452 3.716 20 0 CHADHO C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@](C)(CN)C1 ZINC000261732274 327081008 /nfs/dbraw/zinc/08/10/08/327081008.db2.gz LGZIJESIBKIAQI-KBXCAEBGSA-N 1 3 274.452 3.716 20 0 CHADHO C[C@H](c1ccc(C(C)(C)C)cc1)N1CC[C@@](C)(C[NH3+])C1 ZINC000261732278 327081069 /nfs/dbraw/zinc/08/10/69/327081069.db2.gz LGZIJESIBKIAQI-KDOFPFPSSA-N 1 3 274.452 3.716 20 0 CHADHO C[C@H](c1ccc(C(C)(C)C)cc1)[N@@H+]1CC[C@@](C)(CN)C1 ZINC000261732278 327081071 /nfs/dbraw/zinc/08/10/71/327081071.db2.gz LGZIJESIBKIAQI-KDOFPFPSSA-N 1 3 274.452 3.716 20 0 CHADHO C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@@](C)(CN)C1 ZINC000261732278 327081073 /nfs/dbraw/zinc/08/10/73/327081073.db2.gz LGZIJESIBKIAQI-KDOFPFPSSA-N 1 3 274.452 3.716 20 0 CHADHO CC[C@@H](NCC1CC[NH+](CC)CC1)c1ccc(F)cc1F ZINC000558800579 327121145 /nfs/dbraw/zinc/12/11/45/327121145.db2.gz XBKKPSILMBHCDF-QGZVFWFLSA-N 1 3 296.405 3.737 20 0 CHADHO C[C@H](CC[NH2+]CCCN1CCCCC1)c1ccccc1 ZINC000043532940 327260139 /nfs/dbraw/zinc/26/01/39/327260139.db2.gz KOFFCWOQRUZLIC-QGZVFWFLSA-N 1 3 274.452 3.646 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@H]1N[C@H](CC(C)(C)C)c1ccccc1 ZINC000261807153 327352890 /nfs/dbraw/zinc/35/28/90/327352890.db2.gz RWULJKZPYOXVNA-DJIMGWMZSA-N 1 3 274.452 3.752 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@H](CC(C)(C)C)c1ccccc1 ZINC000261807153 327352892 /nfs/dbraw/zinc/35/28/92/327352892.db2.gz RWULJKZPYOXVNA-DJIMGWMZSA-N 1 3 274.452 3.752 20 0 CHADHO C[C@@H]1CCC[C@H](N2CCC([NH2+][C@H]3CCC[C@@H](F)C3)CC2)C1 ZINC000567048020 327522535 /nfs/dbraw/zinc/52/25/35/327522535.db2.gz HCJLOTMEFCAOKZ-LMSBXDPUSA-N 1 3 296.474 3.900 20 0 CHADHO CC1=C[C@H](C)C[C@H](C[N@@H+]2CC[C@H](CN(C)CC3CC3)C2)C1 ZINC000582479471 329095308 /nfs/dbraw/zinc/09/53/08/329095308.db2.gz YNXGVPZIWSMLKQ-IPELMVKDSA-N 1 3 290.495 3.643 20 0 CHADHO CC1=C[C@H](C)C[C@H](C[N@H+]2CC[C@H](CN(C)CC3CC3)C2)C1 ZINC000582479471 329095309 /nfs/dbraw/zinc/09/53/09/329095309.db2.gz YNXGVPZIWSMLKQ-IPELMVKDSA-N 1 3 290.495 3.643 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@H](c2ccccc2)C1)[C@H]1CCCNC1 ZINC000582600292 329113883 /nfs/dbraw/zinc/11/38/83/329113883.db2.gz OMVWTSBWRDODDV-DSLXNQLJSA-N 1 3 286.463 3.691 20 0 CHADHO c1ccc2c(c1)nccc2N1CCC(C[NH+]2CCCC2)CC1 ZINC000174689023 329160730 /nfs/dbraw/zinc/16/07/30/329160730.db2.gz IJNRXGLTTQSQNU-UHFFFAOYSA-N 1 3 295.430 3.547 20 0 CHADHO Cc1nc(C)c([C@H](C)[NH2+]C[C@@H]2CCCN(C(C)C)C2)s1 ZINC000178750422 329200170 /nfs/dbraw/zinc/20/01/70/329200170.db2.gz ANDOYULKJARJPH-WFASDCNBSA-N 1 3 295.496 3.531 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1C[N@@H+]1CC[C@H](C2CCN(C)CC2)C1 ZINC000584378549 329306935 /nfs/dbraw/zinc/30/69/35/329306935.db2.gz NYFLATXQIJMOKJ-WDSOQIARSA-N 1 3 290.495 3.643 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1C[N@H+]1CC[C@H](C2CCN(C)CC2)C1 ZINC000584378549 329306937 /nfs/dbraw/zinc/30/69/37/329306937.db2.gz NYFLATXQIJMOKJ-WDSOQIARSA-N 1 3 290.495 3.643 20 0 CHADHO CCC(CC)[C@@H](NC1CC[NH2+]CC1)c1ccccc1 ZINC000038041298 329354632 /nfs/dbraw/zinc/35/46/32/329354632.db2.gz LJFWEANYIKMPIK-QGZVFWFLSA-N 1 3 260.425 3.506 20 0 CHADHO CCC(CC)[C@@H]([NH2+]C1CCNCC1)c1ccccc1 ZINC000038041298 329354634 /nfs/dbraw/zinc/35/46/34/329354634.db2.gz LJFWEANYIKMPIK-QGZVFWFLSA-N 1 3 260.425 3.506 20 0 CHADHO CN(C)Cc1ccc(C[NH2+][C@@H]2CCC23CCCC3)cc1 ZINC000189045471 329375171 /nfs/dbraw/zinc/37/51/71/329375171.db2.gz XPMNKIGRDRSGKS-QGZVFWFLSA-N 1 3 272.436 3.561 20 0 CHADHO C[C@H](NC1CCC([NH3+])CC1)c1cc(Cl)sc1Cl ZINC000235495053 329439347 /nfs/dbraw/zinc/43/93/47/329439347.db2.gz UNDOUOXDUFEMRI-UEJVZZJDSA-N 1 3 293.263 3.975 20 0 CHADHO CC1CCN(CCC[NH2+][C@H]2CC[C@H]2C(C)(C)C)CC1 ZINC000580479789 330146932 /nfs/dbraw/zinc/14/69/32/330146932.db2.gz HUYYPKZFUJNTLL-CVEARBPZSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)C[C@H](CN1CCC2(CC[NH2+]2)CC1)c1ccccc1 ZINC000422561196 330149330 /nfs/dbraw/zinc/14/93/30/330149330.db2.gz JRZLYYQGTTVRQX-GOSISDBHSA-N 1 3 286.463 3.644 20 0 CHADHO C[C@H](CCC[NH3+])N[C@@H](C)c1c(Cl)ccc(F)c1Cl ZINC000422706347 330151210 /nfs/dbraw/zinc/15/12/10/330151210.db2.gz DWXBXPYRGHMABY-BDAKNGLRSA-N 1 3 293.213 3.911 20 0 CHADHO CC(C)Sc1ccc([C@H](C)N[C@@H](C)C[C@H](C)[NH3+])cc1 ZINC000422715436 330151767 /nfs/dbraw/zinc/15/17/67/330151767.db2.gz MDBKRHZRSNOMOA-IHRRRGAJSA-N 1 3 280.481 3.964 20 0 CHADHO CC(C)(CN[C@@H]1C[C@@H]([NH3+])c2ccccc21)c1ccc(F)cc1 ZINC000422711230 330151531 /nfs/dbraw/zinc/15/15/31/330151531.db2.gz MKUZLRBVZLKLIS-QZTJIDSGSA-N 1 3 298.405 3.838 20 0 CHADHO CCSc1ccc([C@H](C)N[C@H](C)C[C@@H](C)[NH3+])cc1 ZINC000422720889 330152014 /nfs/dbraw/zinc/15/20/14/330152014.db2.gz UBYQFERLZWCMGG-UPJWGTAASA-N 1 3 266.454 3.575 20 0 CHADHO Cc1[nH]c2ccc(C[NH2+][C@@H]3CCCCC[C@H]3N)cc2c1C ZINC000422724781 330152620 /nfs/dbraw/zinc/15/26/20/330152620.db2.gz WOIPYZHCVJLRAH-SJLPKXTDSA-N 1 3 285.435 3.534 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+][C@H](C)CCCC(C)C ZINC000422734170 330152841 /nfs/dbraw/zinc/15/28/41/330152841.db2.gz SCWPHHFGXBHQDY-ZIAGYGMSSA-N 1 3 277.456 3.714 20 0 CHADHO [NH3+][C@@H]1CCC[C@@H]1NCC1(c2cccc(Cl)c2)CCCC1 ZINC000422764425 330153933 /nfs/dbraw/zinc/15/39/33/330153933.db2.gz PMEHMPFTLIFATF-CVEARBPZSA-N 1 3 292.854 3.621 20 0 CHADHO CC(C)c1ccc([C@H](N[C@@H](C)C2C[NH2+]C2)C(C)C)cc1 ZINC000422775022 330154666 /nfs/dbraw/zinc/15/46/66/330154666.db2.gz ZMAQMKUOAKXIEC-KBXCAEBGSA-N 1 3 274.452 3.705 20 0 CHADHO CC(C)c1ccc([C@H]([NH2+][C@@H](C)C2CNC2)C(C)C)cc1 ZINC000422775022 330154667 /nfs/dbraw/zinc/15/46/67/330154667.db2.gz ZMAQMKUOAKXIEC-KBXCAEBGSA-N 1 3 274.452 3.705 20 0 CHADHO C[C@H](C[NH2+][C@H]1C[C@H](N)c2ccccc21)Sc1ccccc1 ZINC000422778970 330155042 /nfs/dbraw/zinc/15/50/42/330155042.db2.gz BIKOBDMTFRAMTN-BVGQSLNGSA-N 1 3 298.455 3.902 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@H](c1ccc(F)cc1)C(C)(C)C ZINC000422787281 330155257 /nfs/dbraw/zinc/15/52/57/330155257.db2.gz UMWMPFCXKQQTIJ-SLEUVZQESA-N 1 3 266.404 3.628 20 0 CHADHO [NH3+][C@@H]1C[C@H](N[C@@H]2CC[C@@H]3CCC[C@H]3C2)c2ccccc21 ZINC000422795440 330155577 /nfs/dbraw/zinc/15/55/77/330155577.db2.gz VOOJUKYMQNXDAZ-MIMASFHYSA-N 1 3 270.420 3.690 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H](c1ccccc1)C1CC1 ZINC000422808801 330155878 /nfs/dbraw/zinc/15/58/78/330155878.db2.gz QWPWPGQXBUWEIG-IFXJQAMLSA-N 1 3 295.430 3.651 20 0 CHADHO Cc1cccc(CN[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC000422810152 330156159 /nfs/dbraw/zinc/15/61/59/330156159.db2.gz SVUIWHPJCHEZHY-RTBURBONSA-N 1 3 280.415 3.578 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)[C@H]1CCCNC1)[C@@H](C)C1CCCCC1 ZINC000422822795 330156490 /nfs/dbraw/zinc/15/64/90/330156490.db2.gz KQGIAVFJVAYDTA-AIANPOQGSA-N 1 3 266.473 3.569 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)NCc1ccc(OC2CCCCC2)cc1 ZINC000422847411 330157341 /nfs/dbraw/zinc/15/73/41/330157341.db2.gz ICZUTDGZVMGLQA-GJZGRUSLSA-N 1 3 290.451 3.614 20 0 CHADHO CC[C@H](N[C@H](C)[C@H]1CCC[NH2+]C1)c1cccc(Cl)c1 ZINC000422853422 330157562 /nfs/dbraw/zinc/15/75/62/330157562.db2.gz BTFJHYHHDXLTES-INWMFGNUSA-N 1 3 280.843 3.769 20 0 CHADHO [NH3+][C@@H]1C[C@H](N[C@@H](Cc2ccccc2)C2CC2)c2ccccc21 ZINC000422914704 330160271 /nfs/dbraw/zinc/16/02/71/330160271.db2.gz VOVLXUFSVDZBOG-AABGKKOBSA-N 1 3 292.426 3.742 20 0 CHADHO c1ccc(C[C@@H]2C[C@@H]2N[C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000422919129 330160518 /nfs/dbraw/zinc/16/05/18/330160518.db2.gz JLISXMPSUVNIEP-OBKDMQGPSA-N 1 3 298.474 3.518 20 0 CHADHO CCC(CC)[C@H](N[C@@H](C)C[C@@H](C)[NH3+])c1cccs1 ZINC000422944486 330161888 /nfs/dbraw/zinc/16/18/88/330161888.db2.gz ZUGAVZHURLPDOT-XUJVJEKNSA-N 1 3 268.470 3.941 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](Cc1ccccc1)c1cccs1 ZINC000422979818 330162520 /nfs/dbraw/zinc/16/25/20/330162520.db2.gz KKPAOUIQKXRBTB-DZKIICNBSA-N 1 3 288.460 3.747 20 0 CHADHO CC[C@H](CSc1ccc(C)c(C)c1)N[C@@H](C)C[C@@H](C)[NH3+] ZINC000422998460 330163412 /nfs/dbraw/zinc/16/34/12/330163412.db2.gz CUJMENDVHPAKEA-OWCLPIDISA-N 1 3 294.508 3.890 20 0 CHADHO CC[C@H](CSc1ccc(C)c(C)c1)[NH2+][C@@H](C)C[C@@H](C)N ZINC000422998460 330163413 /nfs/dbraw/zinc/16/34/13/330163413.db2.gz CUJMENDVHPAKEA-OWCLPIDISA-N 1 3 294.508 3.890 20 0 CHADHO C(=C\c1ccccc1)\CN[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000422972812 330164627 /nfs/dbraw/zinc/16/46/27/330164627.db2.gz AKFSUCSFSAISKM-MCFDBRLESA-N 1 3 292.426 3.783 20 0 CHADHO [NH3+][C@H]1CCCCC[C@@H]1NCC1(c2ccccc2Cl)CC1 ZINC000423021358 330165767 /nfs/dbraw/zinc/16/57/67/330165767.db2.gz FAZXAYGPXFSQNA-HOTGVXAUSA-N 1 3 292.854 3.621 20 0 CHADHO CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H]1C[C@@H](N)c2ccccc21 ZINC000423054262 330166332 /nfs/dbraw/zinc/16/63/32/330166332.db2.gz BOGZQRJGEIKHHS-MCIONIFRSA-N 1 3 286.341 3.698 20 0 CHADHO CS[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCCN1)C(C)(C)C ZINC000423036776 330166675 /nfs/dbraw/zinc/16/66/75/330166675.db2.gz UTEQPIYJNOWZDF-ZJIFWQFVSA-N 1 3 298.540 3.665 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H](CC1CCC1)c1ccccc1 ZINC000423043247 330166685 /nfs/dbraw/zinc/16/66/85/330166685.db2.gz OAENPAOWVDRSOK-JJRVBVJISA-N 1 3 260.425 3.633 20 0 CHADHO CC(C)[C@@H]1CCc2ccccc2[C@H]1NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423052521 330167443 /nfs/dbraw/zinc/16/74/43/330167443.db2.gz QOJALBLJLBRPEC-ZYGVUQDESA-N 1 3 298.474 3.819 20 0 CHADHO CC(C)[C@H](CC(F)(F)F)N[C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000423059125 330167620 /nfs/dbraw/zinc/16/76/20/330167620.db2.gz LESWOBBJRLEBGB-MCIONIFRSA-N 1 3 294.405 3.864 20 0 CHADHO CC(C)c1ccc2c(c1)[C@@H](N[C@@H](C)C[C@H](C)[NH3+])CC2 ZINC000423065859 330168201 /nfs/dbraw/zinc/16/82/01/330168201.db2.gz VJJBNOLNNDIVDF-DCGLDWPTSA-N 1 3 260.425 3.513 20 0 CHADHO CC(C)[C@H](CN[C@@H]1CCC[C@@H]1[NH3+])c1ccc(Cl)cc1 ZINC000423103285 330170509 /nfs/dbraw/zinc/17/05/09/330170509.db2.gz GGOKARODKYYONQ-HRCADAONSA-N 1 3 280.843 3.549 20 0 CHADHO NC[C@@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423105645 330170521 /nfs/dbraw/zinc/17/05/21/330170521.db2.gz ZDNWGOWSTUXPQM-NXNVCVFFSA-N 1 3 292.854 3.693 20 0 CHADHO C[C@@H]1CCNCC[C@@H]1[NH2+][C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423103715 330170550 /nfs/dbraw/zinc/17/05/50/330170550.db2.gz XXJBAOGUNAWYPG-WNOSKKOXSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@@H]1CC[NH2+]CC[C@@H]1N[C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423103715 330170551 /nfs/dbraw/zinc/17/05/51/330170551.db2.gz XXJBAOGUNAWYPG-WNOSKKOXSA-N 1 3 292.854 3.564 20 0 CHADHO Cc1ccccc1[C@H]1C[C@H](N[C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000423111953 330170877 /nfs/dbraw/zinc/17/08/77/330170877.db2.gz WZKCZGDHRMDRJS-CZKCSJLSSA-N 1 3 298.474 3.751 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](C)c1ccc(Oc2cccnc2)cc1 ZINC000423119879 330171145 /nfs/dbraw/zinc/17/11/45/330171145.db2.gz FRIVPTGNYBDXFK-KKUMJFAQSA-N 1 3 299.418 3.650 20 0 CHADHO CC(F)(F)c1ccc(C[NH2+][C@@H]2CCCCC[C@@H]2N)cc1 ZINC000423127298 330171524 /nfs/dbraw/zinc/17/15/24/330171524.db2.gz BUGZWXFMFLAHQV-LSDHHAIUSA-N 1 3 282.378 3.548 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[C@H](C)C1 ZINC000423164395 330173844 /nfs/dbraw/zinc/17/38/44/330173844.db2.gz OKWDFDBSCIUSIT-RZLSGREXSA-N 1 3 289.467 3.714 20 0 CHADHO CC[C@H]([NH2+]CC1(N)CCCCC1)c1ccc(F)cc1 ZINC000423176801 330175029 /nfs/dbraw/zinc/17/50/29/330175029.db2.gz HXAOFGIZGRYBSA-HNNXBMFYSA-N 1 3 264.388 3.528 20 0 CHADHO CC1(C)[C@H](NCC2([NH3+])CCCCC2)C[C@@H]1c1ccccc1 ZINC000423176625 330175054 /nfs/dbraw/zinc/17/50/54/330175054.db2.gz HJXWXYMTBCWIRB-IAGOWNOFSA-N 1 3 286.463 3.820 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000423177691 330175153 /nfs/dbraw/zinc/17/51/53/330175153.db2.gz HMLKCMKILAOAHE-GMZLATJGSA-N 1 3 280.843 3.692 20 0 CHADHO CC[C@@H]([NH2+]C1CCNCC1)c1ccc2cc(OC)ccc2c1 ZINC000423178415 330175199 /nfs/dbraw/zinc/17/51/99/330175199.db2.gz FXUWUGMDVSEMJY-LJQANCHMSA-N 1 3 298.430 3.641 20 0 CHADHO Cc1ccc([C@H](NC2CC[NH2+]CC2)C2CCCC2)cc1 ZINC000423191498 330175897 /nfs/dbraw/zinc/17/58/97/330175897.db2.gz UHHBIUBAHVBQFY-GOSISDBHSA-N 1 3 272.436 3.568 20 0 CHADHO Cc1ccc([C@H]([NH2+]C2CCNCC2)C2CCCC2)cc1 ZINC000423191498 330175898 /nfs/dbraw/zinc/17/58/98/330175898.db2.gz UHHBIUBAHVBQFY-GOSISDBHSA-N 1 3 272.436 3.568 20 0 CHADHO Clc1ccc([C@@H]2CC[C@@H]([NH2+]C[C@@H]3CCCNC3)C2)cc1 ZINC000423202648 330176799 /nfs/dbraw/zinc/17/67/99/330176799.db2.gz BINDCLIXHVZFKM-FRFSOERESA-N 1 3 292.854 3.565 20 0 CHADHO Cc1ccsc1[C@@H](Cc1ccccc1)NCC[C@H](C)[NH3+] ZINC000423223568 330180142 /nfs/dbraw/zinc/18/01/42/330180142.db2.gz GPKCVWXSYIPBTM-GOEBONIOSA-N 1 3 288.460 3.667 20 0 CHADHO C[C@H](N)CC[NH2+][C@@H](C)C(c1ccccc1)c1ccccc1 ZINC000423225463 330180184 /nfs/dbraw/zinc/18/01/84/330180184.db2.gz MWWDZSDMCQKJCJ-HOTGVXAUSA-N 1 3 282.431 3.534 20 0 CHADHO C[C@H]([NH3+])CCN[C@@H](C)C(c1ccccc1)c1ccccc1 ZINC000423225463 330180185 /nfs/dbraw/zinc/18/01/85/330180185.db2.gz MWWDZSDMCQKJCJ-HOTGVXAUSA-N 1 3 282.431 3.534 20 0 CHADHO C[C@@H](NCC[C@H](C)[NH3+])c1ccc(OCc2ccccc2)cc1 ZINC000423240887 330181569 /nfs/dbraw/zinc/18/15/69/330181569.db2.gz XPKZGVZETRELDC-JKSUJKDBSA-N 1 3 298.430 3.654 20 0 CHADHO CC(C)C[C@@H](CN)[NH2+][C@H]1C[C@H](C)Sc2sccc21 ZINC000423271488 330184420 /nfs/dbraw/zinc/18/44/20/330184420.db2.gz XUBAEWPGFOGRMA-GVXVVHGQSA-N 1 3 284.494 3.637 20 0 CHADHO Cc1nc(C(C)C)sc1[C@H](C)N[C@H]1CCCC[C@H]1C[NH3+] ZINC000423270939 330184462 /nfs/dbraw/zinc/18/44/62/330184462.db2.gz HAEHNDHCZCNDAV-UBHSHLNASA-N 1 3 295.496 3.743 20 0 CHADHO [NH3+]C[C@@H](N[C@H]1CCCc2c3ccccc3sc21)C1CC1 ZINC000423276189 330185192 /nfs/dbraw/zinc/18/51/92/330185192.db2.gz MPJOECTZEPLEFE-LSDHHAIUSA-N 1 3 286.444 3.606 20 0 CHADHO CC(C)[C@H](N)C[NH2+][C@@H](C)c1ccc(F)c2ccccc21 ZINC000423275437 330185202 /nfs/dbraw/zinc/18/52/02/330185202.db2.gz NFTCPJVIGCUNIT-YVEFUNNKSA-N 1 3 274.383 3.613 20 0 CHADHO CC(C)[C@H]([NH3+])CN[C@H]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000423279543 330185332 /nfs/dbraw/zinc/18/53/32/330185332.db2.gz SGWSRHMTUPRFRY-CWRNSKLLSA-N 1 3 280.843 3.549 20 0 CHADHO CNC[C@@H](C)C[NH2+][C@H](C)C(c1ccccc1)c1ccccc1 ZINC000423284017 330185755 /nfs/dbraw/zinc/18/57/55/330185755.db2.gz XXWPQZAFUDZCGM-IAGOWNOFSA-N 1 3 296.458 3.652 20 0 CHADHO C[NH2+]C[C@@H](C)CN[C@H](C)C(c1ccccc1)c1ccccc1 ZINC000423284017 330185757 /nfs/dbraw/zinc/18/57/57/330185757.db2.gz XXWPQZAFUDZCGM-IAGOWNOFSA-N 1 3 296.458 3.652 20 0 CHADHO Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]CC(C)(C)N ZINC000423287105 330186119 /nfs/dbraw/zinc/18/61/19/330186119.db2.gz KHUSVIPJQBDLNI-OAHLLOKOSA-N 1 3 288.460 3.667 20 0 CHADHO CC[C@H]([NH2+]CC(C)(C)N)c1ccc(Cl)c(Cl)c1 ZINC000423286451 330186140 /nfs/dbraw/zinc/18/61/40/330186140.db2.gz HJJFEMNNNHVQJP-LBPRGKRZSA-N 1 3 275.223 3.771 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2cccc(F)c2)cc1 ZINC000423289876 330186424 /nfs/dbraw/zinc/18/64/24/330186424.db2.gz BVYBNEXTLIRYHK-CHWSQXEVSA-N 1 3 272.367 3.696 20 0 CHADHO CCC(N)(CC)C[NH2+][C@H](C)c1ccc(SC)cc1 ZINC000423289530 330186440 /nfs/dbraw/zinc/18/64/40/330186440.db2.gz XKHDJQBARIYYHH-GFCCVEGCSA-N 1 3 266.454 3.577 20 0 CHADHO C[C@@H](NCC(C)(C)[NH3+])C(c1ccccc1)c1ccccc1 ZINC000423290337 330186682 /nfs/dbraw/zinc/18/66/82/330186682.db2.gz ZSRVUEPXLWZCGU-OAHLLOKOSA-N 1 3 282.431 3.534 20 0 CHADHO CC[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccc(OC)cc1 ZINC000423290556 330186727 /nfs/dbraw/zinc/18/67/27/330186727.db2.gz DMLXFYODQLGGFN-IFXJQAMLSA-N 1 3 298.430 3.956 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2ccsc2)cc1 ZINC000423290504 330186830 /nfs/dbraw/zinc/18/68/30/330186830.db2.gz DHLKSJFMEYWKPM-NEPJUHHUSA-N 1 3 260.406 3.619 20 0 CHADHO Cc1cc([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)cs1 ZINC000423290962 330187019 /nfs/dbraw/zinc/18/70/19/330187019.db2.gz GBSWXXBQBRDTKB-CHWSQXEVSA-N 1 3 274.433 3.927 20 0 CHADHO CCC(N)(CC)C[NH2+][C@@H]1CC[C@@H](C)c2ccsc21 ZINC000423291764 330187460 /nfs/dbraw/zinc/18/74/60/330187460.db2.gz JTDBVEAPBXBGIS-DGCLKSJQSA-N 1 3 266.454 3.794 20 0 CHADHO CC[C@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccccc1 ZINC000423291693 330187482 /nfs/dbraw/zinc/18/74/82/330187482.db2.gz JLFXYRIAWFGLIW-KSSFIOAISA-N 1 3 268.404 3.947 20 0 CHADHO C[C@@H]([NH3+])c1ccc(CN[C@@H]2CCCNc3ccccc32)cc1 ZINC000423292672 330187659 /nfs/dbraw/zinc/18/76/59/330187659.db2.gz NVLXWGZRNQEWDO-AUUYWEPGSA-N 1 3 295.430 3.743 20 0 CHADHO C[C@H](C[NH3+])CN[C@@H](C)c1ccc(-c2ccccc2F)s1 ZINC000423298262 330189161 /nfs/dbraw/zinc/18/91/61/330189161.db2.gz NVCQVYFLWPFSMS-NEPJUHHUSA-N 1 3 292.423 3.800 20 0 CHADHO C[C@@H](NC[C@@H]([NH3+])C1CC1)C(c1ccccc1)c1ccccc1 ZINC000423314420 330189769 /nfs/dbraw/zinc/18/97/69/330189769.db2.gz HCRIVQVWYZCQSX-DNVCBOLYSA-N 1 3 294.442 3.534 20 0 CHADHO C[C@@H](C[NH3+])CN[C@@H](c1cc2ccccc2o1)C(C)(C)C ZINC000423313714 330189845 /nfs/dbraw/zinc/18/98/45/330189845.db2.gz XGMFMRJLHACYRD-LRDDRELGSA-N 1 3 274.408 3.704 20 0 CHADHO CC(C)CC[C@H]([NH2+][C@@H]1CCN[C@@H](C)C1)C(C)(C)C ZINC000423374696 330191016 /nfs/dbraw/zinc/19/10/16/330191016.db2.gz IABFEPPXDPLTKB-ZNMIVQPWSA-N 1 3 254.462 3.567 20 0 CHADHO CCC[C@@H](NC[C@]1(C)CCC[NH2+]C1)c1ccc(OC)cc1 ZINC000423331399 330191335 /nfs/dbraw/zinc/19/13/35/330191335.db2.gz OEOJRZVSAPXRJP-QZTJIDSGSA-N 1 3 290.451 3.516 20 0 CHADHO CCC[C@@H]([NH2+]C[C@]1(C)CCCNC1)c1ccc(OC)cc1 ZINC000423331399 330191336 /nfs/dbraw/zinc/19/13/36/330191336.db2.gz OEOJRZVSAPXRJP-QZTJIDSGSA-N 1 3 290.451 3.516 20 0 CHADHO N[C@H](C[NH2+][C@H](c1ccc(Cl)cc1)C1CCC1)C1CC1 ZINC000423333186 330191623 /nfs/dbraw/zinc/19/16/23/330191623.db2.gz VNLLJGSAIWVCAM-CVEARBPZSA-N 1 3 278.827 3.508 20 0 CHADHO NC1(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)CCC1 ZINC000423335920 330191884 /nfs/dbraw/zinc/19/18/84/330191884.db2.gz UJVPWGNRVADOPC-AWEZNQCLSA-N 1 3 298.352 3.628 20 0 CHADHO C[C@]1(CN[C@@H]2CCCc3c4ccccc4[nH]c32)CCC[NH2+]C1 ZINC000423343022 330191901 /nfs/dbraw/zinc/19/19/01/330191901.db2.gz NILBPYYBWJGXTP-MJGOQNOKSA-N 1 3 297.446 3.525 20 0 CHADHO C[C@]1(C[NH2+][C@@H]2CCCc3c4ccccc4[nH]c32)CCCNC1 ZINC000423343022 330191902 /nfs/dbraw/zinc/19/19/02/330191902.db2.gz NILBPYYBWJGXTP-MJGOQNOKSA-N 1 3 297.446 3.525 20 0 CHADHO CC[C@@H](NCC1=CC[NH2+]CC1)c1ccc(Cl)c(Cl)c1 ZINC000423344375 330192374 /nfs/dbraw/zinc/19/23/74/330192374.db2.gz MQPLNTWXXUFAFT-OAHLLOKOSA-N 1 3 299.245 3.954 20 0 CHADHO C[C@H](NCC1=CC[NH2+]CC1)c1ccc(-c2ccccc2)o1 ZINC000423346716 330192616 /nfs/dbraw/zinc/19/26/16/330192616.db2.gz PMVRMZGPCJLVMN-AWEZNQCLSA-N 1 3 282.387 3.517 20 0 CHADHO C[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccc(Cl)cc1 ZINC000423356149 330193329 /nfs/dbraw/zinc/19/33/29/330193329.db2.gz JEOMKWQJHQEGIK-GFCCVEGCSA-N 1 3 286.806 3.794 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@@H](N)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423359203 330193539 /nfs/dbraw/zinc/19/35/39/330193539.db2.gz CWBHFNBXLSMOKR-CKIKVBCHSA-N 1 3 298.883 3.753 20 0 CHADHO Cc1ccc([C@H](C)NCc2ccc3c(c2)C[NH2+]C3)cc1C ZINC000423361276 330193605 /nfs/dbraw/zinc/19/36/05/330193605.db2.gz RLFRLUOVTYADSD-HNNXBMFYSA-N 1 3 280.415 3.757 20 0 CHADHO CC[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccc(OC)cc1 ZINC000423359858 330193729 /nfs/dbraw/zinc/19/37/29/330193729.db2.gz PRMNRVDWAQXXMR-LJQANCHMSA-N 1 3 296.414 3.539 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)CCN1 ZINC000423363054 330193805 /nfs/dbraw/zinc/19/38/05/330193805.db2.gz AHCGVYIYKWSBBS-HFBAOOFYSA-N 1 3 278.827 3.521 20 0 CHADHO Clc1ccc([C@@H]2CC[C@@H](NCC[C@H]3CCC[NH2+]3)C2)cc1 ZINC000423362943 330194071 /nfs/dbraw/zinc/19/40/71/330194071.db2.gz UGAPFSGOYNPNGI-DJIMGWMZSA-N 1 3 292.854 3.708 20 0 CHADHO C[C@H]([NH2+][C@H]1CCNC[C@H]1C)c1ccccc1C(C)(C)C ZINC000423363902 330194327 /nfs/dbraw/zinc/19/43/27/330194327.db2.gz CCSKBFBZPCRKGE-KEYYUXOJSA-N 1 3 274.452 3.633 20 0 CHADHO c1ccc([C@@H]2CCC[C@H]2[NH2+]Cc2ccc3c(c2)CNC3)cc1 ZINC000423366032 330194513 /nfs/dbraw/zinc/19/45/13/330194513.db2.gz BLORQOFQQRKUQP-VQTJNVASSA-N 1 3 292.426 3.716 20 0 CHADHO CCCC[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1ccccc1 ZINC000423370137 330194996 /nfs/dbraw/zinc/19/49/96/330194996.db2.gz GTBHFQWLEOUPNT-OIISXLGYSA-N 1 3 260.425 3.648 20 0 CHADHO C[C@@H]1C[C@H](NCc2ccc3c(c2)C[NH2+]C3)c2ccccc21 ZINC000423368935 330195059 /nfs/dbraw/zinc/19/50/59/330195059.db2.gz DNDUWQQGFSMUSR-YJYMSZOUSA-N 1 3 278.399 3.628 20 0 CHADHO CC(C)[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1ccc(F)c(F)c1 ZINC000423370970 330195085 /nfs/dbraw/zinc/19/50/85/330195085.db2.gz GEVCXDGLTVQRHS-XEZPLFJOSA-N 1 3 282.378 3.521 20 0 CHADHO Cc1cc(C)c([C@H](C)N[C@H]2CCC[C@@H]([NH3+])C2)cc1C ZINC000423372095 330195426 /nfs/dbraw/zinc/19/54/26/330195426.db2.gz GTDVSWLAURWAAA-XHSDSOJGSA-N 1 3 260.425 3.532 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@@H](N)C1)C1(c2ccccc2)CCCC1 ZINC000423400459 330195957 /nfs/dbraw/zinc/19/59/57/330195957.db2.gz VKUPJTBWTMQVSO-JQHSSLGASA-N 1 3 286.463 3.746 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@H]1N[C@@H](CC1CCC1)c1ccccc1 ZINC000423397930 330195991 /nfs/dbraw/zinc/19/59/91/330195991.db2.gz OOWXPBDBHJYIEM-OLMNPRSZSA-N 1 3 272.436 3.506 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+][C@@H](CC1CCC1)c1ccccc1 ZINC000423397930 330195993 /nfs/dbraw/zinc/19/59/93/330195993.db2.gz OOWXPBDBHJYIEM-OLMNPRSZSA-N 1 3 272.436 3.506 20 0 CHADHO C[C@@H]([NH2+][C@H]1CCN[C@H](C)C1)c1ccc(C(C)(C)C)cc1 ZINC000423401772 330196327 /nfs/dbraw/zinc/19/63/27/330196327.db2.gz XIQGPPKUMATZDQ-CPUCHLNUSA-N 1 3 274.452 3.775 20 0 CHADHO C[C@@H]([NH2+]Cc1ccc2c(c1)CNC2)C(C)(C)c1ccccc1 ZINC000423403838 330196384 /nfs/dbraw/zinc/19/63/84/330196384.db2.gz XIFSIYGKTZAWBD-OAHLLOKOSA-N 1 3 294.442 3.746 20 0 CHADHO COc1ccc([C@H](C)[NH2+][C@@H]2CCN[C@H](C)C2)c2ccccc12 ZINC000423401237 330196450 /nfs/dbraw/zinc/19/64/50/330196450.db2.gz XAYGVSNLIANUAE-QLFBSQMISA-N 1 3 298.430 3.640 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000423409986 330197101 /nfs/dbraw/zinc/19/71/01/330197101.db2.gz ZHYGMLYCGAJGNP-IRWJRLHMSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000423409989 330197289 /nfs/dbraw/zinc/19/72/89/330197289.db2.gz ZHYGMLYCGAJGNP-WNOSKKOXSA-N 1 3 292.854 3.564 20 0 CHADHO C[C@@H]([NH2+][C@H]1CCN[C@H](C)C1)c1ccc(F)c2ccccc21 ZINC000423374740 330198644 /nfs/dbraw/zinc/19/86/44/330198644.db2.gz IHLSJPWDBMJSIQ-MCIONIFRSA-N 1 3 286.394 3.770 20 0 CHADHO C[C@@H]1[C@@H]([NH2+]Cc2ccc3c(c2)CNC3)C[C@@H]1c1ccccc1 ZINC000423382159 330199149 /nfs/dbraw/zinc/19/91/49/330199149.db2.gz JXNPWMIKWKENFT-GKCIPKSASA-N 1 3 292.426 3.572 20 0 CHADHO C[C@@H]([NH2+]Cc1ccc2c(c1)CNC2)[C@@H](C)c1ccccc1 ZINC000423383048 330199228 /nfs/dbraw/zinc/19/92/28/330199228.db2.gz KHUNFVNJBAIWJZ-HUUCEWRRSA-N 1 3 280.415 3.572 20 0 CHADHO C[C@H]([NH2+][C@H]1CCN[C@H](C)C1)c1cccc(-c2ccncc2)c1 ZINC000423382423 330199300 /nfs/dbraw/zinc/19/93/00/330199300.db2.gz OXGXUSJURPUWRD-VCBZYWHSSA-N 1 3 295.430 3.540 20 0 CHADHO C[C@@H]([NH2+]Cc1ccc2c(c1)CNC2)[C@@H]1CCCC[C@H]1C ZINC000423382907 330199446 /nfs/dbraw/zinc/19/94/46/330199446.db2.gz KAWWQNYOKDURPX-HBUWYVDXSA-N 1 3 272.436 3.594 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@@H]1N[C@@H](c1ccccc1)C1CCCC1 ZINC000423385202 330199465 /nfs/dbraw/zinc/19/94/65/330199465.db2.gz GOLFEVCZYZCAOA-JLSDUUJJSA-N 1 3 272.436 3.506 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H](c1ccccc1)C1CCCC1 ZINC000423385202 330199466 /nfs/dbraw/zinc/19/94/66/330199466.db2.gz GOLFEVCZYZCAOA-JLSDUUJJSA-N 1 3 272.436 3.506 20 0 CHADHO CC[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1cccc(F)c1 ZINC000423386583 330199652 /nfs/dbraw/zinc/19/96/52/330199652.db2.gz LXRCIXJAYYXYRN-SFHVURJKSA-N 1 3 284.378 3.670 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H]1CCCCc2ccc(Cl)cc21 ZINC000423384472 330199773 /nfs/dbraw/zinc/19/97/73/330199773.db2.gz FZRUGERXVRNKBJ-OAUYIBNBSA-N 1 3 292.854 3.695 20 0 CHADHO c1ccc2c(c1)CCCC[C@@H]2NCc1ccc2c(c1)C[NH2+]C2 ZINC000423387432 330199852 /nfs/dbraw/zinc/19/98/52/330199852.db2.gz MSYJOJUSMVOLCL-FQEVSTJZSA-N 1 3 292.426 3.847 20 0 CHADHO CC[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccccc1OC ZINC000423395009 330200506 /nfs/dbraw/zinc/20/05/06/330200506.db2.gz ROECXMPCTUAPLG-GOSISDBHSA-N 1 3 296.414 3.539 20 0 CHADHO CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CCN[C@H](C)C2)c2ccccc21 ZINC000423394088 330200528 /nfs/dbraw/zinc/20/05/28/330200528.db2.gz ZLYSBKLKACQZIM-KNCCTNLNSA-N 1 3 272.436 3.601 20 0 CHADHO C[C@@H](CCC1CCCC1)[NH2+]Cc1ccc2c(c1)CNC2 ZINC000423392991 330200576 /nfs/dbraw/zinc/20/05/76/330200576.db2.gz QHMZPLKSOZHNEI-AWEZNQCLSA-N 1 3 272.436 3.738 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H](c3cccc(Cl)c3)C2)CCN1 ZINC000423394433 330200710 /nfs/dbraw/zinc/20/07/10/330200710.db2.gz ZQWOHNUBJHYGFY-QIJZBDPFSA-N 1 3 292.854 3.706 20 0 CHADHO C[C@@H](N)[C@@H](C)[NH2+][C@@H](C)c1cccc(-c2ccccc2)c1 ZINC000423434574 330201092 /nfs/dbraw/zinc/20/10/92/330201092.db2.gz CZOMIAJSXBASKF-KFWWJZLASA-N 1 3 268.404 3.740 20 0 CHADHO C[C@H](N)[C@H](C)[NH2+][C@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000423432761 330201101 /nfs/dbraw/zinc/20/11/01/330201101.db2.gz BMJZCLRDJCALFT-SLEUVZQESA-N 1 3 266.404 3.628 20 0 CHADHO CC[C@H](N)C[NH2+][C@H](C)c1ccc(-c2ccccc2OC)cc1 ZINC000423459457 330203873 /nfs/dbraw/zinc/20/38/73/330203873.db2.gz IBQWXGYXYAUTQG-PBHICJAKSA-N 1 3 298.430 3.750 20 0 CHADHO C[C@H](N[C@H]1CC[C@@H](C[NH3+])C1)c1cc(Cl)sc1Cl ZINC000423494181 330207605 /nfs/dbraw/zinc/20/76/05/330207605.db2.gz RWQPYCVIAUPYEH-YIZRAAEISA-N 1 3 293.263 3.833 20 0 CHADHO C[C@H](N[C@H]1CC[C@@H](C[NH3+])C1)c1cccc(Cl)c1Cl ZINC000423494672 330207676 /nfs/dbraw/zinc/20/76/76/330207676.db2.gz SOLVOAWQULDEMN-AXFHLTTASA-N 1 3 287.234 3.771 20 0 CHADHO COc1ccccc1[C@@H](C)N[C@@H](CCC[NH3+])c1ccccc1 ZINC000423498597 330208089 /nfs/dbraw/zinc/20/80/89/330208089.db2.gz IHBCLONVWKHWRT-QAPCUYQASA-N 1 3 298.430 3.826 20 0 CHADHO CC[C@@H](N[C@H](CCC[NH3+])c1ccccc1)c1ccncc1 ZINC000423499047 330208219 /nfs/dbraw/zinc/20/82/19/330208219.db2.gz ADUMSZOYWSDFLP-QZTJIDSGSA-N 1 3 283.419 3.603 20 0 CHADHO C[C@@H](N[C@@H](CCC[NH3+])c1ccccc1)c1ccccc1F ZINC000423505660 330208745 /nfs/dbraw/zinc/20/87/45/330208745.db2.gz ORIUBUMSTFAZTR-KDOFPFPSSA-N 1 3 286.394 3.957 20 0 CHADHO [NH3+]CCC[C@H](N[C@H]1CCc2cc(F)ccc21)c1ccccc1 ZINC000423513673 330209419 /nfs/dbraw/zinc/20/94/19/330209419.db2.gz VOYMUUADKMWFFA-OALUTQOASA-N 1 3 298.405 3.883 20 0 CHADHO [NH3+]CCC[C@@H](N[C@H]1CCCc2occc21)c1ccccc1 ZINC000423521053 330209918 /nfs/dbraw/zinc/20/99/18/330209918.db2.gz RXGDYBKSVRBBPQ-SJORKVTESA-N 1 3 284.403 3.727 20 0 CHADHO CC[C@H](NCCC1=CC[NH2+]CC1)c1cccc(Cl)c1F ZINC000423537491 330210868 /nfs/dbraw/zinc/21/08/68/330210868.db2.gz KCSWKBIVTDQALU-HNNXBMFYSA-N 1 3 296.817 3.830 20 0 CHADHO Cc1c(C)c(C)c(CN[C@H]2CC[N@H+](C)[C@@H](C)C2)c(C)c1C ZINC000536841625 330236211 /nfs/dbraw/zinc/23/62/11/330236211.db2.gz VZPLHOWOZBJPNB-SGTLLEGYSA-N 1 3 288.479 3.801 20 0 CHADHO Cc1c(C)c(C)c(CN[C@H]2CC[N@@H+](C)[C@@H](C)C2)c(C)c1C ZINC000536841625 330236212 /nfs/dbraw/zinc/23/62/12/330236212.db2.gz VZPLHOWOZBJPNB-SGTLLEGYSA-N 1 3 288.479 3.801 20 0 CHADHO COc1ccc([C@H](C)[NH2+]CCCN2CCCC[C@H]2C)cc1 ZINC000036122751 330249758 /nfs/dbraw/zinc/24/97/58/330249758.db2.gz OXESROMZUYCIDW-CVEARBPZSA-N 1 3 290.451 3.610 20 0 CHADHO C[C@@H]([NH2+]C1CCN(C2CCCCC2)CC1)[C@@H]1C[C@H]1C1CC1 ZINC000527669163 330269576 /nfs/dbraw/zinc/26/95/76/330269576.db2.gz GZUGLXJPECIZFE-CCKFTAQKSA-N 1 3 290.495 3.808 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](c2cccc(C)c2)C(C)C)C1 ZINC000527855137 330288719 /nfs/dbraw/zinc/28/87/19/330288719.db2.gz ZRGNHGFMXAGESC-WMZOPIPTSA-N 1 3 274.452 3.624 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](c2cccc(C)c2)C(C)C)C1 ZINC000527855137 330288720 /nfs/dbraw/zinc/28/87/20/330288720.db2.gz ZRGNHGFMXAGESC-WMZOPIPTSA-N 1 3 274.452 3.624 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](c2cccc(C)c2)C(C)C)C1 ZINC000527855137 330288721 /nfs/dbraw/zinc/28/87/21/330288721.db2.gz ZRGNHGFMXAGESC-WMZOPIPTSA-N 1 3 274.452 3.624 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](CC)CCc2ccccc2)C1 ZINC000527855326 330288865 /nfs/dbraw/zinc/28/88/65/330288865.db2.gz WAYUZHBNFUUNNI-RBUKOAKNSA-N 1 3 288.479 3.719 20 0 CHADHO C[C@H]1CCC[C@H](N2CCC([NH2+]CC3CC=CC3)CC2)C1 ZINC000527943377 330294059 /nfs/dbraw/zinc/29/40/59/330294059.db2.gz KCBIMJGDEKXJRE-YJBOKZPZSA-N 1 3 276.468 3.585 20 0 CHADHO C1=CC[C@H](C[NH2+]C2CCN(CC3CCCC3)CC2)CC1 ZINC000120494718 330388805 /nfs/dbraw/zinc/38/88/05/330388805.db2.gz XKMDBFHYNPHFAP-INIZCTEOSA-N 1 3 276.468 3.587 20 0 CHADHO CN(C)Cc1ccc(C[NH2+]C2CCC(C(F)F)CC2)cc1 ZINC000442651453 330778306 /nfs/dbraw/zinc/77/83/06/330778306.db2.gz OTQVPLSGNZGBFR-UHFFFAOYSA-N 1 3 296.405 3.662 20 0 CHADHO C(C1CCCC1)N1CCC([NH2+][C@@H]2CCCC23CCC3)CC1 ZINC000449103452 330899229 /nfs/dbraw/zinc/89/92/29/330899229.db2.gz AWSHSFKUAAJULL-GOSISDBHSA-N 1 3 290.495 3.953 20 0 CHADHO CO[C@H](C)CCNC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449114301 330899910 /nfs/dbraw/zinc/89/99/10/330899910.db2.gz ZCUOUWGYKCMTJD-OAHLLOKOSA-N 1 3 298.515 3.680 20 0 CHADHO CC[C@H]([NH2+]C1CCN(C2CCCCC2)CC1)C1CCC1 ZINC000449178319 330903993 /nfs/dbraw/zinc/90/39/93/330903993.db2.gz SBFWINBHZZZMHM-SFHVURJKSA-N 1 3 278.484 3.952 20 0 CHADHO C[NH+](C)CCCC(C)(C)NCc1ncc(C(C)(C)C)s1 ZINC000449529425 330934105 /nfs/dbraw/zinc/93/41/05/330934105.db2.gz XAZMWSKGXKHCRD-UHFFFAOYSA-N 1 3 297.512 3.651 20 0 CHADHO CN1CCC[C@H]1CC[NH2+][C@H]1CCCC[C@H]1CC(F)(F)F ZINC000451300732 331023682 /nfs/dbraw/zinc/02/36/82/331023682.db2.gz VSGIEBCEKQWDKH-IHRRRGAJSA-N 1 3 292.389 3.572 20 0 CHADHO C[C@@H]1CC[C@H](NC[C@@H]2CC[N@@H+](C3CC3)C2)c2sccc21 ZINC000453076623 331086970 /nfs/dbraw/zinc/08/69/70/331086970.db2.gz JIVCWDKBTGFLFR-WWGRRREGSA-N 1 3 290.476 3.760 20 0 CHADHO C[C@@H]1CC[C@H](NC[C@@H]2CC[N@H+](C3CC3)C2)c2sccc21 ZINC000453076623 331086971 /nfs/dbraw/zinc/08/69/71/331086971.db2.gz JIVCWDKBTGFLFR-WWGRRREGSA-N 1 3 290.476 3.760 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC000459427373 331280856 /nfs/dbraw/zinc/28/08/56/331280856.db2.gz NIXZWZXXGXIFKQ-KRWDZBQOSA-N 1 3 286.463 3.774 20 0 CHADHO CN(C)[C@H]1CCC[C@H]([NH2+]C2CC(C)(c3ccccc3)C2)C1 ZINC000459432639 331281081 /nfs/dbraw/zinc/28/10/81/331281081.db2.gz UAILNEZRRSLLLG-BMHOQUIDSA-N 1 3 286.463 3.569 20 0 CHADHO C[NH+](C)[C@H]1CCC[C@H](NC2CC(C)(c3ccccc3)C2)C1 ZINC000459432639 331281082 /nfs/dbraw/zinc/28/10/82/331281082.db2.gz UAILNEZRRSLLLG-BMHOQUIDSA-N 1 3 286.463 3.569 20 0 CHADHO C[C@@H]1CCC[C@@H](N2CCC([NH2+][C@@H]3CCC[C@@H]4C[C@@H]43)CC2)C1 ZINC000459751685 331298419 /nfs/dbraw/zinc/29/84/19/331298419.db2.gz ICYZVQJTEIYOLB-SIZVQLJJSA-N 1 3 290.495 3.808 20 0 CHADHO C[C@@H]1CCCC[C@H]1N1CCC([NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000459779019 331300566 /nfs/dbraw/zinc/30/05/66/331300566.db2.gz WPRKKWGJXSZFOC-QWXYKEQDSA-N 1 3 290.495 3.808 20 0 CHADHO C[C@H](NCCCC[NH+]1CCC(C)CC1)c1ccccc1F ZINC000480636831 331780985 /nfs/dbraw/zinc/78/09/85/331780985.db2.gz FXMRBLUQIWGFCU-INIZCTEOSA-N 1 3 292.442 3.988 20 0 CHADHO CC(C)(C[NH2+][C@@H]1CS[C@H](C(C)(C)C)C1)CN1CCCC1 ZINC000488531951 332015940 /nfs/dbraw/zinc/01/59/40/332015940.db2.gz FSTIOVRZASIHLV-GJZGRUSLSA-N 1 3 298.540 3.618 20 0 CHADHO CC(C)(CN[C@@H]1CS[C@H](C(C)(C)C)C1)C[NH+]1CCCC1 ZINC000488531951 332015941 /nfs/dbraw/zinc/01/59/41/332015941.db2.gz FSTIOVRZASIHLV-GJZGRUSLSA-N 1 3 298.540 3.618 20 0 CHADHO Cc1ccc2c(c1)[C@@H](N[C@@H]1C[C@@H](C)[N@@H+](C)C[C@@H]1C)CCC2 ZINC000490228096 332085074 /nfs/dbraw/zinc/08/50/74/332085074.db2.gz YTXUAEIGBBBYMV-QGWWYQLQSA-N 1 3 286.463 3.691 20 0 CHADHO Cc1ccc2c(c1)[C@@H](N[C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C)CCC2 ZINC000490228096 332085075 /nfs/dbraw/zinc/08/50/75/332085075.db2.gz YTXUAEIGBBBYMV-QGWWYQLQSA-N 1 3 286.463 3.691 20 0 CHADHO C[C@H](CCC[NH3+])N[C@@H](C)c1ccc(Cl)cc1Cl ZINC000336679802 335111609 /nfs/dbraw/zinc/11/16/09/335111609.db2.gz DHXVLCJNKDXPLV-ZJUUUORDSA-N 1 3 275.223 3.771 20 0 CHADHO C[C@H](CCc1ccco1)N[C@H](C)C[C@H]1CCCCC[NH2+]1 ZINC000251131174 334356996 /nfs/dbraw/zinc/35/69/96/334356996.db2.gz UFOUIJJIICIKQP-BZUAXINKSA-N 1 3 278.440 3.501 20 0 CHADHO C[C@@H](C[NH2+]CCCN1CCCC[C@H]1C)c1ccccc1 ZINC000252203443 334376859 /nfs/dbraw/zinc/37/68/59/334376859.db2.gz UOYWQACWGYAADK-DLBZAZTESA-N 1 3 274.452 3.644 20 0 CHADHO C[C@H]1CCC[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000513074748 333003045 /nfs/dbraw/zinc/00/30/45/333003045.db2.gz JEZIIEMNWLYRLZ-DOTOQJQBSA-N 1 3 278.484 3.952 20 0 CHADHO C[C@H]1C[C@@H](CCNCc2ccco2)C[N@@H+]1Cc1ccccc1 ZINC000513508616 333023436 /nfs/dbraw/zinc/02/34/36/333023436.db2.gz YTZSQFNCJSFMSF-FUHWJXTLSA-N 1 3 298.430 3.670 20 0 CHADHO C[C@H]1C[C@@H](CCNCc2ccco2)C[N@H+]1Cc1ccccc1 ZINC000513508616 333023437 /nfs/dbraw/zinc/02/34/37/333023437.db2.gz YTZSQFNCJSFMSF-FUHWJXTLSA-N 1 3 298.430 3.670 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H](C)C2CCCCC2)C1 ZINC000177299214 333057097 /nfs/dbraw/zinc/05/70/97/333057097.db2.gz CPGXIRYLKOORBA-HOTGVXAUSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@H](C)C2CCCCCC2)C1 ZINC000517439400 333098992 /nfs/dbraw/zinc/09/89/92/333098992.db2.gz WVHFOVUHAAVWAL-HZPDHXFCSA-N 1 3 266.473 3.665 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+](C[C@H]2CC(C)=C[C@H](C)C2)C1 ZINC000520904363 333107701 /nfs/dbraw/zinc/10/77/01/333107701.db2.gz IFKGARGEQJPPAS-RYQLBKOJSA-N 1 3 278.484 3.643 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+](C[C@H]2CC(C)=C[C@H](C)C2)C1 ZINC000520904363 333107702 /nfs/dbraw/zinc/10/77/02/333107702.db2.gz IFKGARGEQJPPAS-RYQLBKOJSA-N 1 3 278.484 3.643 20 0 CHADHO Cc1cccc([C@H]2CCN(CC[C@H]3CCCC[N@H+]3C)C2)c1 ZINC000564157469 333124877 /nfs/dbraw/zinc/12/48/77/333124877.db2.gz OYHINVOFYJFREF-RBUKOAKNSA-N 1 3 286.463 3.659 20 0 CHADHO Cc1cccc([C@H]2CCN(CC[C@H]3CCCC[N@@H+]3C)C2)c1 ZINC000564157469 333124879 /nfs/dbraw/zinc/12/48/79/333124879.db2.gz OYHINVOFYJFREF-RBUKOAKNSA-N 1 3 286.463 3.659 20 0 CHADHO Cc1cccc([C@@H]2CCN(CC[C@@H]3CCCC[N@H+]3C)C2)c1 ZINC000564157462 333124957 /nfs/dbraw/zinc/12/49/57/333124957.db2.gz OYHINVOFYJFREF-MOPGFXCFSA-N 1 3 286.463 3.659 20 0 CHADHO Cc1cccc([C@@H]2CCN(CC[C@@H]3CCCC[N@@H+]3C)C2)c1 ZINC000564157462 333124959 /nfs/dbraw/zinc/12/49/59/333124959.db2.gz OYHINVOFYJFREF-MOPGFXCFSA-N 1 3 286.463 3.659 20 0 CHADHO CCCN(CCC)CCC[NH2+][C@H](C)C1CCSCC1 ZINC000187152288 333168111 /nfs/dbraw/zinc/16/81/11/333168111.db2.gz HXLUICNKLADBDK-OAHLLOKOSA-N 1 3 286.529 3.620 20 0 CHADHO [NH3+][C@@H]1CCC[C@H](N[C@@H](c2cccs2)C2CCCC2)C1 ZINC000222956248 333203100 /nfs/dbraw/zinc/20/31/00/333203100.db2.gz MEGUKERRJXGUAX-IJEWVQPXSA-N 1 3 278.465 3.839 20 0 CHADHO C[NH+](C)Cc1ccc(CNCc2cc(Cl)cs2)cc1 ZINC000192983997 333240844 /nfs/dbraw/zinc/24/08/44/333240844.db2.gz WVDOUQRRXJSPPH-UHFFFAOYSA-N 1 3 294.851 3.753 20 0 CHADHO C[C@@H](c1ccc(F)cc1)[N@H+](C)CCCN1CCCCC1 ZINC000195632299 333258054 /nfs/dbraw/zinc/25/80/54/333258054.db2.gz ZIHNLYSEIGOQRV-HNNXBMFYSA-N 1 3 278.415 3.695 20 0 CHADHO C[C@@H](c1ccc(F)cc1)[N@@H+](C)CCCN1CCCCC1 ZINC000195632299 333258056 /nfs/dbraw/zinc/25/80/56/333258056.db2.gz ZIHNLYSEIGOQRV-HNNXBMFYSA-N 1 3 278.415 3.695 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@H](c2cccs2)C2CCCC2)C1 ZINC000226918735 333272153 /nfs/dbraw/zinc/27/21/53/333272153.db2.gz SZAUIFLXOZCTFI-YOEHRIQHSA-N 1 3 292.492 3.911 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@H](c2cccs2)C2CCCC2)C1 ZINC000226918735 333272154 /nfs/dbraw/zinc/27/21/54/333272154.db2.gz SZAUIFLXOZCTFI-YOEHRIQHSA-N 1 3 292.492 3.911 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@H](c2cccs2)C2CCCC2)C1 ZINC000226918735 333272156 /nfs/dbraw/zinc/27/21/56/333272156.db2.gz SZAUIFLXOZCTFI-YOEHRIQHSA-N 1 3 292.492 3.911 20 0 CHADHO C[C@H](NCC1(C)CC[NH+](C)CC1)c1ccc(F)cc1Cl ZINC000227497501 333283669 /nfs/dbraw/zinc/28/36/69/333283669.db2.gz GWCYHIWDCQOGCW-LBPRGKRZSA-N 1 3 298.833 3.862 20 0 CHADHO CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCCN2)C1 ZINC000235211272 333366910 /nfs/dbraw/zinc/36/69/10/333366910.db2.gz BUBGVKJWWJGRQD-JZAWBGDQSA-N 1 3 296.524 3.561 20 0 CHADHO CCc1cccc(CNCc2ccc(C[NH+](C)C)cc2)c1 ZINC000576045965 335145344 /nfs/dbraw/zinc/14/53/44/335145344.db2.gz XVXLVXUCUWZWBL-UHFFFAOYSA-N 1 3 282.431 3.600 20 0 CHADHO CC[C@H]1CCC[C@H]([NH2+]CCCN2CCC(C)CC2)C1 ZINC000071107108 333843480 /nfs/dbraw/zinc/84/34/80/333843480.db2.gz IRMCTJNSMZXMSC-IRXDYDNUSA-N 1 3 266.473 3.667 20 0 CHADHO CCCC[C@H](CC)C[N@@H+]1CC[C@H]2[C@@H](CCCN2C)C1 ZINC000546930634 334055779 /nfs/dbraw/zinc/05/57/79/334055779.db2.gz KQYQNGCBZOSJPC-ULQDDVLXSA-N 1 3 266.473 3.619 20 0 CHADHO CCCC[C@H](CC)C[N@H+]1CC[C@H]2[C@@H](CCCN2C)C1 ZINC000546930634 334055781 /nfs/dbraw/zinc/05/57/81/334055781.db2.gz KQYQNGCBZOSJPC-ULQDDVLXSA-N 1 3 266.473 3.619 20 0 CHADHO C[C@@H](Cc1ccccc1F)[NH2+]CCCN1CCCC[C@@H]1C ZINC000133924578 334071337 /nfs/dbraw/zinc/07/13/37/334071337.db2.gz DQIXJTBJPUEBKE-HOTGVXAUSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@@H](Cc1ccccc1F)NCCC[N@@H+]1CCCC[C@@H]1C ZINC000133924578 334071338 /nfs/dbraw/zinc/07/13/38/334071338.db2.gz DQIXJTBJPUEBKE-HOTGVXAUSA-N 1 3 292.442 3.611 20 0 CHADHO C[C@@H](Cc1ccccc1F)NCCC[N@H+]1CCCC[C@@H]1C ZINC000133924578 334071341 /nfs/dbraw/zinc/07/13/41/334071341.db2.gz DQIXJTBJPUEBKE-HOTGVXAUSA-N 1 3 292.442 3.611 20 0 CHADHO CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@H]1C=CCCC1 ZINC000076109774 334072782 /nfs/dbraw/zinc/07/27/82/334072782.db2.gz OCOMCFQUCYFCEC-MOPGFXCFSA-N 1 3 284.447 3.549 20 0 CHADHO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1C=CCCC1 ZINC000076109774 334072784 /nfs/dbraw/zinc/07/27/84/334072784.db2.gz OCOMCFQUCYFCEC-MOPGFXCFSA-N 1 3 284.447 3.549 20 0 CHADHO C1=C[C@H](N2CCC[C@H]([NH+]3CCCC3)CC2)CCCCC1 ZINC000549464168 334194684 /nfs/dbraw/zinc/19/46/84/334194684.db2.gz LEAPTGPBWSVOGO-ROUUACIJSA-N 1 3 276.468 3.826 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN([C@@H]2CCCc3ccccc32)C1 ZINC000081568194 334196945 /nfs/dbraw/zinc/19/69/45/334196945.db2.gz LVRADUGFSNRJIX-QFBILLFUSA-N 1 3 286.463 3.728 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN([C@@H]2CCCc3ccccc32)C1 ZINC000081568194 334196946 /nfs/dbraw/zinc/19/69/46/334196946.db2.gz LVRADUGFSNRJIX-QFBILLFUSA-N 1 3 286.463 3.728 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+]([C@@H]2CCCc3ccccc32)C1 ZINC000081568194 334196947 /nfs/dbraw/zinc/19/69/47/334196947.db2.gz LVRADUGFSNRJIX-QFBILLFUSA-N 1 3 286.463 3.728 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+]([C@@H]2CCCc3ccccc32)C1 ZINC000081568194 334196948 /nfs/dbraw/zinc/19/69/48/334196948.db2.gz LVRADUGFSNRJIX-QFBILLFUSA-N 1 3 286.463 3.728 20 0 CHADHO Cc1cc(Cl)cc(C[NH2+][C@H]2CCC[C@@H](N(C)C)C2)c1 ZINC000549763866 334204410 /nfs/dbraw/zinc/20/44/10/334204410.db2.gz NYYKXUTYIPWZHN-JKSUJKDBSA-N 1 3 280.843 3.611 20 0 CHADHO C[C@H](NC[C@H]1CCC[N@H+](C)C1)c1cccc(C2CC2)c1 ZINC000551050630 334237179 /nfs/dbraw/zinc/23/71/79/334237179.db2.gz JKAHUXPTOMLHHN-LSDHHAIUSA-N 1 3 272.436 3.556 20 0 CHADHO C[C@H](NC[C@H]1CCC[N@@H+](C)C1)c1cccc(C2CC2)c1 ZINC000551050630 334237180 /nfs/dbraw/zinc/23/71/80/334237180.db2.gz JKAHUXPTOMLHHN-LSDHHAIUSA-N 1 3 272.436 3.556 20 0 CHADHO CC(C)(C[NH2+][C@H]1CCCC12CCCC2)CN1CCCC1 ZINC000551176319 334240049 /nfs/dbraw/zinc/24/00/49/334240049.db2.gz XGSINYYKGGGDIF-INIZCTEOSA-N 1 3 278.484 3.811 20 0 CHADHO CCc1cccnc1[C@@H](C)NCCCCC[NH+]1CCCC1 ZINC000551263001 334243432 /nfs/dbraw/zinc/24/34/32/334243432.db2.gz KENHLIVBBFAENV-MRXNPFEDSA-N 1 3 289.467 3.561 20 0 CHADHO CC(C)N1CCC[C@H](C[NH2+][C@H](C)c2cccc(F)c2)C1 ZINC000246880851 334271101 /nfs/dbraw/zinc/27/11/01/334271101.db2.gz DAAMAGIQCOKUIR-HUUCEWRRSA-N 1 3 278.415 3.597 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@H](C)c2cccc(F)c2)C1 ZINC000246880825 334271169 /nfs/dbraw/zinc/27/11/69/334271169.db2.gz DAAMAGIQCOKUIR-CABCVRRESA-N 1 3 278.415 3.597 20 0 CHADHO C[C@@H]1CCc2c(F)cccc2[C@@H]1N[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000247949357 334291966 /nfs/dbraw/zinc/29/19/66/334291966.db2.gz DXAVUFMQUADJBK-KYZVSKTDSA-N 1 3 290.426 3.521 20 0 CHADHO C[C@@H]1CCc2c(F)cccc2[C@@H]1N[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000247949357 334291967 /nfs/dbraw/zinc/29/19/67/334291967.db2.gz DXAVUFMQUADJBK-KYZVSKTDSA-N 1 3 290.426 3.521 20 0 CHADHO C[N@@H+]1CC[C@H](NCc2cccc3ccccc32)[C@H]2CCC[C@@H]21 ZINC000552248724 334308593 /nfs/dbraw/zinc/30/85/93/334308593.db2.gz QWCKWZYFQGGAGQ-AABGKKOBSA-N 1 3 294.442 3.802 20 0 CHADHO C[N@H+]1CC[C@H](NCc2cccc3ccccc32)[C@H]2CCC[C@@H]21 ZINC000552248724 334308594 /nfs/dbraw/zinc/30/85/94/334308594.db2.gz QWCKWZYFQGGAGQ-AABGKKOBSA-N 1 3 294.442 3.802 20 0 CHADHO CC(C)[C@@H]1CC[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000552251193 334308672 /nfs/dbraw/zinc/30/86/72/334308672.db2.gz NBCKSAKZDAWMOX-ROUUACIJSA-N 1 3 278.484 3.808 20 0 CHADHO CC[NH+](CC)C[C@@H]1CCN(CC[C@H](C)c2ccccc2)C1 ZINC000248830180 334319092 /nfs/dbraw/zinc/31/90/92/334319092.db2.gz HDFOYQUGVGNRRS-ROUUACIJSA-N 1 3 288.479 3.844 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](CC[C@H](C)c2ccccc2)C1 ZINC000248830180 334319093 /nfs/dbraw/zinc/31/90/93/334319093.db2.gz HDFOYQUGVGNRRS-ROUUACIJSA-N 1 3 288.479 3.844 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](CC[C@H](C)c2ccccc2)C1 ZINC000248830180 334319094 /nfs/dbraw/zinc/31/90/94/334319094.db2.gz HDFOYQUGVGNRRS-ROUUACIJSA-N 1 3 288.479 3.844 20 0 CHADHO CC(C)CN1CCC[C@H](C[NH2+][C@H](C)CCC2CC2)C1 ZINC000248992145 334323982 /nfs/dbraw/zinc/32/39/82/334323982.db2.gz LHCAPZSCEDURTJ-NVXWUHKLSA-N 1 3 266.473 3.523 20 0 CHADHO CCCN1CC[C@@H](C[NH2+]C[C@H](C)c2cccc(Cl)c2)C1 ZINC000249250153 334330496 /nfs/dbraw/zinc/33/04/96/334330496.db2.gz BWZBXTVZQLCQEC-GJZGRUSLSA-N 1 3 294.870 3.765 20 0 CHADHO C[C@@H](NCCCC[N@@H+]1CCC[C@@H](C)C1)c1cccc(O)c1 ZINC000249410632 334333599 /nfs/dbraw/zinc/33/35/99/334333599.db2.gz CSYMXYBUBUBLAC-HZPDHXFCSA-N 1 3 290.451 3.555 20 0 CHADHO C[C@@H](NCCCC[N@H+]1CCC[C@@H](C)C1)c1cccc(O)c1 ZINC000249410632 334333601 /nfs/dbraw/zinc/33/36/01/334333601.db2.gz CSYMXYBUBUBLAC-HZPDHXFCSA-N 1 3 290.451 3.555 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](c2ccc(C)cc2)C2CCC2)C1 ZINC000249838351 334340963 /nfs/dbraw/zinc/34/09/63/334340963.db2.gz FRANYLXMAQJEJF-APWZRJJASA-N 1 3 286.463 3.768 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](c2ccc(C)cc2)C2CCC2)C1 ZINC000249838351 334340964 /nfs/dbraw/zinc/34/09/64/334340964.db2.gz FRANYLXMAQJEJF-APWZRJJASA-N 1 3 286.463 3.768 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](c2ccc(C)cc2)C2CCC2)C1 ZINC000249838351 334340966 /nfs/dbraw/zinc/34/09/66/334340966.db2.gz FRANYLXMAQJEJF-APWZRJJASA-N 1 3 286.463 3.768 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2N[C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000250528623 334345702 /nfs/dbraw/zinc/34/57/02/334345702.db2.gz IXJZNJGXVSVDHH-AKHDSKFASA-N 1 3 284.447 3.574 20 0 CHADHO CC(C)Oc1ccc([C@H](C)N[C@@H]2CCCC[C@H]2C[NH3+])cc1 ZINC000250575038 334346346 /nfs/dbraw/zinc/34/63/46/334346346.db2.gz CUSJNQFUNFFBDC-QILLFSRXSA-N 1 3 290.451 3.642 20 0 CHADHO CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCN2CCC[C@@H]2C1 ZINC000250689118 334348639 /nfs/dbraw/zinc/34/86/39/334348639.db2.gz INPYPYTZPSAZOS-HZMVEIRTSA-N 1 3 278.484 3.808 20 0 CHADHO Cc1ccsc1[C@H](C)[NH2+]CCCN1CCCC[C@H]1C ZINC000250871211 334352478 /nfs/dbraw/zinc/35/24/78/334352478.db2.gz KPOUILXTPVQOBA-CABCVRRESA-N 1 3 280.481 3.972 20 0 CHADHO C[C@H]1C[C@H](N[C@@H]2C[C@@H]([NH3+])c3ccccc32)C[C@@H](C)C1 ZINC000252792037 334393391 /nfs/dbraw/zinc/39/33/91/334393391.db2.gz UXSFAGRFDOJJOF-DVKYCARXSA-N 1 3 258.409 3.546 20 0 CHADHO [NH3+][C@@H]1C[C@H](N[C@H]2CCC[C@@H](C(F)(F)F)C2)c2ccccc21 ZINC000252794177 334393402 /nfs/dbraw/zinc/39/34/02/334393402.db2.gz YKPGSNRFOIPTTM-BVIHXZOGSA-N 1 3 298.352 3.842 20 0 CHADHO C1=CC[C@H](C[NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000158042907 334790650 /nfs/dbraw/zinc/79/06/50/334790650.db2.gz MNPNYMDWOSYMOJ-INIZCTEOSA-N 1 3 276.468 3.729 20 0 CHADHO Cc1ccoc1CNCC1CC[NH+](Cc2ccccc2)CC1 ZINC000343670859 335215481 /nfs/dbraw/zinc/21/54/81/335215481.db2.gz SSJXMDNYQZUALN-UHFFFAOYSA-N 1 3 298.430 3.590 20 0 CHADHO CC(C)C[C@@H]([NH2+]CC1=CCN(C)CC1)c1ccccc1 ZINC000344299161 335246537 /nfs/dbraw/zinc/24/65/37/335246537.db2.gz OQTQVPVPYFWWNX-GOSISDBHSA-N 1 3 272.436 3.625 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)C1 ZINC000576907768 335262754 /nfs/dbraw/zinc/26/27/54/335262754.db2.gz PMDLPKKTKMKIQQ-NZSAHSFTSA-N 1 3 286.463 3.643 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3N[C@@H](C)CC[NH+](C)C ZINC000580672820 335320271 /nfs/dbraw/zinc/32/02/71/335320271.db2.gz OTPHRRANBUXWRA-KSSFIOAISA-N 1 3 299.462 3.784 20 0 CHADHO C[C@H](NCCCCC[NH+]1CCCCC1)c1ccoc1 ZINC000178145046 335419676 /nfs/dbraw/zinc/41/96/76/335419676.db2.gz JGFBHAVEQYTBPM-HNNXBMFYSA-N 1 3 264.413 3.586 20 0 CHADHO CCC[C@H](CC)[NH2+][C@H](C)c1cccc(OCCN(C)C)c1 ZINC000581268170 336034795 /nfs/dbraw/zinc/03/47/95/336034795.db2.gz SZZVLNWGEQFYRX-WBVHZDCISA-N 1 3 292.467 3.856 20 0 CHADHO Cc1c[nH+]ccc1NC[C@H](c1cccs1)N1CCCC1 ZINC000195334612 336051675 /nfs/dbraw/zinc/05/16/75/336051675.db2.gz XHRNBXMYMIYNHN-OAHLLOKOSA-N 1 3 287.432 3.701 20 0 CHADHO CC(C)(C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCCN1)C1CCC1 ZINC000385029575 336136040 /nfs/dbraw/zinc/13/60/40/336136040.db2.gz KFSYCGIAXSQPKJ-YESZJQIVSA-N 1 3 278.484 3.713 20 0 CHADHO CC[NH+](CC)CCC[C@@H](C)N[C@H](C)c1cccnc1Cl ZINC000131278310 520632072 /nfs/dbraw/zinc/63/20/72/520632072.db2.gz WVVMVMNHVVZDNB-ZIAGYGMSSA-N 1 3 297.874 3.896 20 0 CHADHO Cc1cc(Cl)cc(C)c1CN1CCC([C@@H](C)[NH3+])CC1 ZINC000347219611 533769815 /nfs/dbraw/zinc/76/98/15/533769815.db2.gz SVASLSMXPGJVHD-CYBMUJFWSA-N 1 3 280.843 3.516 20 0 CHADHO CC(C)[C@H](N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000127846505 519821604 /nfs/dbraw/zinc/82/16/04/519821604.db2.gz BGPAQWZNTRRHPU-KURKYZTESA-N 1 3 272.436 3.600 20 0 CHADHO CC(C)[C@H](N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000127846505 519821605 /nfs/dbraw/zinc/82/16/05/519821605.db2.gz BGPAQWZNTRRHPU-KURKYZTESA-N 1 3 272.436 3.600 20 0 CHADHO CCCC[N@H+](C)CC1CCN([C@@H](C)c2cccnc2)CC1 ZINC000264988542 520400484 /nfs/dbraw/zinc/40/04/84/520400484.db2.gz MJLLWGJNCWXSQL-INIZCTEOSA-N 1 3 289.467 3.587 20 0 CHADHO CCCC[N@@H+](C)CC1CCN([C@@H](C)c2cccnc2)CC1 ZINC000264988542 520400499 /nfs/dbraw/zinc/40/04/99/520400499.db2.gz MJLLWGJNCWXSQL-INIZCTEOSA-N 1 3 289.467 3.587 20 0 CHADHO CCCCN1CCC([NH2+][C@@H](C)c2cccc(OC)c2)CC1 ZINC000037150434 520577388 /nfs/dbraw/zinc/57/73/88/520577388.db2.gz IHVUJJUVVCDMDH-HNNXBMFYSA-N 1 3 290.451 3.610 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N[C@H](C)c1ccc(C)o1 ZINC000019915079 520637031 /nfs/dbraw/zinc/63/70/31/520637031.db2.gz IOZYKTZJERQTRY-DZGCQCFKSA-N 1 3 266.429 3.749 20 0 CHADHO CC[NH+](CC)Cc1cccc(CNCc2cnccc2C)c1 ZINC000279797218 520755003 /nfs/dbraw/zinc/75/50/03/520755003.db2.gz DJRNETTYRYEYKE-UHFFFAOYSA-N 1 3 297.446 3.522 20 0 CHADHO C[C@H](N[C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc2ccccc2c1 ZINC000093978076 525567196 /nfs/dbraw/zinc/56/71/96/525567196.db2.gz ZCEYHYFIYXPBTR-ZRGWGRIASA-N 1 3 282.431 3.973 20 0 CHADHO C[C@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc2ccccc2c1 ZINC000093978076 525567204 /nfs/dbraw/zinc/56/72/04/525567204.db2.gz ZCEYHYFIYXPBTR-ZRGWGRIASA-N 1 3 282.431 3.973 20 0 CHADHO Cc1oc2ccccc2c1CN(C)[C@H]1CC[N@@H+](C)C[C@@H]1C ZINC000290395760 526786708 /nfs/dbraw/zinc/78/67/08/526786708.db2.gz JBEVLEWOYNJBDR-GUYCJALGSA-N 1 3 286.419 3.513 20 0 CHADHO Cc1oc2ccccc2c1CN(C)[C@H]1CC[N@H+](C)C[C@@H]1C ZINC000290395760 526786709 /nfs/dbraw/zinc/78/67/09/526786709.db2.gz JBEVLEWOYNJBDR-GUYCJALGSA-N 1 3 286.419 3.513 20 0 CHADHO CCN(CC)CCC[NH2+][C@H](C)C1CCC(F)(F)CC1 ZINC000353244224 528113190 /nfs/dbraw/zinc/11/31/90/528113190.db2.gz PMSXVKOKMUJWTK-CYBMUJFWSA-N 1 3 276.415 3.522 20 0 CHADHO Cc1ccccc1[C@@H](C)N[C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623337661 1117834568 /nfs/dbraw/zinc/83/45/68/1117834568.db2.gz SELRQADBMCYZIJ-CABCVRRESA-N 1 3 260.425 3.518 20 0 CHADHO Cc1ccccc1[C@@H](C)N[C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623337661 1117834571 /nfs/dbraw/zinc/83/45/71/1117834571.db2.gz SELRQADBMCYZIJ-CABCVRRESA-N 1 3 260.425 3.518 20 0 CHADHO C[C@@H](N[C@H]1CCC[NH2+]CC1)c1ccc(C(C)(C)C)cc1 ZINC000133627866 1125480884 /nfs/dbraw/zinc/48/08/84/1125480884.db2.gz QHQKWHUOPINZNR-PBHICJAKSA-N 1 3 274.452 3.777 20 0 CHADHO CC(C)Cc1ccc([C@@H](C)N[C@H]2CCC[NH2+]CC2)cc1 ZINC000133640876 1125482144 /nfs/dbraw/zinc/48/21/44/1125482144.db2.gz HYULYVMHDCUAAJ-QAPCUYQASA-N 1 3 274.452 3.678 20 0 CHADHO CC[C@@H]([NH2+]C[C@H]1CCN(CC)C1)c1ccc(Cl)cc1 ZINC000037644082 1118033464 /nfs/dbraw/zinc/03/34/64/1118033464.db2.gz QMZLUPMQQXYCKX-CZUORRHYSA-N 1 3 280.843 3.723 20 0 CHADHO Cc1nc(C(C)C)sc1[C@H](C)[NH2+]CC(C)(C)CN(C)C ZINC000132116734 1125500025 /nfs/dbraw/zinc/50/00/25/1125500025.db2.gz XOKUYPKGLVAZCF-LBPRGKRZSA-N 1 3 297.512 3.813 20 0 CHADHO CCC[C@@H](C)CCCN1CCC(C)([NH+]2CCC2)CC1 ZINC001175668563 1121428595 /nfs/dbraw/zinc/42/85/95/1121428595.db2.gz CIIMEPAODVLNJY-MRXNPFEDSA-N 1 3 266.473 3.763 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)CCSC2CCCCC2)[C@@H](C)C1 ZINC000501035657 1121946584 /nfs/dbraw/zinc/94/65/84/1121946584.db2.gz IPXRGOXLDFGRSG-RDJZCZTQSA-N 1 3 298.540 3.714 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)CCSC2CCCCC2)[C@@H](C)C1 ZINC000501035657 1121946589 /nfs/dbraw/zinc/94/65/89/1121946589.db2.gz IPXRGOXLDFGRSG-RDJZCZTQSA-N 1 3 298.540 3.714 20 0 CHADHO CC[C@@H]([NH2+]C[C@H]1CCCN(CC(C)C)C1)C1CCC1 ZINC000449212461 1124670273 /nfs/dbraw/zinc/67/02/73/1124670273.db2.gz SQJPIBFIPBLMTE-NVXWUHKLSA-N 1 3 266.473 3.523 20 0 CHADHO CC[C@@]1([NH2+]C2CCC3(CCCCC3)CC2)CCNC1 ZINC001246456449 1131505485 /nfs/dbraw/zinc/50/54/85/1131505485.db2.gz AOKPHYVRCKKHQK-QGZVFWFLSA-N 1 3 264.457 3.611 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC[C@]2(C)C[C@]2(F)Cl)CC1 ZINC000846031394 1131679783 /nfs/dbraw/zinc/67/97/83/1131679783.db2.gz IHESFVRNRRFLJJ-HUUCEWRRSA-N 1 3 290.854 3.544 20 0 CHADHO CC[N@H+](CCCN(C)C)Cc1ccc(Cl)c(Cl)c1 ZINC001203806445 1133371360 /nfs/dbraw/zinc/37/13/60/1133371360.db2.gz FRVYMZOBQIFHOT-UHFFFAOYSA-N 1 3 289.250 3.767 20 0 CHADHO CC[N@@H+](CCCN(C)C)Cc1ccc(Cl)c(Cl)c1 ZINC001203806445 1133371367 /nfs/dbraw/zinc/37/13/67/1133371367.db2.gz FRVYMZOBQIFHOT-UHFFFAOYSA-N 1 3 289.250 3.767 20 0 CHADHO CS[C@@H](C)CCN(C)C1CC[NH+](C2CCCCC2)CC1 ZINC001208151736 1133885851 /nfs/dbraw/zinc/88/58/51/1133885851.db2.gz XXYDJLWVJDWVOO-HNNXBMFYSA-N 1 3 298.540 3.857 20 0 CHADHO CS[C@@H](C)CC[N@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001208151736 1133885857 /nfs/dbraw/zinc/88/58/57/1133885857.db2.gz XXYDJLWVJDWVOO-HNNXBMFYSA-N 1 3 298.540 3.857 20 0 CHADHO CS[C@@H](C)CC[N@@H+](C)C1CCN(C2CCCCC2)CC1 ZINC001208151736 1133885862 /nfs/dbraw/zinc/88/58/62/1133885862.db2.gz XXYDJLWVJDWVOO-HNNXBMFYSA-N 1 3 298.540 3.857 20 0 CHADHO Cc1ccc(CN2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)s1 ZINC000246192593 1125608682 /nfs/dbraw/zinc/60/86/82/1125608682.db2.gz LIWIMHBMJLTZFX-YOEHRIQHSA-N 1 3 290.476 3.505 20 0 CHADHO Cc1ccc(CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)s1 ZINC000246192593 1125608684 /nfs/dbraw/zinc/60/86/84/1125608684.db2.gz LIWIMHBMJLTZFX-YOEHRIQHSA-N 1 3 290.476 3.505 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](C)c2ccccc2C(C)(C)C)C1 ZINC000533638722 1125620092 /nfs/dbraw/zinc/62/00/92/1125620092.db2.gz MOPDLRMCLFBBSW-HZPDHXFCSA-N 1 3 288.479 3.977 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](C)c2ccccc2C(C)(C)C)C1 ZINC000533638722 1125620094 /nfs/dbraw/zinc/62/00/94/1125620094.db2.gz MOPDLRMCLFBBSW-HZPDHXFCSA-N 1 3 288.479 3.977 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](C)c2ccccc2C(C)(C)C)C1 ZINC000533638722 1125620097 /nfs/dbraw/zinc/62/00/97/1125620097.db2.gz MOPDLRMCLFBBSW-HZPDHXFCSA-N 1 3 288.479 3.977 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H]2C[C@H](c3ccccc3)C2(C)C)C1 ZINC000248634471 1125672881 /nfs/dbraw/zinc/67/28/81/1125672881.db2.gz JLWZNUVIVOXXOD-NXHRZFHOSA-N 1 3 286.463 3.500 20 0 CHADHO CCC[NH+]1CCC(N[C@@H](C)c2cc3c(s2)CCC3)CC1 ZINC000161623764 1125707853 /nfs/dbraw/zinc/70/78/53/1125707853.db2.gz PVZXFSNJIHFYJG-ZDUSSCGKSA-N 1 3 292.492 3.762 20 0 CHADHO CC[C@@H](CC(F)F)C[NH+]1CCC(CC)(N2CCC2)CC1 ZINC000886719668 1125713622 /nfs/dbraw/zinc/71/36/22/1125713622.db2.gz CTAMGGIJEAEWHG-AWEZNQCLSA-N 1 3 288.426 3.618 20 0 CHADHO Cc1ccccc1[C@@H](C(C)C)N(C)C[C@]1(C)CC[NH2+]C1 ZINC000261994342 1125748822 /nfs/dbraw/zinc/74/88/22/1125748822.db2.gz KPJNOLFIMGJWAZ-QZTJIDSGSA-N 1 3 274.452 3.624 20 0 CHADHO CCSc1ccc([C@H](C)[NH2+]C[C@@H]2CCN(CC)C2)cc1 ZINC000533785288 1125781119 /nfs/dbraw/zinc/78/11/19/1125781119.db2.gz RBHPTSYPZMIXRX-GJZGRUSLSA-N 1 3 292.492 3.791 20 0 CHADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H]2CCc3c2cccc3F)C1 ZINC000482358661 1126752734 /nfs/dbraw/zinc/75/27/34/1126752734.db2.gz OTNVLTJEAUEFAU-KBXCAEBGSA-N 1 3 290.426 3.523 20 0 CHADHO C(CC1CCCC1)CN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000483200424 1126772708 /nfs/dbraw/zinc/77/27/08/1126772708.db2.gz QKPRANWRVIBUDE-SFHVURJKSA-N 1 3 278.484 3.907 20 0 CHADHO C[C@H]1CCCC[N@@H+]1Cc1ccc(CNCc2cc[nH]c2)cc1 ZINC000175697857 1126784558 /nfs/dbraw/zinc/78/45/58/1126784558.db2.gz AZPNWTRZGNJYQP-INIZCTEOSA-N 1 3 297.446 3.679 20 0 CHADHO C[C@H]1CCCC[N@H+]1Cc1ccc(CNCc2cc[nH]c2)cc1 ZINC000175697857 1126784561 /nfs/dbraw/zinc/78/45/61/1126784561.db2.gz AZPNWTRZGNJYQP-INIZCTEOSA-N 1 3 297.446 3.679 20 0 CHADHO C[C@H](NCc1cccc(C[NH+](C)C)c1)c1ccsc1 ZINC000177733819 1126805008 /nfs/dbraw/zinc/80/50/08/1126805008.db2.gz PDQYLWRATOXZAX-ZDUSSCGKSA-N 1 3 274.433 3.661 20 0 CHADHO Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H](N(C)C)C2)cc1C ZINC000484483619 1126821546 /nfs/dbraw/zinc/82/15/46/1126821546.db2.gz ADLAYILWHOBZSU-SZMVWBNQSA-N 1 3 274.452 3.827 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1cccc(Cl)c1 ZINC000484500313 1126822139 /nfs/dbraw/zinc/82/21/39/1126822139.db2.gz KOSGRLNHCKKOOT-APHBMKBZSA-N 1 3 280.843 3.863 20 0 CHADHO CCc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](N(C)C)C2)s1 ZINC000484473655 1126820204 /nfs/dbraw/zinc/82/02/04/1126820204.db2.gz MVJFKIRBPXWDJB-BFHYXJOUSA-N 1 3 280.481 3.834 20 0 CHADHO CC(C)[C@@H](CNC[C@@H]([NH3+])CCC(C)(C)C)c1cccnc1 ZINC000904363538 1126849948 /nfs/dbraw/zinc/84/99/48/1126849948.db2.gz IBQDZMFYNMQCQS-DLBZAZTESA-N 1 3 291.483 3.564 20 0 CHADHO CC[C@H](c1ccccc1)N1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000252418000 1126853445 /nfs/dbraw/zinc/85/34/45/1126853445.db2.gz UHVJWNUOGIZLET-RCCFBDPRSA-N 1 3 272.436 3.602 20 0 CHADHO Cc1csc(C[N@H+](CC(C)(C)C)C2CCNCC2)c1 ZINC001236458092 1130946437 /nfs/dbraw/zinc/94/64/37/1130946437.db2.gz RFYRFCJLCWCKHH-UHFFFAOYSA-N 1 3 280.481 3.657 20 0 CHADHO Cc1csc(C[N@@H+](CC(C)(C)C)C2CCNCC2)c1 ZINC001236458092 1130946442 /nfs/dbraw/zinc/94/64/42/1130946442.db2.gz RFYRFCJLCWCKHH-UHFFFAOYSA-N 1 3 280.481 3.657 20 0 CHADHO Cc1csc(CN(CC(C)(C)C)C2CC[NH2+]CC2)c1 ZINC001236458092 1130946445 /nfs/dbraw/zinc/94/64/45/1130946445.db2.gz RFYRFCJLCWCKHH-UHFFFAOYSA-N 1 3 280.481 3.657 20 0 CHADHO Cc1cc([C@H](N[C@@H]2CC[N@H+](C)[C@@H](C)C2)C2CC2)ccc1F ZINC000271540228 1127090057 /nfs/dbraw/zinc/09/00/57/1127090057.db2.gz QSXOZFJPAXQQGG-FDQGKXFDSA-N 1 3 290.426 3.658 20 0 CHADHO Cc1cc([C@H](N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)C2CC2)ccc1F ZINC000271540228 1127090059 /nfs/dbraw/zinc/09/00/59/1127090059.db2.gz QSXOZFJPAXQQGG-FDQGKXFDSA-N 1 3 290.426 3.658 20 0 CHADHO CCCC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCNC2(CCC2)C1 ZINC000666995599 1127139449 /nfs/dbraw/zinc/13/94/49/1127139449.db2.gz SVJCMIXPIDDSAD-OAGGEKHMSA-N 1 3 264.457 3.610 20 0 CHADHO c1csc([C@@H]2CCCN2C2CC[NH+](CC3CC3)CC2)c1 ZINC001168379414 1127162748 /nfs/dbraw/zinc/16/27/48/1127162748.db2.gz JVCSAFLDPIDAQJ-INIZCTEOSA-N 1 3 290.476 3.759 20 0 CHADHO CN1[C@@H]2CC[C@H]1CC([N@H+](C)Cc1cccc(C(F)F)c1)C2 ZINC000285346063 1127223212 /nfs/dbraw/zinc/22/32/12/1127223212.db2.gz AOBUNROCRSPEPA-XYPWUTKMSA-N 1 3 294.389 3.681 20 0 CHADHO CN1[C@@H]2CC[C@H]1CC([N@@H+](C)Cc1cccc(C(F)F)c1)C2 ZINC000285346063 1127223215 /nfs/dbraw/zinc/22/32/15/1127223215.db2.gz AOBUNROCRSPEPA-XYPWUTKMSA-N 1 3 294.389 3.681 20 0 CHADHO Cc1ccnc([C@@H](C)NCCCC[N@@H+]2CCC[C@H](C)C2)c1 ZINC000285464728 1127229880 /nfs/dbraw/zinc/22/98/80/1127229880.db2.gz AJVHAGSIKVJGHB-DLBZAZTESA-N 1 3 289.467 3.553 20 0 CHADHO Cc1ccnc([C@@H](C)NCCCC[N@H+]2CCC[C@H](C)C2)c1 ZINC000285464728 1127229882 /nfs/dbraw/zinc/22/98/82/1127229882.db2.gz AJVHAGSIKVJGHB-DLBZAZTESA-N 1 3 289.467 3.553 20 0 CHADHO CCCCN1CCC([NH2+]Cc2ccc(SC)s2)CC1 ZINC000574085287 1127370659 /nfs/dbraw/zinc/37/06/59/1127370659.db2.gz YDMLRKLCTZQPEK-UHFFFAOYSA-N 1 3 298.521 3.824 20 0 CHADHO C[C@@H](NCCCCC[NH+]1CCCC1)c1ccc(Cl)cn1 ZINC000293636865 1127510161 /nfs/dbraw/zinc/51/01/61/1127510161.db2.gz GWKQUDPRPRRPQP-CQSZACIVSA-N 1 3 295.858 3.652 20 0 CHADHO CC[C@H](N[C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(C)cc1 ZINC000361970965 1127603678 /nfs/dbraw/zinc/60/36/78/1127603678.db2.gz JPTLQFVIQXLPOJ-KURKYZTESA-N 1 3 274.452 3.909 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCC[C@@H](N(C)C)C1)c1ccc(C)cc1 ZINC000361970965 1127603679 /nfs/dbraw/zinc/60/36/79/1127603679.db2.gz JPTLQFVIQXLPOJ-KURKYZTESA-N 1 3 274.452 3.909 20 0 CHADHO C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C)c1ccc2ccccc2n1 ZINC000295946673 1127657808 /nfs/dbraw/zinc/65/78/08/1127657808.db2.gz LVZXHHUHSMDZEH-LNRIEFBSSA-N 1 3 295.430 3.511 20 0 CHADHO C(C1CCCC1)N1CCC([NH2+][C@@H]2CCC23CCC3)CC1 ZINC000669699242 1127674848 /nfs/dbraw/zinc/67/48/48/1127674848.db2.gz QGNPYELTHGNRHW-QGZVFWFLSA-N 1 3 276.468 3.563 20 0 CHADHO CC/C=C\CC[NH2+][C@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000467187791 1127957999 /nfs/dbraw/zinc/95/79/99/1127957999.db2.gz SJFIIVHANRBROK-MSNYOWOLSA-N 1 3 264.457 3.585 20 0 CHADHO CCc1ccc([C@H]([NH2+]C[C@H]2CCN(CC)C2)C(C)C)cc1 ZINC000540259194 1127971709 /nfs/dbraw/zinc/97/17/09/1127971709.db2.gz ONPUGBHIWUKNPA-IEBWSBKVSA-N 1 3 288.479 3.878 20 0 CHADHO Cc1ccccc1[C@@H]([NH2+]CC[C@@H]1CCCN1C)C(C)C ZINC000540360147 1127976738 /nfs/dbraw/zinc/97/67/38/1127976738.db2.gz PLTGFBXZLIFFGM-WMZOPIPTSA-N 1 3 274.452 3.766 20 0 CHADHO Cc1ccccc1[C@@H](NCC[C@@H]1CCC[N@@H+]1C)C(C)C ZINC000540360147 1127976740 /nfs/dbraw/zinc/97/67/40/1127976740.db2.gz PLTGFBXZLIFFGM-WMZOPIPTSA-N 1 3 274.452 3.766 20 0 CHADHO Cc1ccccc1[C@@H](NCC[C@@H]1CCC[N@H+]1C)C(C)C ZINC000540360147 1127976742 /nfs/dbraw/zinc/97/67/42/1127976742.db2.gz PLTGFBXZLIFFGM-WMZOPIPTSA-N 1 3 274.452 3.766 20 0 CHADHO CC[C@H]([NH2+]CC[C@@H]1CCCN1C)C(C)(C)c1ccccc1 ZINC000540526863 1127982569 /nfs/dbraw/zinc/98/25/69/1127982569.db2.gz YIASJNMVJGIUJH-ROUUACIJSA-N 1 3 288.479 3.817 20 0 CHADHO Cc1cccc(C)c1[C@H](C)[NH2+]CC[C@H]1CCCCN1C ZINC000545517628 1128018182 /nfs/dbraw/zinc/01/81/82/1128018182.db2.gz RBDGRXFCVKFZNH-DLBZAZTESA-N 1 3 274.452 3.828 20 0 CHADHO Cc1cccc(C)c1[C@H](C)NCC[C@H]1CCCC[N@@H+]1C ZINC000545517628 1128018186 /nfs/dbraw/zinc/01/81/86/1128018186.db2.gz RBDGRXFCVKFZNH-DLBZAZTESA-N 1 3 274.452 3.828 20 0 CHADHO Cc1cccc(C)c1[C@H](C)NCC[C@H]1CCCC[N@H+]1C ZINC000545517628 1128018191 /nfs/dbraw/zinc/01/81/91/1128018191.db2.gz RBDGRXFCVKFZNH-DLBZAZTESA-N 1 3 274.452 3.828 20 0 CHADHO CCC[NH+]1CCC(N[C@H](C)c2c(C)cccc2C)CC1 ZINC000545519714 1128018222 /nfs/dbraw/zinc/01/82/22/1128018222.db2.gz MCAPEGOBFMHIER-MRXNPFEDSA-N 1 3 274.452 3.828 20 0 CHADHO Cc1cccc(C)c1[C@H](C)[NH2+]CC[C@@H]1CCCCN1C ZINC000545517630 1128018379 /nfs/dbraw/zinc/01/83/79/1128018379.db2.gz RBDGRXFCVKFZNH-IRXDYDNUSA-N 1 3 274.452 3.828 20 0 CHADHO Cc1cccc(C)c1[C@H](C)NCC[C@@H]1CCCC[N@@H+]1C ZINC000545517630 1128018383 /nfs/dbraw/zinc/01/83/83/1128018383.db2.gz RBDGRXFCVKFZNH-IRXDYDNUSA-N 1 3 274.452 3.828 20 0 CHADHO Cc1cccc(C)c1[C@H](C)NCC[C@@H]1CCCC[N@H+]1C ZINC000545517630 1128018388 /nfs/dbraw/zinc/01/83/88/1128018388.db2.gz RBDGRXFCVKFZNH-IRXDYDNUSA-N 1 3 274.452 3.828 20 0 CHADHO COc1c(C)cccc1CN[C@@H](CCC[NH3+])c1ccccc1 ZINC000925702285 1128137967 /nfs/dbraw/zinc/13/79/67/1128137967.db2.gz MUKJRZKMPYFHSK-SFHVURJKSA-N 1 3 298.430 3.573 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1cc2ccccc2[nH]1 ZINC000926753298 1128192151 /nfs/dbraw/zinc/19/21/51/1128192151.db2.gz MYQPSRVJJCXGMF-GJZGRUSLSA-N 1 3 285.435 3.550 20 0 CHADHO CCCCCC[C@@H](C)[NH2+][C@H]1CC[C@H](N2CCOCC2)CC1 ZINC001257358172 1128266337 /nfs/dbraw/zinc/26/63/37/1128266337.db2.gz CRZUTPHDICQPOF-KZNAEPCWSA-N 1 3 296.499 3.578 20 0 CHADHO CC(C)=CCC[C@H](C)CN1CCCC[C@@]12CCC[NH2+]C2 ZINC001235174175 1128311629 /nfs/dbraw/zinc/31/16/29/1128311629.db2.gz SJCMMJHHGIEZIN-ROUUACIJSA-N 1 3 278.484 3.977 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@@H+]1CCCC[C@@]12CCCNC2 ZINC001235174175 1128311633 /nfs/dbraw/zinc/31/16/33/1128311633.db2.gz SJCMMJHHGIEZIN-ROUUACIJSA-N 1 3 278.484 3.977 20 0 CHADHO CC(C)=CCC[C@H](C)C[N@H+]1CCCC[C@@]12CCCNC2 ZINC001235174175 1128311637 /nfs/dbraw/zinc/31/16/37/1128311637.db2.gz SJCMMJHHGIEZIN-ROUUACIJSA-N 1 3 278.484 3.977 20 0 CHADHO CCCC[N@H+](CCC[C@@H](C)O)C1CC(C)(C)NC(C)(C)C1 ZINC000931034140 1128344996 /nfs/dbraw/zinc/34/49/96/1128344996.db2.gz OQZJVZUCRJLPFY-OAHLLOKOSA-N 1 3 298.515 3.559 20 0 CHADHO CCCC[N@@H+](CCC[C@@H](C)O)C1CC(C)(C)NC(C)(C)C1 ZINC000931034140 1128345000 /nfs/dbraw/zinc/34/50/00/1128345000.db2.gz OQZJVZUCRJLPFY-OAHLLOKOSA-N 1 3 298.515 3.559 20 0 CHADHO CCCC[C@H](CC)N1CCC([NH+](CC)CC)CC1 ZINC001257422172 1128353072 /nfs/dbraw/zinc/35/30/72/1128353072.db2.gz DUPZGYOHDZZTHC-HNNXBMFYSA-N 1 3 254.462 3.761 20 0 CHADHO C[C@H](Cc1cccc(Cl)c1)[NH2+][C@@H]1CCC[C@@H](N(C)C)C1 ZINC000715276143 1128360063 /nfs/dbraw/zinc/36/00/63/1128360063.db2.gz JNFCANDPLGOWJO-KBRIMQKVSA-N 1 3 294.870 3.733 20 0 CHADHO C[C@H](CC[N@@H+]1CCC[C@H](N(C)C)CC1)c1ccccc1 ZINC000562580088 1128411591 /nfs/dbraw/zinc/41/15/91/1128411591.db2.gz TWMMKOBAVNNLQG-AEFFLSMTSA-N 1 3 274.452 3.596 20 0 CHADHO C[C@H](CC[N@H+]1CCC[C@H](N(C)C)CC1)c1ccccc1 ZINC000562580088 1128411594 /nfs/dbraw/zinc/41/15/94/1128411594.db2.gz TWMMKOBAVNNLQG-AEFFLSMTSA-N 1 3 274.452 3.596 20 0 CHADHO C[C@H](CC(C)(C)c1ccccc1)[NH2+]CCCN1CCCC1 ZINC000037229471 1128424855 /nfs/dbraw/zinc/42/48/55/1128424855.db2.gz ZYJGDSNQEADIPI-QGZVFWFLSA-N 1 3 288.479 3.818 20 0 CHADHO CC[N@@H+]1CC[C@@H](CN[C@@H](C)c2ccc(C(C)C)cc2)C1 ZINC000037643706 1128434118 /nfs/dbraw/zinc/43/41/18/1128434118.db2.gz VKYOMCKVEQZLCI-HOTGVXAUSA-N 1 3 274.452 3.802 20 0 CHADHO CC[N@H+]1CC[C@@H](CN[C@@H](C)c2ccc(C(C)C)cc2)C1 ZINC000037643706 1128434122 /nfs/dbraw/zinc/43/41/22/1128434122.db2.gz VKYOMCKVEQZLCI-HOTGVXAUSA-N 1 3 274.452 3.802 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H](C)c2ccc(C(C)C)cc2)C1 ZINC000037643706 1128434126 /nfs/dbraw/zinc/43/41/26/1128434126.db2.gz VKYOMCKVEQZLCI-HOTGVXAUSA-N 1 3 274.452 3.802 20 0 CHADHO CC(C)c1ccc([C@H](C)NC[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000037649525 1128434968 /nfs/dbraw/zinc/43/49/68/1128434968.db2.gz PSYXUHPSSFFXPK-JKSUJKDBSA-N 1 3 286.463 3.945 20 0 CHADHO CC(C)c1ccc([C@H](C)NC[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000037649525 1128434970 /nfs/dbraw/zinc/43/49/70/1128434970.db2.gz PSYXUHPSSFFXPK-JKSUJKDBSA-N 1 3 286.463 3.945 20 0 CHADHO Cc1cccc(CC[C@H](C)[NH2+]C[C@H](C)CN2CCCC2)c1 ZINC000062079233 1128437349 /nfs/dbraw/zinc/43/73/49/1128437349.db2.gz RPRQWPCJSFATSY-ROUUACIJSA-N 1 3 288.479 3.638 20 0 CHADHO CCC1CCC([NH2+]C[C@@H](C)CN2CCCCC2)CC1 ZINC000037997614 1128438276 /nfs/dbraw/zinc/43/82/76/1128438276.db2.gz RSHAMUXFBFMUHH-KLAILNCOSA-N 1 3 266.473 3.667 20 0 CHADHO Cc1cccc2c1CC[C@H]2[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000125752900 1128452983 /nfs/dbraw/zinc/45/29/83/1128452983.db2.gz LDRFNBYFVLPZLI-VQIMIIECSA-N 1 3 286.463 3.692 20 0 CHADHO Cc1cc([C@@H](C)NCc2ccc(C[NH3+])cc2)c(C)s1 ZINC000564989195 1128517742 /nfs/dbraw/zinc/51/77/42/1128517742.db2.gz UATHIUYKFGFCAD-GFCCVEGCSA-N 1 3 274.433 3.674 20 0 CHADHO CCCCCC[C@H](C)[NH2+]C[C@@H]1CCN(C(C)C)C1 ZINC000040622460 1128525103 /nfs/dbraw/zinc/52/51/03/1128525103.db2.gz MOVFOPUFFDOOGI-HOTGVXAUSA-N 1 3 254.462 3.665 20 0 CHADHO COc1cc(C)ccc1[C@@H](C)NCc1ccc([C@@H](C)[NH3+])cc1 ZINC000565710359 1128531257 /nfs/dbraw/zinc/53/12/57/1128531257.db2.gz ITSLVMMYEHDXBT-HUUCEWRRSA-N 1 3 298.430 3.874 20 0 CHADHO Clc1ccc2c(c1)CC[C@H]2[NH2+]CCCN1CCCCC1 ZINC000129809990 1128556774 /nfs/dbraw/zinc/55/67/74/1128556774.db2.gz UWINCBQPPMUAOX-QGZVFWFLSA-N 1 3 292.854 3.793 20 0 CHADHO Cc1cc(C)cc([C@@H](C)NC[C@H](C)C[NH+]2CCCC2)c1 ZINC000130352893 1128581135 /nfs/dbraw/zinc/58/11/35/1128581135.db2.gz UECFWOAQKVBHDI-DLBZAZTESA-N 1 3 274.452 3.686 20 0 CHADHO C1CC12CCC[C@@H]2[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000568274570 1128581609 /nfs/dbraw/zinc/58/16/09/1128581609.db2.gz DBBITBCNFPKVCV-KRWDZBQOSA-N 1 3 276.468 3.706 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+][C@H](C)CCC2CCCC2)C1 ZINC000568564738 1128587605 /nfs/dbraw/zinc/58/76/05/1128587605.db2.gz ARDCUSGGMWZIKA-NVXWUHKLSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@@H](CC[NH2+]C1CCCCCC1)N1CCCCC1 ZINC000569272363 1128602796 /nfs/dbraw/zinc/60/27/96/1128602796.db2.gz KKYKHBAKSKFHOR-HNNXBMFYSA-N 1 3 252.446 3.563 20 0 CHADHO CC(C)c1cccc(CN[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@H]32)c1 ZINC000556889245 1128635852 /nfs/dbraw/zinc/63/58/52/1128635852.db2.gz AZCLFFAKYGIDNB-IPMKNSEASA-N 1 3 286.463 3.772 20 0 CHADHO CC(C)c1cccc(CN[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@H]32)c1 ZINC000556889245 1128635853 /nfs/dbraw/zinc/63/58/53/1128635853.db2.gz AZCLFFAKYGIDNB-IPMKNSEASA-N 1 3 286.463 3.772 20 0 CHADHO CC(C)c1cccc(CN[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@@H]32)c1 ZINC000556889244 1128636060 /nfs/dbraw/zinc/63/60/60/1128636060.db2.gz AZCLFFAKYGIDNB-GUDVDZBRSA-N 1 3 286.463 3.772 20 0 CHADHO CC(C)c1cccc(CN[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@@H]32)c1 ZINC000556889244 1128636063 /nfs/dbraw/zinc/63/60/63/1128636063.db2.gz AZCLFFAKYGIDNB-GUDVDZBRSA-N 1 3 286.463 3.772 20 0 CHADHO C[C@H](CSC(C)(C)C)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000159614191 1128713530 /nfs/dbraw/zinc/71/35/30/1128713530.db2.gz FCIDQSIXWGYXEU-GFCCVEGCSA-N 1 3 286.529 3.805 20 0 CHADHO c1ccc([C@@H]2CCCC[C@H]2[NH2+][C@H]2CCNC3(CCC3)C2)cc1 ZINC000643546567 1117793061 /nfs/dbraw/zinc/79/30/61/1117793061.db2.gz REJSAGALPUPEIA-GBESFXJTSA-N 1 3 298.474 3.977 20 0 CHADHO CC(C)Oc1cccc([C@@H](C)[NH2+]CCCN2CCCC2)c1 ZINC000179674035 1117909436 /nfs/dbraw/zinc/90/94/36/1117909436.db2.gz ILQHICUGMHMMBP-MRXNPFEDSA-N 1 3 290.451 3.610 20 0 CHADHO C[C@]1(C[NH2+]C2CCN(C3CCCCC3)CC2)C[C@H]2C[C@H]2C1 ZINC000623740707 1117909932 /nfs/dbraw/zinc/90/99/32/1117909932.db2.gz BOLYHACZBOJJLU-MNZLEMJZSA-N 1 3 290.495 3.809 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)N[C@@H](C)c1nc(C)cs1 ZINC000623849134 1117943546 /nfs/dbraw/zinc/94/35/46/1117943546.db2.gz WUMBXTKHOIIKID-JSGCOSHPSA-N 1 3 283.485 3.613 20 0 CHADHO CC1(CN2CCC([NH+]3CCCCC3)CC2)CCCCC1 ZINC001208897704 1117957482 /nfs/dbraw/zinc/95/74/82/1117957482.db2.gz GXSHYEYECGJXJX-UHFFFAOYSA-N 1 3 278.484 3.907 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+]C[C@H](C)CCc2ccccc2)C1 ZINC000579388888 1128747466 /nfs/dbraw/zinc/74/74/66/1128747466.db2.gz OKHFYVKVBAVWPV-MJGOQNOKSA-N 1 3 288.479 3.575 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)c1ccc2c(c1)CCC2 ZINC000624120021 1117983422 /nfs/dbraw/zinc/98/34/22/1117983422.db2.gz PRCUPTUWRHBRQT-HOTGVXAUSA-N 1 3 286.463 3.558 20 0 CHADHO C[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccc2c(c1)CCC2 ZINC000624120023 1117983627 /nfs/dbraw/zinc/98/36/27/1117983627.db2.gz PRCUPTUWRHBRQT-JKSUJKDBSA-N 1 3 286.463 3.558 20 0 CHADHO Cc1cccc([C@H](C)NC[C@@H]2CCCC[N@H+](C)C2)c1C ZINC000624120924 1117984491 /nfs/dbraw/zinc/98/44/91/1117984491.db2.gz KIGGADGZBYGEKK-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO Cc1cccc([C@H](C)NC[C@@H]2CCCC[N@@H+](C)C2)c1C ZINC000624120924 1117984492 /nfs/dbraw/zinc/98/44/92/1117984492.db2.gz KIGGADGZBYGEKK-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO Cc1cccc([C@H](C)[NH2+]C[C@@H]2CCCCN(C)C2)c1C ZINC000624120924 1117984495 /nfs/dbraw/zinc/98/44/95/1117984495.db2.gz KIGGADGZBYGEKK-IRXDYDNUSA-N 1 3 274.452 3.686 20 0 CHADHO C[C@H]([NH2+]C[C@@H]1CCCCN(C)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000624122970 1117984582 /nfs/dbraw/zinc/98/45/82/1117984582.db2.gz BZLRAUUJNHHDNX-CAMMJAKZSA-N 1 3 286.463 3.500 20 0 CHADHO C[C@@H]([NH2+]C[C@H]1CCCCN(C)C1)c1ccc(Cl)s1 ZINC000624120112 1117984867 /nfs/dbraw/zinc/98/48/67/1117984867.db2.gz RLJGOPDYQWZVFV-VXGBXAGGSA-N 1 3 286.872 3.784 20 0 CHADHO Cc1ccc([C@H]([NH2+]C[C@H]2CCCCN(C)C2)C2CC2)cc1 ZINC000624122148 1117984992 /nfs/dbraw/zinc/98/49/92/1117984992.db2.gz KWKJJEQSBZTPDF-APWZRJJASA-N 1 3 286.463 3.768 20 0 CHADHO Cc1ccc([C@H](NC[C@H]2CCCC[N@@H+](C)C2)C2CC2)cc1 ZINC000624122148 1117984994 /nfs/dbraw/zinc/98/49/94/1117984994.db2.gz KWKJJEQSBZTPDF-APWZRJJASA-N 1 3 286.463 3.768 20 0 CHADHO Cc1ccc([C@H](NC[C@H]2CCCC[N@H+](C)C2)C2CC2)cc1 ZINC000624122148 1117984997 /nfs/dbraw/zinc/98/49/97/1117984997.db2.gz KWKJJEQSBZTPDF-APWZRJJASA-N 1 3 286.463 3.768 20 0 CHADHO CC[C@H]([NH2+]C[C@H]1CCCCN(C)C1)c1cccc(C)c1 ZINC000624124003 1117985216 /nfs/dbraw/zinc/98/52/16/1117985216.db2.gz VLVUKYKWQUGAFS-AEFFLSMTSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@H](NC[C@H]1CCCC[N@H+](C)C1)c1cccc(C)c1 ZINC000624124003 1117985218 /nfs/dbraw/zinc/98/52/18/1117985218.db2.gz VLVUKYKWQUGAFS-AEFFLSMTSA-N 1 3 274.452 3.768 20 0 CHADHO CC[C@H](NC[C@H]1CCCC[N@@H+](C)C1)c1cccc(C)c1 ZINC000624124003 1117985221 /nfs/dbraw/zinc/98/52/21/1117985221.db2.gz VLVUKYKWQUGAFS-AEFFLSMTSA-N 1 3 274.452 3.768 20 0 CHADHO CN1CCCC[C@@H](C[NH2+][C@@H]2CCc3cc(Cl)ccc32)C1 ZINC000624120892 1117985502 /nfs/dbraw/zinc/98/55/02/1117985502.db2.gz JJOSSXXSVVUCJJ-SUMWQHHRSA-N 1 3 292.854 3.649 20 0 CHADHO Cc1ccccc1C1CC([NH2+]C[C@H]2CCCCN(C)C2)C1 ZINC000624122106 1117985979 /nfs/dbraw/zinc/98/59/79/1117985979.db2.gz JWVRSUWZDDOULM-WWDZGPRUSA-N 1 3 286.463 3.563 20 0 CHADHO CC(C)[C@@H](C[NH2+]C[C@@H]1CCN(C(C)C)C1)c1ccccc1 ZINC000232713697 1117988354 /nfs/dbraw/zinc/98/83/54/1117988354.db2.gz ULQLUEHZVOXXFG-PKOBYXMFSA-N 1 3 288.479 3.746 20 0 CHADHO CC(C)[C@@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccc(F)c(F)c1 ZINC000182073317 1118012900 /nfs/dbraw/zinc/01/29/00/1118012900.db2.gz QUJXBOKCFNIFSO-SUMWQHHRSA-N 1 3 296.405 3.593 20 0 CHADHO CC(C)[C@@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccc(F)c(F)c1 ZINC000182073317 1118012902 /nfs/dbraw/zinc/01/29/02/1118012902.db2.gz QUJXBOKCFNIFSO-SUMWQHHRSA-N 1 3 296.405 3.593 20 0 CHADHO CC[C@H](NC[C@H]1CC[N@H+](CC)C1)c1ccc(Cl)cc1 ZINC000037644081 1118033261 /nfs/dbraw/zinc/03/32/61/1118033261.db2.gz QMZLUPMQQXYCKX-CJNGLKHVSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@H](NC[C@H]1CC[N@@H+](CC)C1)c1ccc(Cl)cc1 ZINC000037644081 1118033266 /nfs/dbraw/zinc/03/32/66/1118033266.db2.gz QMZLUPMQQXYCKX-CJNGLKHVSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@H]([NH2+]C[C@H]1CCN(CC)C1)c1ccc(Cl)cc1 ZINC000037644081 1118033272 /nfs/dbraw/zinc/03/32/72/1118033272.db2.gz QMZLUPMQQXYCKX-CJNGLKHVSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@@H](NC[C@H]1CC[N@@H+](CC)C1)c1ccc(Cl)cc1 ZINC000037644082 1118033459 /nfs/dbraw/zinc/03/34/59/1118033459.db2.gz QMZLUPMQQXYCKX-CZUORRHYSA-N 1 3 280.843 3.723 20 0 CHADHO CC[C@@H](NC[C@H]1CC[N@H+](CC)C1)c1ccc(Cl)cc1 ZINC000037644082 1118033455 /nfs/dbraw/zinc/03/34/55/1118033455.db2.gz QMZLUPMQQXYCKX-CZUORRHYSA-N 1 3 280.843 3.723 20 0 CHADHO C[C@@H](c1cccs1)N(C)Cc1ccc2c(c1)C[NH2+]CC2 ZINC000211953421 1118056273 /nfs/dbraw/zinc/05/62/73/1118056273.db2.gz AUMCMHZCAPJKJL-ZDUSSCGKSA-N 1 3 286.444 3.587 20 0 CHADHO CCC[C@H]([NH2+]CCCN1CCC(C)CC1)c1cccnc1 ZINC000184898299 1118058702 /nfs/dbraw/zinc/05/87/02/1118058702.db2.gz ZZJFJBYBFLHXQX-SFHVURJKSA-N 1 3 289.467 3.634 20 0 CHADHO C[C@@H]([NH2+]CCC1CCCC1)[C@H]1CCCN(C2CCC2)C1 ZINC000185725446 1118063651 /nfs/dbraw/zinc/06/36/51/1118063651.db2.gz UISUSVYPZZDNMI-WBVHZDCISA-N 1 3 278.484 3.809 20 0 CHADHO Cc1cc2c(c(C)c1)[C@H](NC1C[C@H]3CC[C@@H](C1)[N@H+]3C)CC2 ZINC000655773046 1118206944 /nfs/dbraw/zinc/20/69/44/1118206944.db2.gz WQLGAQRVBQAROR-HQSKLWIPSA-N 1 3 284.447 3.506 20 0 CHADHO Cc1cc2c(c(C)c1)[C@H](NC1C[C@H]3CC[C@@H](C1)[N@@H+]3C)CC2 ZINC000655773046 1118206948 /nfs/dbraw/zinc/20/69/48/1118206948.db2.gz WQLGAQRVBQAROR-HQSKLWIPSA-N 1 3 284.447 3.506 20 0 CHADHO CC(C)c1ccc(CN(C)[C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000123577437 1118339300 /nfs/dbraw/zinc/33/93/00/1118339300.db2.gz DBFCCOLSOIVMCP-CRAIPNDOSA-N 1 3 274.452 3.725 20 0 CHADHO CC(C)c1ccc(CN(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000123577437 1118339305 /nfs/dbraw/zinc/33/93/05/1118339305.db2.gz DBFCCOLSOIVMCP-CRAIPNDOSA-N 1 3 274.452 3.725 20 0 CHADHO CCOc1cccc([C@@H](C)[NH2+]CC[C@@H]2CCCCN2C)c1 ZINC000539279163 1118351052 /nfs/dbraw/zinc/35/10/52/1118351052.db2.gz ABQLUKARYNSKLD-WBVHZDCISA-N 1 3 290.451 3.610 20 0 CHADHO CN1CCCC[C@H]1CC[N@H+](C)Cc1ccc2cnccc2c1 ZINC000683831434 1118397857 /nfs/dbraw/zinc/39/78/57/1118397857.db2.gz XOGXBKHZSILDBV-IBGZPJMESA-N 1 3 297.446 3.541 20 0 CHADHO CN1CCCC[C@H]1CC[N@@H+](C)Cc1ccc2cnccc2c1 ZINC000683831434 1118397862 /nfs/dbraw/zinc/39/78/62/1118397862.db2.gz XOGXBKHZSILDBV-IBGZPJMESA-N 1 3 297.446 3.541 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+]C1CCC(c2ccccc2)CC1 ZINC000089141233 1118528744 /nfs/dbraw/zinc/52/87/44/1118528744.db2.gz RKDZTDLYCRFSIM-JEVOJNTISA-N 1 3 286.463 3.820 20 0 CHADHO CC[C@@H]([NH2+]CC[C@@H]1CCCN1C)c1cccc(Cl)c1 ZINC000341106601 1118602999 /nfs/dbraw/zinc/60/29/99/1118602999.db2.gz QUUPOAOXWFRTAI-JKSUJKDBSA-N 1 3 280.843 3.865 20 0 CHADHO C[NH+](C)CCCN[C@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000341460241 1118712471 /nfs/dbraw/zinc/71/24/71/1118712471.db2.gz RQOLECNYNCYWKH-MRXNPFEDSA-N 1 3 280.431 3.844 20 0 CHADHO CCSc1cccc(C[NH2+]C[C@@H]2CCCN(CC)C2)c1 ZINC000349564328 1118755172 /nfs/dbraw/zinc/75/51/72/1118755172.db2.gz KGKIDOXTFBSPLN-INIZCTEOSA-N 1 3 292.492 3.620 20 0 CHADHO CC[NH2+]CC1CCN([C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000131507091 1118760153 /nfs/dbraw/zinc/76/01/53/1118760153.db2.gz UGCQDPHCFXAMFJ-ZDUSSCGKSA-N 1 3 280.843 3.723 20 0 CHADHO C1CC([C@@H]2CC[C@@H]2[NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000510721260 1118796434 /nfs/dbraw/zinc/79/64/34/1118796434.db2.gz MMFRSVZVDMDRSH-OALUTQOASA-N 1 3 290.495 3.952 20 0 CHADHO CCC(CC)[C@H](N[C@@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000133704928 1118865808 /nfs/dbraw/zinc/86/58/08/1118865808.db2.gz NSPJCVZSNNSSDM-MSOLQXFVSA-N 1 3 274.452 3.896 20 0 CHADHO CC[NH+](CC)C[C@H]1CCN(CCCc2cccc(C)c2)C1 ZINC000181125413 1118903345 /nfs/dbraw/zinc/90/33/45/1118903345.db2.gz MJUINZGMAFLJJK-LJQANCHMSA-N 1 3 288.479 3.591 20 0 CHADHO C[C@@H](CC[NH+](C)C)N[C@H]1CCC(C)(C)c2ccccc21 ZINC000049553768 1119104369 /nfs/dbraw/zinc/10/43/69/1119104369.db2.gz FMTBZCRTEUWGHB-YOEHRIQHSA-N 1 3 274.452 3.729 20 0 CHADHO CC[C@@H]([NH2+]C[C@H](C)CN1CCCCC1)c1ccsc1 ZINC000394347271 1119238057 /nfs/dbraw/zinc/23/80/57/1119238057.db2.gz DELPQEGWIJQSBN-GOEBONIOSA-N 1 3 280.481 3.911 20 0 CHADHO CCN1CC[C@@H](C[NH2+][C@@H]2CCCc3c(C)ccc(C)c32)C1 ZINC000349812021 1119272720 /nfs/dbraw/zinc/27/27/20/1119272720.db2.gz JQHWPLAYBROSOM-FUHWJXTLSA-N 1 3 286.463 3.612 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+]C2CCC(C(F)(F)F)CC2)C1 ZINC000123410152 1119295528 /nfs/dbraw/zinc/29/55/28/1119295528.db2.gz ULPADWBJMTYVAC-CLRIEMFWSA-N 1 3 292.389 3.570 20 0 CHADHO CC1CCN(CCC[NH2+]C[C@@H]2C[C@@H]2c2ccccc2)CC1 ZINC000343085051 1119304639 /nfs/dbraw/zinc/30/46/39/1119304639.db2.gz AIIJYEKFZHHCBG-RBUKOAKNSA-N 1 3 286.463 3.502 20 0 CHADHO Clc1ccc2c(c1)[C@@H](NC1CC[NH+](C3CC3)CC1)CC2 ZINC000343112355 1119315079 /nfs/dbraw/zinc/31/50/79/1119315079.db2.gz XWMHPVNOVXCODL-KRWDZBQOSA-N 1 3 290.838 3.544 20 0 CHADHO CCOc1ccc([C@@H](C)N[C@@H]2CC[NH2+]CC(C)(C)C2)cc1 ZINC000635012304 1119368692 /nfs/dbraw/zinc/36/86/92/1119368692.db2.gz SILSOCFGGHJCQF-GDBMZVCRSA-N 1 3 290.451 3.514 20 0 CHADHO CCCN1CC[C@H](C[NH2+]C2CCC3(CCCC3)CC2)C1 ZINC000564415456 1119373410 /nfs/dbraw/zinc/37/34/10/1119373410.db2.gz PXXXAEIBSFITOR-MRXNPFEDSA-N 1 3 278.484 3.811 20 0 CHADHO CCC[C@H](C)[C@@H](CC)[NH2+]C[C@@H]1CCN(CCC)C1 ZINC000151123947 1119404649 /nfs/dbraw/zinc/40/46/49/1119404649.db2.gz PVDFKXUILUNPKZ-HRCADAONSA-N 1 3 254.462 3.523 20 0 CHADHO CCCN1CCC([NH2+]Cc2ccc3nc(C)ccc3c2)CC1 ZINC000317973872 1119446765 /nfs/dbraw/zinc/44/67/65/1119446765.db2.gz HBVKEBAMISWIPY-UHFFFAOYSA-N 1 3 297.446 3.507 20 0 CHADHO CCC[N@H+](C)C[C@H]1CCN([C@@H](C)c2ccccc2C)C1 ZINC000151337135 1119451634 /nfs/dbraw/zinc/45/16/34/1119451634.db2.gz LPDIDHCWKPFNJB-DLBZAZTESA-N 1 3 274.452 3.720 20 0 CHADHO CCC[N@@H+](C)C[C@H]1CCN([C@@H](C)c2ccccc2C)C1 ZINC000151337135 1119451635 /nfs/dbraw/zinc/45/16/35/1119451635.db2.gz LPDIDHCWKPFNJB-DLBZAZTESA-N 1 3 274.452 3.720 20 0 CHADHO c1ccc(C[N@@H+]2CCC23CCC3)c(CN2CCC23CCC3)c1 ZINC000343713197 1119492858 /nfs/dbraw/zinc/49/28/58/1119492858.db2.gz OWGDKKMSRNPXKM-UHFFFAOYSA-N 1 3 296.458 3.943 20 0 CHADHO c1ccc(C[N@H+]2CCC23CCC3)c(CN2CCC23CCC3)c1 ZINC000343713197 1119492860 /nfs/dbraw/zinc/49/28/60/1119492860.db2.gz OWGDKKMSRNPXKM-UHFFFAOYSA-N 1 3 296.458 3.943 20 0 CHADHO CC1CCC([NH2+]C2CCN(C3CCCC3)CC2)CC1 ZINC000089555265 1119542332 /nfs/dbraw/zinc/54/23/32/1119542332.db2.gz DATFGIHCWGAASN-UHFFFAOYSA-N 1 3 264.457 3.562 20 0 CHADHO c1ccc([C@@H]2C[C@@H]2CN2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000093563893 1119571529 /nfs/dbraw/zinc/57/15/29/1119571529.db2.gz VZXIKUFMBLGGRH-AABGKKOBSA-N 1 3 298.474 3.740 20 0 CHADHO C[C@@H](NC[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)c1ccccc1 ZINC000647343626 1119597715 /nfs/dbraw/zinc/59/77/15/1119597715.db2.gz YCAAOFWMTYAZLA-AHRSYUTCSA-N 1 3 294.442 3.683 20 0 CHADHO C[C@@H](NC[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1ccccc1 ZINC000647343626 1119597718 /nfs/dbraw/zinc/59/77/18/1119597718.db2.gz YCAAOFWMTYAZLA-AHRSYUTCSA-N 1 3 294.442 3.683 20 0 CHADHO C[C@@H](CC[NH2+]C[C@@H]1CCCCN(C)C1)c1ccccc1 ZINC000628425641 1128859198 /nfs/dbraw/zinc/85/91/98/1128859198.db2.gz QUNOLUZZODMMGD-IRXDYDNUSA-N 1 3 274.452 3.502 20 0 CHADHO CC[C@H]([NH2+]C1CCN([C@H]2CCC[C@@H](C)C2)CC1)C1CC1 ZINC000658236080 1119712176 /nfs/dbraw/zinc/71/21/76/1119712176.db2.gz SXXVEJKXUGQVIB-JLSDUUJJSA-N 1 3 278.484 3.808 20 0 CHADHO CC1=C[C@H](C)C[C@@H](CN2CCC[C@@H]([NH+]3CCCC3)C2)C1 ZINC000685834262 1119853629 /nfs/dbraw/zinc/85/36/29/1119853629.db2.gz BLLABQWKIFXTGD-CGTJXYLNSA-N 1 3 276.468 3.539 20 0 CHADHO CC(C)C[C@@H](CN1CCC(C)([NH3+])CC1)c1ccccc1 ZINC000647530992 1119995588 /nfs/dbraw/zinc/99/55/88/1119995588.db2.gz UMQKYFMDMBEAJE-KRWDZBQOSA-N 1 3 274.452 3.630 20 0 CHADHO C[C@@H](Cc1cccc(F)c1)[NH2+]CCCN1CCCC[C@H]1C ZINC000252711289 1128896335 /nfs/dbraw/zinc/89/63/35/1128896335.db2.gz JDTUUQPCXMYRMN-JKSUJKDBSA-N 1 3 292.442 3.611 20 0 CHADHO CCC(CC)(CC)C[N@@H+]1CC[C@H](CN2CCCC2)C1 ZINC000542949319 1120276390 /nfs/dbraw/zinc/27/63/90/1120276390.db2.gz WPQVFNSXXXZTRA-MRXNPFEDSA-N 1 3 266.473 3.621 20 0 CHADHO CCC(CC)(CC)C[N@H+]1CC[C@H](CN2CCCC2)C1 ZINC000542949319 1120276392 /nfs/dbraw/zinc/27/63/92/1120276392.db2.gz WPQVFNSXXXZTRA-MRXNPFEDSA-N 1 3 266.473 3.621 20 0 CHADHO CC(C)N1CC[C@@H](C[NH2+][C@@H]2CCCC23CCCCC3)C1 ZINC000313042171 1120382176 /nfs/dbraw/zinc/38/21/76/1120382176.db2.gz QNCIMRXVMPZCBT-DLBZAZTESA-N 1 3 278.484 3.809 20 0 CHADHO CCC[C@@H]([NH2+]C[C@@H]1CCN(C(C)C)C1)C1CCCC1 ZINC000313413511 1120396459 /nfs/dbraw/zinc/39/64/59/1120396459.db2.gz QQHKJHNNJSATNL-DOTOQJQBSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)(CN[C@@H]1CCC[C@H]1[NH3+])c1ccc2ccccc2c1 ZINC000629550492 1128914665 /nfs/dbraw/zinc/91/46/65/1128914665.db2.gz NENFSMARQJLPFK-QZTJIDSGSA-N 1 3 282.431 3.587 20 0 CHADHO C[C@@H]([NH2+][C@H]1CC[C@@H](C)NC1)c1cc2ccccc2s1 ZINC000629542686 1128914730 /nfs/dbraw/zinc/91/47/30/1128914730.db2.gz JIERFVVBLBKVHZ-BZPMIXESSA-N 1 3 274.433 3.692 20 0 CHADHO [NH3+][C@H]1CCC[C@@H](N[C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000629550436 1128914741 /nfs/dbraw/zinc/91/47/41/1128914741.db2.gz YKNNWWRISCUIDQ-LZWOXQAQSA-N 1 3 278.827 3.577 20 0 CHADHO C[C@H](C[NH2+][C@H](C)[C@@H]1C[C@H]1c1cccs1)CN1CCCC1 ZINC000417309406 1120424821 /nfs/dbraw/zinc/42/48/21/1120424821.db2.gz GGOINQBWZWNPAX-LVQVYYBASA-N 1 3 292.492 3.562 20 0 CHADHO CC(C)N(C)CCC[NH2+][C@H](C)[C@@H]1C[C@H]1c1cccs1 ZINC000417331949 1120428681 /nfs/dbraw/zinc/42/86/81/1120428681.db2.gz WRMYNXQRKAJJHA-QLFBSQMISA-N 1 3 280.481 3.560 20 0 CHADHO CN(C)CC(C)(C)C[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC000019905677 1120490338 /nfs/dbraw/zinc/49/03/38/1120490338.db2.gz JYRCWGAXXPQGOE-UHFFFAOYSA-N 1 3 289.250 3.671 20 0 CHADHO CCC[C@H](C)N1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000500073865 1120503718 /nfs/dbraw/zinc/50/37/18/1120503718.db2.gz JBGPKGFWQSQUMT-BBWFWOEESA-N 1 3 266.473 3.761 20 0 CHADHO CCC[C@H](C)N1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000500073865 1120503722 /nfs/dbraw/zinc/50/37/22/1120503722.db2.gz JBGPKGFWQSQUMT-BBWFWOEESA-N 1 3 266.473 3.761 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]CCCN2CCCC[C@H]2C)cc1 ZINC000019913019 1120548605 /nfs/dbraw/zinc/54/86/05/1120548605.db2.gz JHXWZMUYSKAAJG-SJORKVTESA-N 1 3 274.452 3.910 20 0 CHADHO C[C@H](c1cccc(Cl)c1)[N@H+](C)CCCN1CCCC1 ZINC000499910640 1120549833 /nfs/dbraw/zinc/54/98/33/1120549833.db2.gz WQBGSPXGATWHLG-CQSZACIVSA-N 1 3 280.843 3.819 20 0 CHADHO C[C@H](c1cccc(Cl)c1)[N@@H+](C)CCCN1CCCC1 ZINC000499910640 1120549837 /nfs/dbraw/zinc/54/98/37/1120549837.db2.gz WQBGSPXGATWHLG-CQSZACIVSA-N 1 3 280.843 3.819 20 0 CHADHO CC1([NH+]2CCC2)CCC(NCc2ccsc2Cl)CC1 ZINC000922845142 1120613037 /nfs/dbraw/zinc/61/30/37/1120613037.db2.gz MFXMBXKRYUTIFY-UHFFFAOYSA-N 1 3 298.883 3.898 20 0 CHADHO CC(C)c1ccc([C@@H](C)N2CC[C@@]3(CC[N@H+](C)C3)C2)cc1 ZINC000429017188 1120617767 /nfs/dbraw/zinc/61/77/67/1120617767.db2.gz DUAZEDRIBQACLK-VQIMIIECSA-N 1 3 286.463 3.899 20 0 CHADHO CC(C)c1ccc([C@@H](C)N2CC[C@@]3(CC[N@@H+](C)C3)C2)cc1 ZINC000429017188 1120617770 /nfs/dbraw/zinc/61/77/70/1120617770.db2.gz DUAZEDRIBQACLK-VQIMIIECSA-N 1 3 286.463 3.899 20 0 CHADHO CC[C@H](CN[C@@H](c1ccccc1)[C@@H](C)[NH3+])CC(F)(F)F ZINC000925697425 1120622272 /nfs/dbraw/zinc/62/22/72/1120622272.db2.gz NLOWJSCFNRWVCD-MBNYWOFBSA-N 1 3 288.357 3.643 20 0 CHADHO C[C@@H](CCN1C[C@@H]2CCCC[C@@H]21)[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660933784 1120705211 /nfs/dbraw/zinc/70/52/11/1120705211.db2.gz YIJZXIPBZJHRDV-ATIWLJMLSA-N 1 3 276.468 3.514 20 0 CHADHO C[C@@H](CCN1C[C@@H]2CCCC[C@@H]21)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660933784 1120705215 /nfs/dbraw/zinc/70/52/15/1120705215.db2.gz YIJZXIPBZJHRDV-ATIWLJMLSA-N 1 3 276.468 3.514 20 0 CHADHO C[C@@H](CC[N@@H+]1C[C@@H]2CCCC[C@@H]21)N1C[C@@H]2CCCC[C@@H]21 ZINC000660933784 1120705219 /nfs/dbraw/zinc/70/52/19/1120705219.db2.gz YIJZXIPBZJHRDV-ATIWLJMLSA-N 1 3 276.468 3.514 20 0 CHADHO C[C@@H](CC[N@H+]1C[C@@H]2CCCC[C@@H]21)N1C[C@@H]2CCCC[C@@H]21 ZINC000660933784 1120705225 /nfs/dbraw/zinc/70/52/25/1120705225.db2.gz YIJZXIPBZJHRDV-ATIWLJMLSA-N 1 3 276.468 3.514 20 0 CHADHO CN(CCCC1CC[NH2+]CC1)Cc1ccccc1Cl ZINC000050953069 1120882124 /nfs/dbraw/zinc/88/21/24/1120882124.db2.gz IHAHGUSJYZNMAW-UHFFFAOYSA-N 1 3 280.843 3.552 20 0 CHADHO CC[C@@H]1C[N@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)CC[C@@H]1N ZINC000662273712 1120916692 /nfs/dbraw/zinc/91/66/92/1120916692.db2.gz YUSKYOVZMAFJFS-RWQQGDIJSA-N 1 3 286.463 3.630 20 0 CHADHO CC[C@@H]1C[N@@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)CC[C@@H]1N ZINC000662273712 1120916695 /nfs/dbraw/zinc/91/66/95/1120916695.db2.gz YUSKYOVZMAFJFS-RWQQGDIJSA-N 1 3 286.463 3.630 20 0 CHADHO C([NH2+][C@H](C1CC1)C1CCCC1)[C@@H]1CCCN(CC2CC2)C1 ZINC000663464997 1120979894 /nfs/dbraw/zinc/97/98/94/1120979894.db2.gz HWILUSWABPLYKU-LPHOPBHVSA-N 1 3 290.495 3.667 20 0 CHADHO c1ccc([C@@H](NC[C@H]2CCC[N@H+](CC3CC3)C2)C2CC2)cc1 ZINC000663467686 1120983955 /nfs/dbraw/zinc/98/39/55/1120983955.db2.gz HCMWFCXJRLIGPC-YLJYHZDGSA-N 1 3 298.474 3.849 20 0 CHADHO c1ccc([C@@H](NC[C@H]2CCC[N@@H+](CC3CC3)C2)C2CC2)cc1 ZINC000663467686 1120983959 /nfs/dbraw/zinc/98/39/59/1120983959.db2.gz HCMWFCXJRLIGPC-YLJYHZDGSA-N 1 3 298.474 3.849 20 0 CHADHO c1ccc([C@@H]([NH2+]C[C@H]2CCCN(CC3CC3)C2)C2CC2)cc1 ZINC000663467686 1120983962 /nfs/dbraw/zinc/98/39/62/1120983962.db2.gz HCMWFCXJRLIGPC-YLJYHZDGSA-N 1 3 298.474 3.849 20 0 CHADHO CC(C)[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC000663469597 1120984859 /nfs/dbraw/zinc/98/48/59/1120984859.db2.gz QWWQMVKWKKGAAA-OKZBNKHCSA-N 1 3 278.484 3.523 20 0 CHADHO c1ccc(C2CC2)c(C[NH2+]CCCN2CCCCC2)c1 ZINC000094357608 1120998760 /nfs/dbraw/zinc/99/87/60/1120998760.db2.gz KTUJSSXZAZUXLD-UHFFFAOYSA-N 1 3 272.436 3.530 20 0 CHADHO Cc1ccc([C@H](N[C@H]2CCC[NH2+]CC2)C2CCC2)cc1 ZINC000643523166 1121005496 /nfs/dbraw/zinc/00/54/96/1121005496.db2.gz XAMOLLPCJPBSPJ-ZWKOTPCHSA-N 1 3 272.436 3.568 20 0 CHADHO C[C@@H](Cc1coc2ccccc12)[NH2+][C@H]1CCNC2(CCC2)C1 ZINC000643548129 1121011633 /nfs/dbraw/zinc/01/16/33/1121011633.db2.gz MVDOYRHRNPNIOH-HOCLYGCPSA-N 1 3 298.430 3.628 20 0 CHADHO C[C@@H](Cc1coc2ccccc12)N[C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643548129 1121011638 /nfs/dbraw/zinc/01/16/38/1121011638.db2.gz MVDOYRHRNPNIOH-HOCLYGCPSA-N 1 3 298.430 3.628 20 0 CHADHO CC(C)[C@H](N[C@H]1CC[NH2+]C2(CCC2)C1)c1ccccc1 ZINC000643547897 1121012043 /nfs/dbraw/zinc/01/20/43/1121012043.db2.gz KMQPJIMZYXRAIR-IRXDYDNUSA-N 1 3 272.436 3.648 20 0 CHADHO CC(C)[C@H]([NH2+][C@H]1CCNC2(CCC2)C1)c1ccccc1 ZINC000643547897 1121012046 /nfs/dbraw/zinc/01/20/46/1121012046.db2.gz KMQPJIMZYXRAIR-IRXDYDNUSA-N 1 3 272.436 3.648 20 0 CHADHO Cc1ccccc1[C@H](C)[NH2+]CCCN1CCC(C)CC1 ZINC000021788412 1121213815 /nfs/dbraw/zinc/21/38/15/1121213815.db2.gz LXOCXPRFHQVBGU-KRWDZBQOSA-N 1 3 274.452 3.768 20 0 CHADHO Cc1ccccc1[C@@H](C)[NH2+]CCCN1CCC(C)CC1 ZINC000021788416 1121214437 /nfs/dbraw/zinc/21/44/37/1121214437.db2.gz LXOCXPRFHQVBGU-QGZVFWFLSA-N 1 3 274.452 3.768 20 0 CHADHO CC(C)C[C@H](C)[NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000512334058 1121270792 /nfs/dbraw/zinc/27/07/92/1121270792.db2.gz ZFEWIPSLUFAGKA-HRCADAONSA-N 1 3 266.473 3.664 20 0 CHADHO CC(C)[NH+]1CCC(N[C@H]2C[C@@H](C)c3ccccc32)CC1 ZINC000274223538 1121273881 /nfs/dbraw/zinc/27/38/81/1121273881.db2.gz OMQOOVNFFLAHNH-KDOFPFPSSA-N 1 3 272.436 3.697 20 0 CHADHO CC[C@@H](c1ccccc1)N1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000246241543 1121286957 /nfs/dbraw/zinc/28/69/57/1121286957.db2.gz UWNPGIRYSBHHRT-WMZOPIPTSA-N 1 3 272.436 3.555 20 0 CHADHO CC[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](CN2CCCC2)C1 ZINC000246241543 1121286964 /nfs/dbraw/zinc/28/69/64/1121286964.db2.gz UWNPGIRYSBHHRT-WMZOPIPTSA-N 1 3 272.436 3.555 20 0 CHADHO CC[C@@H](c1ccccc1)[N@H+]1CC[C@@H](CN2CCCC2)C1 ZINC000246241543 1121286970 /nfs/dbraw/zinc/28/69/70/1121286970.db2.gz UWNPGIRYSBHHRT-WMZOPIPTSA-N 1 3 272.436 3.555 20 0 CHADHO Cc1cccc2c1CCC[C@@H]2NC1CC[NH+](C(C)C)CC1 ZINC000658336312 1121313210 /nfs/dbraw/zinc/31/32/10/1121313210.db2.gz ACNQSPORIQSUIN-IBGZPJMESA-N 1 3 286.463 3.835 20 0 CHADHO CC(C)CC(CC(C)C)[N@@H+]1CC[C@]2(C1)CCCNC2 ZINC000709852382 1121375957 /nfs/dbraw/zinc/37/59/57/1121375957.db2.gz VWXPLNPWTNDXOX-QGZVFWFLSA-N 1 3 266.473 3.523 20 0 CHADHO CC(C)CC(CC(C)C)[N@H+]1CC[C@]2(C1)CCCNC2 ZINC000709852382 1121375966 /nfs/dbraw/zinc/37/59/66/1121375966.db2.gz VWXPLNPWTNDXOX-QGZVFWFLSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@@H](C[NH2+]C1CCN(C2CCCC2)CC1)C(C)(C)C ZINC000675884373 1121381253 /nfs/dbraw/zinc/38/12/53/1121381253.db2.gz UZDIZVOZMBRZCG-AWEZNQCLSA-N 1 3 266.473 3.665 20 0 CHADHO CC(C)CCC[N@@H+]1CCC[C@H](N2[C@H](C)CC[C@@H]2C)C1 ZINC000429324988 1121527823 /nfs/dbraw/zinc/52/78/23/1121527823.db2.gz GXMVEPCUCUXZSU-BBWFWOEESA-N 1 3 266.473 3.760 20 0 CHADHO CC(C)CCC[N@H+]1CCC[C@H](N2[C@H](C)CC[C@@H]2C)C1 ZINC000429324988 1121527828 /nfs/dbraw/zinc/52/78/28/1121527828.db2.gz GXMVEPCUCUXZSU-BBWFWOEESA-N 1 3 266.473 3.760 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CCC[C@@](C)(N)C1 ZINC001204939040 1121757804 /nfs/dbraw/zinc/75/78/04/1121757804.db2.gz PENPFZSAISFXLM-JKSUJKDBSA-N 1 3 252.446 3.572 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CCC[C@@](C)(N)C1 ZINC001204939040 1121757809 /nfs/dbraw/zinc/75/78/09/1121757809.db2.gz PENPFZSAISFXLM-JKSUJKDBSA-N 1 3 252.446 3.572 20 0 CHADHO CC[N@H+](CCC1CCN(C/C=C/Cl)CC1)CC(C)C ZINC000773733391 1121773718 /nfs/dbraw/zinc/77/37/18/1121773718.db2.gz ZNQXIXGMKQROIF-WEVVVXLNSA-N 1 3 286.891 3.819 20 0 CHADHO CC[N@@H+](CCC1CCN(C/C=C/Cl)CC1)CC(C)C ZINC000773733391 1121773727 /nfs/dbraw/zinc/77/37/27/1121773727.db2.gz ZNQXIXGMKQROIF-WEVVVXLNSA-N 1 3 286.891 3.819 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](C[C@@H]2CCCC(C)(C)C2)C1 ZINC001180058437 1121944587 /nfs/dbraw/zinc/94/45/87/1121944587.db2.gz RACNMFAEOHRJDP-SJORKVTESA-N 1 3 280.500 3.867 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](C[C@@H]2CCCC(C)(C)C2)C1 ZINC001180058437 1121944594 /nfs/dbraw/zinc/94/45/94/1121944594.db2.gz RACNMFAEOHRJDP-SJORKVTESA-N 1 3 280.500 3.867 20 0 CHADHO CSc1ccccc1[C@@H](C)[NH2+]CC[C@@H]1CCCCN1C ZINC000501502520 1121984614 /nfs/dbraw/zinc/98/46/14/1121984614.db2.gz JJTSHHVANFVMOA-CABCVRRESA-N 1 3 292.492 3.934 20 0 CHADHO CN1CCCC[C@H]1CC[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420946053 1122048136 /nfs/dbraw/zinc/04/81/36/1122048136.db2.gz LMQIXPMOMHTETJ-KGLIPLIRSA-N 1 3 292.389 3.525 20 0 CHADHO CN1CCCC[C@H]1CC[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420946053 1122048140 /nfs/dbraw/zinc/04/81/40/1122048140.db2.gz LMQIXPMOMHTETJ-KGLIPLIRSA-N 1 3 292.389 3.525 20 0 CHADHO CC[C@H](Cc1ccccc1)[NH2+]CC(C)(C)CN1CCCC1 ZINC001181428305 1122053872 /nfs/dbraw/zinc/05/38/72/1122053872.db2.gz UXIMJYRASGMEKD-GOSISDBHSA-N 1 3 288.479 3.719 20 0 CHADHO CCSCCCNC1CC[NH+]([C@H]2CCCC[C@H]2C)CC1 ZINC000502346947 1122076736 /nfs/dbraw/zinc/07/67/36/1122076736.db2.gz RMZAHFCVERGYFX-WBVHZDCISA-N 1 3 298.540 3.762 20 0 CHADHO CC1=CCC[C@H](C)[C@@H]1C[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC001203263053 1122078936 /nfs/dbraw/zinc/07/89/36/1122078936.db2.gz FIIKEEAWIXTPLZ-YTQUADARSA-N 1 3 290.495 3.690 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1C[NH2+]C[C@@H]1CCCN(CC2CC2)C1 ZINC001203263052 1122079273 /nfs/dbraw/zinc/07/92/73/1122079273.db2.gz FIIKEEAWIXTPLZ-WDSOQIARSA-N 1 3 290.495 3.690 20 0 CHADHO CC(C)[C@H](NCC[C@@H]1CCC[N@@H+]1C)c1ccc(F)cc1 ZINC000502536438 1122100230 /nfs/dbraw/zinc/10/02/30/1122100230.db2.gz WPGNRACAIXHVBO-IRXDYDNUSA-N 1 3 278.415 3.597 20 0 CHADHO CC(C)[C@H](NCC[C@@H]1CCC[N@H+]1C)c1ccc(F)cc1 ZINC000502536438 1122100232 /nfs/dbraw/zinc/10/02/32/1122100232.db2.gz WPGNRACAIXHVBO-IRXDYDNUSA-N 1 3 278.415 3.597 20 0 CHADHO CC(C)[C@H]([NH2+]CC[C@@H]1CCCN1C)c1ccc(F)cc1 ZINC000502536438 1122100233 /nfs/dbraw/zinc/10/02/33/1122100233.db2.gz WPGNRACAIXHVBO-IRXDYDNUSA-N 1 3 278.415 3.597 20 0 CHADHO CN(C)[C@H]1CCC[C@@H]([NH2+]Cc2cccc(C3CC3)c2)C1 ZINC000421367254 1122102162 /nfs/dbraw/zinc/10/21/62/1122102162.db2.gz SKUXMCOIZWMLRT-MSOLQXFVSA-N 1 3 272.436 3.526 20 0 CHADHO CC(C)(C)N1CCC([NH2+]CC2CCC(F)(F)CC2)CC1 ZINC000503055069 1122165692 /nfs/dbraw/zinc/16/56/92/1122165692.db2.gz YNQIPTHWCVEDAY-UHFFFAOYSA-N 1 3 288.426 3.664 20 0 CHADHO C[C@H]1CCNCC[N@@H+]1Cc1ccc(-c2ccccc2)cc1 ZINC001205324700 1122323034 /nfs/dbraw/zinc/32/30/34/1122323034.db2.gz FLDZQXIBVPCMNZ-INIZCTEOSA-N 1 3 280.415 3.537 20 0 CHADHO C[C@H]1CCNCC[N@H+]1Cc1ccc(-c2ccccc2)cc1 ZINC001205324700 1122323038 /nfs/dbraw/zinc/32/30/38/1122323038.db2.gz FLDZQXIBVPCMNZ-INIZCTEOSA-N 1 3 280.415 3.537 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H](C)c2cccc(CC(C)C)c2)C1 ZINC000514104975 1122375611 /nfs/dbraw/zinc/37/56/11/1122375611.db2.gz NWEFUJBQPDIATK-FUHWJXTLSA-N 1 3 288.479 3.878 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H](C)c2cccc(CC(C)C)c2)C1 ZINC000514104975 1122375617 /nfs/dbraw/zinc/37/56/17/1122375617.db2.gz NWEFUJBQPDIATK-FUHWJXTLSA-N 1 3 288.479 3.878 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H](C)c2cccc(CC(C)C)c2)C1 ZINC000514104975 1122375624 /nfs/dbraw/zinc/37/56/24/1122375624.db2.gz NWEFUJBQPDIATK-FUHWJXTLSA-N 1 3 288.479 3.878 20 0 CHADHO C[C@H](C[N@@H+]1CC[C@@H](CN2CCCCC2)C1)CC(C)(C)C ZINC001191070330 1122568218 /nfs/dbraw/zinc/56/82/18/1122568218.db2.gz KNKPQHFHGSOPHW-IRXDYDNUSA-N 1 3 280.500 3.867 20 0 CHADHO C[C@H](C[N@H+]1CC[C@@H](CN2CCCCC2)C1)CC(C)(C)C ZINC001191070330 1122568224 /nfs/dbraw/zinc/56/82/24/1122568224.db2.gz KNKPQHFHGSOPHW-IRXDYDNUSA-N 1 3 280.500 3.867 20 0 CHADHO C[C@@H]1C[C@@H]2CCCC[C@@H]2N1CC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001191076090 1122569469 /nfs/dbraw/zinc/56/94/69/1122569469.db2.gz GASNIWNITICOHT-WKULXVSPSA-N 1 3 278.484 3.617 20 0 CHADHO C[C@@H]1C[C@@H]2CCCC[C@@H]2N1CC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001191076090 1122569472 /nfs/dbraw/zinc/56/94/72/1122569472.db2.gz GASNIWNITICOHT-WKULXVSPSA-N 1 3 278.484 3.617 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@H+](C[C@H](C)C2CCCCC2)C1 ZINC001191260070 1122585500 /nfs/dbraw/zinc/58/55/00/1122585500.db2.gz ZCZAUMDDVDZVOI-IRXDYDNUSA-N 1 3 280.500 3.867 20 0 CHADHO CCN(CC)C[C@@H]1CC[N@@H+](C[C@H](C)C2CCCCC2)C1 ZINC001191260070 1122585503 /nfs/dbraw/zinc/58/55/03/1122585503.db2.gz ZCZAUMDDVDZVOI-IRXDYDNUSA-N 1 3 280.500 3.867 20 0 CHADHO CC(C)[C@H](CSc1ccccc1)[NH2+]C[C@H](C)CN(C)C ZINC000425938315 1122668553 /nfs/dbraw/zinc/66/85/53/1122668553.db2.gz WUYLPMMWBPXAGE-RDJZCZTQSA-N 1 3 294.508 3.591 20 0 CHADHO C[C@@H]1CCC[C@@H](N2CCC([NH2+]C3CC(C)(C)C3)CC2)C1 ZINC000578524556 1122795857 /nfs/dbraw/zinc/79/58/57/1122795857.db2.gz JJMMPQXHEJQOSY-RHSMWYFYSA-N 1 3 278.484 3.808 20 0 CHADHO c1ccc([C@@H]2C[C@H]2NC2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167967969 1122848234 /nfs/dbraw/zinc/84/82/34/1122848234.db2.gz NGDNLINFNQUUOQ-OLPBJYBYSA-N 1 3 296.458 3.538 20 0 CHADHO c1ccc([C@@H]2C[C@H]2NC2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167967969 1122848237 /nfs/dbraw/zinc/84/82/37/1122848237.db2.gz NGDNLINFNQUUOQ-OLPBJYBYSA-N 1 3 296.458 3.538 20 0 CHADHO CCN(CC)CCC[N@@H+]1C[C@@H](c2ccccc2)CC1(C)C ZINC001198287987 1122986290 /nfs/dbraw/zinc/98/62/90/1122986290.db2.gz CXTAVSONKWXDQK-SFHVURJKSA-N 1 3 288.479 3.986 20 0 CHADHO CCN(CC)CCC[N@H+]1C[C@@H](c2ccccc2)CC1(C)C ZINC001198287987 1122986293 /nfs/dbraw/zinc/98/62/93/1122986293.db2.gz CXTAVSONKWXDQK-SFHVURJKSA-N 1 3 288.479 3.986 20 0 CHADHO C/C(=C\c1ccc(Cl)cc1)CNCC(C)(C)C[NH+](C)C ZINC001198959102 1123017888 /nfs/dbraw/zinc/01/78/88/1123017888.db2.gz IQEKBQGFBDPQTI-GXDHUFHOSA-N 1 3 294.870 3.921 20 0 CHADHO CCC(C)(C)CCN1CCC([NH+]2CCCCC2)CC1 ZINC000441212560 1123069412 /nfs/dbraw/zinc/06/94/12/1123069412.db2.gz TYLUAWLGNLIZCO-UHFFFAOYSA-N 1 3 266.473 3.763 20 0 CHADHO CCC(C)(C)CC[NH+]1CCC(N2CCCCC2)CC1 ZINC000441212560 1123069417 /nfs/dbraw/zinc/06/94/17/1123069417.db2.gz TYLUAWLGNLIZCO-UHFFFAOYSA-N 1 3 266.473 3.763 20 0 CHADHO CCN(CC)CCC[NH2+][C@H](C)[C@@H]1C[C@H]1c1cccs1 ZINC000417295619 1123084818 /nfs/dbraw/zinc/08/48/18/1123084818.db2.gz FKNCBXRVULQKBA-QLFBSQMISA-N 1 3 280.481 3.562 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1C[C@H]1CC=CCC1 ZINC001201423673 1123099056 /nfs/dbraw/zinc/09/90/56/1123099056.db2.gz RKHFGWQSRIHNPJ-BZSNNMDCSA-N 1 3 276.468 3.682 20 0 CHADHO CN1CCC[C@H]1C[C@@H]1CCCC[N@H+]1C[C@H]1CC=CCC1 ZINC001201423673 1123099060 /nfs/dbraw/zinc/09/90/60/1123099060.db2.gz RKHFGWQSRIHNPJ-BZSNNMDCSA-N 1 3 276.468 3.682 20 0 CHADHO CC[C@H]1CCC[N@@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C1 ZINC001167994341 1123103659 /nfs/dbraw/zinc/10/36/59/1123103659.db2.gz BUWCDLUNMVOBMY-QTXGHNMQSA-N 1 3 276.468 3.514 20 0 CHADHO CC[C@H]1CCC[N@H+](C2C[C@H]3CC[C@@H](C2)N3CC2CC2)C1 ZINC001167994341 1123103661 /nfs/dbraw/zinc/10/36/61/1123103661.db2.gz BUWCDLUNMVOBMY-QTXGHNMQSA-N 1 3 276.468 3.514 20 0 CHADHO CCCCC[N@@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001201734519 1123149728 /nfs/dbraw/zinc/14/97/28/1123149728.db2.gz DZDZWIHAKVYQRH-MRXNPFEDSA-N 1 3 252.446 3.517 20 0 CHADHO CCCCC[N@H+]1CCCC[C@@H]1CCN1CCCC1 ZINC001201734519 1123149731 /nfs/dbraw/zinc/14/97/31/1123149731.db2.gz DZDZWIHAKVYQRH-MRXNPFEDSA-N 1 3 252.446 3.517 20 0 CHADHO C(CN1CCCC1)[C@@H]1CCCC[N@@H+]1CC1CCCC1 ZINC001202167784 1123180535 /nfs/dbraw/zinc/18/05/35/1123180535.db2.gz VBODFQZVFRITIX-KRWDZBQOSA-N 1 3 264.457 3.517 20 0 CHADHO C(CN1CCCC1)[C@@H]1CCCC[N@H+]1CC1CCCC1 ZINC001202167784 1123180537 /nfs/dbraw/zinc/18/05/37/1123180537.db2.gz VBODFQZVFRITIX-KRWDZBQOSA-N 1 3 264.457 3.517 20 0 CHADHO COc1ccc2cc([C@H](C)[NH2+]CC3(N)CCCC3)ccc2c1 ZINC000665250191 1123266254 /nfs/dbraw/zinc/26/62/54/1123266254.db2.gz KETIBECMVHUABQ-AWEZNQCLSA-N 1 3 298.430 3.771 20 0 CHADHO [NH3+][C@H]1C[C@H](NC2CCC3(CC3(F)F)CC2)c2ccccc21 ZINC000665273774 1123303349 /nfs/dbraw/zinc/30/33/49/1123303349.db2.gz DFBNVXOCHYNSHH-MOGXHWRCSA-N 1 3 292.373 3.689 20 0 CHADHO CCC1(N2CCC2)CC[NH+](Cc2cccc3cc[nH]c32)CC1 ZINC000895827191 1123516930 /nfs/dbraw/zinc/51/69/30/1123516930.db2.gz HEQLXWODZAQSAP-UHFFFAOYSA-N 1 3 297.446 3.618 20 0 CHADHO COc1ccc([C@H](C)[C@H](C)[NH2+]CCCN(C)C(C)C)cc1 ZINC000474465199 1123535105 /nfs/dbraw/zinc/53/51/05/1123535105.db2.gz WOKRTFRPXFWHEQ-CVEARBPZSA-N 1 3 292.467 3.507 20 0 CHADHO C[C@H]1CCN1C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168038972 1123559309 /nfs/dbraw/zinc/55/93/09/1123559309.db2.gz AQGNHSLKJBKQKB-ARFHVFGLSA-N 1 3 272.436 3.522 20 0 CHADHO C[C@@H]1CCCC[N@@H+]1CCCNc1ccnc2ccccc21 ZINC000041720326 1123594831 /nfs/dbraw/zinc/59/48/31/1123594831.db2.gz SMWOLBGOZCZJJC-OAHLLOKOSA-N 1 3 283.419 3.911 20 0 CHADHO C[C@@H]1CCCC[N@H+]1CCCNc1ccnc2ccccc21 ZINC000041720326 1123594838 /nfs/dbraw/zinc/59/48/38/1123594838.db2.gz SMWOLBGOZCZJJC-OAHLLOKOSA-N 1 3 283.419 3.911 20 0 CHADHO Cc1cc(F)ccc1[C@@H](C)[NH2+]C[C@@H]1CCCCN(C)C1 ZINC000858491627 1123657527 /nfs/dbraw/zinc/65/75/27/1123657527.db2.gz MDBWVIAOXBTRCG-CABCVRRESA-N 1 3 278.415 3.517 20 0 CHADHO CCC[N@@H+]1CC[C@H](CNc2ccnc3ccc(C)cc32)C1 ZINC000302151323 1123957893 /nfs/dbraw/zinc/95/78/93/1123957893.db2.gz KNKJELLVTDMXHU-OAHLLOKOSA-N 1 3 283.419 3.687 20 0 CHADHO CCC[N@H+]1CC[C@H](CNc2ccnc3ccc(C)cc32)C1 ZINC000302151323 1123957897 /nfs/dbraw/zinc/95/78/97/1123957897.db2.gz KNKJELLVTDMXHU-OAHLLOKOSA-N 1 3 283.419 3.687 20 0 CHADHO Cc1ccc2nccc(N(C)C3CC[NH+](C(C)C)CC3)c2c1 ZINC000302174977 1123959931 /nfs/dbraw/zinc/95/99/31/1123959931.db2.gz WRHNNLBPRTXVFM-UHFFFAOYSA-N 1 3 297.446 3.852 20 0 CHADHO Cc1ccc([C@@H](CNc2cc[nH+]c(C)c2)N2CCCC2)o1 ZINC000302544130 1123972147 /nfs/dbraw/zinc/97/21/47/1123972147.db2.gz GMOIIPDJXYATPL-MRXNPFEDSA-N 1 3 285.391 3.540 20 0 CHADHO CC(C)[C@@H](NCc1cccc(C[NH+](C)C)c1)c1ccccn1 ZINC000866222649 1124039670 /nfs/dbraw/zinc/03/96/70/1124039670.db2.gz NQXBFWFYAZWZQB-LJQANCHMSA-N 1 3 297.446 3.630 20 0 CHADHO CC(C)[C@H](NCc1cccc(C[NH+](C)C)c1)c1ccccn1 ZINC000866222648 1124039974 /nfs/dbraw/zinc/03/99/74/1124039974.db2.gz NQXBFWFYAZWZQB-IBGZPJMESA-N 1 3 297.446 3.630 20 0 CHADHO Cc1csc([C@H](C)NCCC2CC[NH+](C(C)C)CC2)n1 ZINC000866470110 1124069306 /nfs/dbraw/zinc/06/93/06/1124069306.db2.gz RQDILUZXPYXGPC-AWEZNQCLSA-N 1 3 295.496 3.613 20 0 CHADHO C[C@@H](CC[N@@H+]1CCCC12CCN(C)CC2)c1ccccc1 ZINC000446793432 1124122430 /nfs/dbraw/zinc/12/24/30/1124122430.db2.gz DSWSIXIULWELGY-KRWDZBQOSA-N 1 3 286.463 3.740 20 0 CHADHO C[C@@H](CC[N@H+]1CCCC12CCN(C)CC2)c1ccccc1 ZINC000446793432 1124122431 /nfs/dbraw/zinc/12/24/31/1124122431.db2.gz DSWSIXIULWELGY-KRWDZBQOSA-N 1 3 286.463 3.740 20 0 CHADHO CC[C@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)c1cccc(F)c1 ZINC000446939156 1124128726 /nfs/dbraw/zinc/12/87/26/1124128726.db2.gz ZPWKLGLBUJZAPI-ULQDDVLXSA-N 1 3 278.415 3.739 20 0 CHADHO c1cc2c(cccc2CN[C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)[nH]1 ZINC000635011990 1129170108 /nfs/dbraw/zinc/17/01/08/1129170108.db2.gz IOXCMPBXMKVRIN-YTQUADARSA-N 1 3 297.446 3.568 20 0 CHADHO CC[C@H](N[C@@H]1CC[NH2+]CC(C)(C)C1)c1cccs1 ZINC000635008991 1129170479 /nfs/dbraw/zinc/17/04/79/1129170479.db2.gz FTLIYPKDGXRCJR-OLZOCXBDSA-N 1 3 266.454 3.567 20 0 CHADHO CC1(C)CCC[C@@H]([NH+]2CCC(N3CCCC3)CC2)C1 ZINC001258283721 1129177060 /nfs/dbraw/zinc/17/70/60/1129177060.db2.gz PMUIUKGMLVSXPT-MRXNPFEDSA-N 1 3 264.457 3.515 20 0 CHADHO CC1(C)CCC[C@H]([NH+]2CCC(N3CCCC3)CC2)C1 ZINC001258283720 1129177114 /nfs/dbraw/zinc/17/71/14/1129177114.db2.gz PMUIUKGMLVSXPT-INIZCTEOSA-N 1 3 264.457 3.515 20 0 CHADHO C[C@@H]1CCC[C@@H]([NH2+]CCCN2C[C@H](C)C[C@H](C)C2)C1 ZINC000525694080 1124458373 /nfs/dbraw/zinc/45/83/73/1124458373.db2.gz LXOKJVAZKYQPBO-WCXIOVBPSA-N 1 3 266.473 3.523 20 0 CHADHO C[C@H](C[NH2+]CCCN1CCC(C)CC1)c1ccc(F)cc1 ZINC000525875220 1124477083 /nfs/dbraw/zinc/47/70/83/1124477083.db2.gz OFNCBEPWQOMUEX-MRXNPFEDSA-N 1 3 292.442 3.641 20 0 CHADHO CC(C)[C@@H]1C[C@H](N[C@H]2CC[N@H+](C)[C@H](C)C2)c2ccccc21 ZINC000447542247 1124486594 /nfs/dbraw/zinc/48/65/94/1124486594.db2.gz INWLQYCGDSGEMI-PDWMJMLSSA-N 1 3 286.463 3.943 20 0 CHADHO CC(C)[C@@H]1C[C@H](N[C@H]2CC[N@@H+](C)[C@H](C)C2)c2ccccc21 ZINC000447542247 1124486596 /nfs/dbraw/zinc/48/65/96/1124486596.db2.gz INWLQYCGDSGEMI-PDWMJMLSSA-N 1 3 286.463 3.943 20 0 CHADHO CC(C)[C@@H]1C[C@H](N[C@@H]2CC[N@H+](C)[C@@H](C)C2)c2ccccc21 ZINC000447542250 1124486913 /nfs/dbraw/zinc/48/69/13/1124486913.db2.gz INWLQYCGDSGEMI-QXGSTGNESA-N 1 3 286.463 3.943 20 0 CHADHO CC(C)[C@@H]1C[C@H](N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c2ccccc21 ZINC000447542250 1124486917 /nfs/dbraw/zinc/48/69/17/1124486917.db2.gz INWLQYCGDSGEMI-QXGSTGNESA-N 1 3 286.463 3.943 20 0 CHADHO CN(C)[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC000526988885 1124539720 /nfs/dbraw/zinc/53/97/20/1124539720.db2.gz QRDMDAYBGLDZHB-LSDHHAIUSA-N 1 3 282.378 3.587 20 0 CHADHO CCC[C@H]([NH2+]C[C@@H]1CCN(CCC)C1)C1CCCC1 ZINC000449095470 1124650699 /nfs/dbraw/zinc/65/06/99/1124650699.db2.gz YQICEXRMRKSOFY-RDJZCZTQSA-N 1 3 266.473 3.667 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1cccc([O-])c1F ZINC000872017322 1124657196 /nfs/dbraw/zinc/65/71/96/1124657196.db2.gz ZEZNUVHLDOWRQO-KBPBESRZSA-N 1 3 296.430 3.692 20 0 CHADHO CN(CCCCCC[NH3+])Cc1cnc(C2CCCC2)s1 ZINC000873231922 1124753274 /nfs/dbraw/zinc/75/32/74/1124753274.db2.gz ZHVXOYQOIVJOQL-UHFFFAOYSA-N 1 3 295.496 3.752 20 0 CHADHO CCC(CC)(CN[C@@H]1CCCCC[C@@H]1[NH3+])C(F)(F)F ZINC000873251798 1124754282 /nfs/dbraw/zinc/75/42/82/1124754282.db2.gz XPPSHBQWBQFSEL-NWDGAFQWSA-N 1 3 280.378 3.605 20 0 CHADHO CCCCCC(CCCCC)[NH2+]C1CCNCC1 ZINC001246082200 1131294259 /nfs/dbraw/zinc/29/42/59/1131294259.db2.gz WQONWLXIBBOFOK-UHFFFAOYSA-N 1 3 254.462 3.857 20 0 CHADHO Cc1ccc([C@@H]2CCC[C@@H]2[NH2+][C@H]2CCNC23CCC3)cc1 ZINC000530176263 1125129569 /nfs/dbraw/zinc/12/95/69/1125129569.db2.gz AGEIQBYPQBAEKJ-BZSNNMDCSA-N 1 3 284.447 3.505 20 0 CHADHO CCc1ccc(CCN(C)[C@H]2CC[N@@H+](CC)[C@H](C)C2)cc1 ZINC000530901507 1125185569 /nfs/dbraw/zinc/18/55/69/1125185569.db2.gz GNVRNFKHUQHJAC-APWZRJJASA-N 1 3 288.479 3.596 20 0 CHADHO CCc1ccc(CCN(C)[C@H]2CC[N@H+](CC)[C@H](C)C2)cc1 ZINC000530901507 1125185570 /nfs/dbraw/zinc/18/55/70/1125185570.db2.gz GNVRNFKHUQHJAC-APWZRJJASA-N 1 3 288.479 3.596 20 0 CHADHO c1ccc2cc(CNC3CC[NH+](C4CC4)CC3)ccc2c1 ZINC000035054355 1125302331 /nfs/dbraw/zinc/30/23/31/1125302331.db2.gz GVTSDQPQTVYVCC-UHFFFAOYSA-N 1 3 280.415 3.556 20 0 CHADHO C[N@@H+]1CCC[C@@H]2CN(Cc3ccc4ccccc4c3)CC[C@H]21 ZINC000532536503 1125409285 /nfs/dbraw/zinc/40/92/85/1125409285.db2.gz OAGMSUNIGKRZAT-WOJBJXKFSA-N 1 3 294.442 3.756 20 0 CHADHO C[N@H+]1CCC[C@@H]2CN(Cc3ccc4ccccc4c3)CC[C@H]21 ZINC000532536503 1125409286 /nfs/dbraw/zinc/40/92/86/1125409286.db2.gz OAGMSUNIGKRZAT-WOJBJXKFSA-N 1 3 294.442 3.756 20 0 CHADHO CN1CCC[C@@H]2C[N@H+](Cc3ccc4ccccc4c3)CC[C@H]21 ZINC000532536503 1125409287 /nfs/dbraw/zinc/40/92/87/1125409287.db2.gz OAGMSUNIGKRZAT-WOJBJXKFSA-N 1 3 294.442 3.756 20 0 CHADHO CN1CCC[C@@H]2C[N@@H+](Cc3ccc4ccccc4c3)CC[C@H]21 ZINC000532536503 1125409288 /nfs/dbraw/zinc/40/92/88/1125409288.db2.gz OAGMSUNIGKRZAT-WOJBJXKFSA-N 1 3 294.442 3.756 20 0 CHADHO CC(C)[C@@H](NC[C@H]1CCC[NH2+]C1)c1ccc(Cl)cc1 ZINC000132078022 1125413570 /nfs/dbraw/zinc/41/35/70/1125413570.db2.gz SBPONZIDDBFZRP-XJKSGUPXSA-N 1 3 280.843 3.626 20 0 CHADHO Cc1cc([C@H](C)N[C@H]2CC[N@H+](C)[C@H](C)C2)cc(C)c1F ZINC000166407032 1129224251 /nfs/dbraw/zinc/22/42/51/1129224251.db2.gz VNILHATXDHFHCC-YCPHGPKFSA-N 1 3 278.415 3.576 20 0 CHADHO Cc1cc([C@H](C)N[C@H]2CC[N@@H+](C)[C@H](C)C2)cc(C)c1F ZINC000166407032 1129224253 /nfs/dbraw/zinc/22/42/53/1129224253.db2.gz VNILHATXDHFHCC-YCPHGPKFSA-N 1 3 278.415 3.576 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2cccc3ncccc23)C[C@H]1C ZINC000638111124 1129243949 /nfs/dbraw/zinc/24/39/49/1129243949.db2.gz RIYXVLOEGZHUDD-NVXWUHKLSA-N 1 3 297.446 3.539 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2cccc3ncccc23)C[C@H]1C ZINC000638111124 1129243950 /nfs/dbraw/zinc/24/39/50/1129243950.db2.gz RIYXVLOEGZHUDD-NVXWUHKLSA-N 1 3 297.446 3.539 20 0 CHADHO Cc1cc2cc(NCC(C)(C)C[NH+](C)C)ccc2cn1 ZINC001168768589 1129284629 /nfs/dbraw/zinc/28/46/29/1129284629.db2.gz BVHAXDXOAGMIAB-UHFFFAOYSA-N 1 3 271.408 3.543 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@@H+]1CCCC[C@H](CN)C1 ZINC001206606311 1129381425 /nfs/dbraw/zinc/38/14/25/1129381425.db2.gz KDKVKLFNGQJVAA-DLBZAZTESA-N 1 3 266.473 3.820 20 0 CHADHO CC(C)=CCC[C@H](C)CC[N@H+]1CCCC[C@H](CN)C1 ZINC001206606311 1129381428 /nfs/dbraw/zinc/38/14/28/1129381428.db2.gz KDKVKLFNGQJVAA-DLBZAZTESA-N 1 3 266.473 3.820 20 0 CHADHO Cc1ccccc1C1([NH2+]C2CCN(C(C)(C)C)CC2)CC1 ZINC000647316210 1129566801 /nfs/dbraw/zinc/56/68/01/1129566801.db2.gz UWPLCKWJNBBJCE-UHFFFAOYSA-N 1 3 286.463 3.837 20 0 CHADHO C[C@@H](c1ccc2ccccc2c1)N(C[C@@H]1CC[NH2+]C1)C1CC1 ZINC000647882038 1129586798 /nfs/dbraw/zinc/58/67/98/1129586798.db2.gz DIKQETHSEWEPJB-JKSUJKDBSA-N 1 3 294.442 3.975 20 0 CHADHO C[C@@H](c1ccc2ccccc2c1)N(C[C@H]1CC[NH2+]C1)C1CC1 ZINC000647882036 1129587177 /nfs/dbraw/zinc/58/71/77/1129587177.db2.gz DIKQETHSEWEPJB-HOTGVXAUSA-N 1 3 294.442 3.975 20 0 CHADHO Clc1cccc([C@H](NC[C@@H]2CC[NH2+]C2)C2CCCC2)c1 ZINC000647992098 1129591111 /nfs/dbraw/zinc/59/11/11/1129591111.db2.gz FLBUNXRSRDOKGF-CXAGYDPISA-N 1 3 292.854 3.770 20 0 CHADHO C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)N2C)c1ccc(Cl)c(F)c1 ZINC001169097844 1129696326 /nfs/dbraw/zinc/69/63/26/1129696326.db2.gz CMNUBZBPLYLCBZ-ZRJCITRHSA-N 1 3 296.817 3.755 20 0 CHADHO CC[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(C)cc1 ZINC001169099323 1129696485 /nfs/dbraw/zinc/69/64/85/1129696485.db2.gz PTUGUJFWLZWPPQ-MHORFTMASA-N 1 3 272.436 3.661 20 0 CHADHO CC[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(C)cc1 ZINC001169099323 1129696486 /nfs/dbraw/zinc/69/64/86/1129696486.db2.gz PTUGUJFWLZWPPQ-MHORFTMASA-N 1 3 272.436 3.661 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@H](N[C@H](c1ccccc1)C(C)(C)C)C2 ZINC001169091437 1129699849 /nfs/dbraw/zinc/69/98/49/1129699849.db2.gz QZRFTRJSEVQFEP-ZJPYXAASSA-N 1 3 286.463 3.989 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](N[C@H](c1ccccc1)C(C)(C)C)C2 ZINC001169091437 1129699851 /nfs/dbraw/zinc/69/98/51/1129699851.db2.gz QZRFTRJSEVQFEP-ZJPYXAASSA-N 1 3 286.463 3.989 20 0 CHADHO CC[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)N2C)c1cc(F)cc(F)c1 ZINC001169119560 1129700723 /nfs/dbraw/zinc/70/07/23/1129700723.db2.gz ULAMKJLVFQTSDV-YYIAUSFCSA-N 1 3 294.389 3.631 20 0 CHADHO C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](N[C@@H]1CCCCc3ccccc31)C2 ZINC001169122763 1129700736 /nfs/dbraw/zinc/70/07/36/1129700736.db2.gz CZSXDYNMWXVQAT-SFNKJDCFSA-N 1 3 284.447 3.669 20 0 CHADHO C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](N[C@@H]1CCCCc3ccccc31)C2 ZINC001169122763 1129700737 /nfs/dbraw/zinc/70/07/37/1129700737.db2.gz CZSXDYNMWXVQAT-SFNKJDCFSA-N 1 3 284.447 3.669 20 0 CHADHO CN1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccc(C(C)(C)C)cc1)C2 ZINC001169090893 1129700873 /nfs/dbraw/zinc/70/08/73/1129700873.db2.gz NKJZKWCTRYBNOK-NNZMDNLPSA-N 1 3 286.463 3.699 20 0 CHADHO Cc1ccc2c(c1)[C@H](N[C@@H]1C[C@H]3CC[C@@H](C1)[N@H+]3C)CCC2 ZINC001169124370 1129701529 /nfs/dbraw/zinc/70/15/29/1129701529.db2.gz QNLAMVSBSRTBSE-VXIBKDFQSA-N 1 3 284.447 3.587 20 0 CHADHO Cc1ccc2c(c1)[C@H](N[C@@H]1C[C@H]3CC[C@@H](C1)[N@@H+]3C)CCC2 ZINC001169124370 1129701531 /nfs/dbraw/zinc/70/15/31/1129701531.db2.gz QNLAMVSBSRTBSE-VXIBKDFQSA-N 1 3 284.447 3.587 20 0 CHADHO CC[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(C)c(C)c1 ZINC001169107140 1129703536 /nfs/dbraw/zinc/70/35/36/1129703536.db2.gz DZFNYISYLPFCJE-FCGDIQPGSA-N 1 3 286.463 3.969 20 0 CHADHO CC[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(C)c(C)c1 ZINC001169107140 1129703538 /nfs/dbraw/zinc/70/35/38/1129703538.db2.gz DZFNYISYLPFCJE-FCGDIQPGSA-N 1 3 286.463 3.969 20 0 CHADHO CC[C@H](NC1CC[NH+](CC)CC1)c1ccc(F)c(C)c1 ZINC001169241146 1129712344 /nfs/dbraw/zinc/71/23/44/1129712344.db2.gz IKNVLADYNHGARH-KRWDZBQOSA-N 1 3 278.415 3.659 20 0 CHADHO CC[C@H](NCc1ccccc1C[NH2+]C)c1ccc(F)cc1 ZINC000650758251 1129722214 /nfs/dbraw/zinc/72/22/14/1129722214.db2.gz LUHGVSVNQFWKSB-SFHVURJKSA-N 1 3 286.394 3.786 20 0 CHADHO CC(C)C[C@H](NC[C@H]1CCC[N@H+](C)C1)c1ccc(F)cc1 ZINC000652151430 1129758927 /nfs/dbraw/zinc/75/89/27/1129758927.db2.gz SLWSAVXHLGMNOW-QAPCUYQASA-N 1 3 292.442 3.844 20 0 CHADHO CC(C)C[C@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccc(F)cc1 ZINC000652151430 1129758930 /nfs/dbraw/zinc/75/89/30/1129758930.db2.gz SLWSAVXHLGMNOW-QAPCUYQASA-N 1 3 292.442 3.844 20 0 CHADHO C[NH+](C)C[C@H]1CCN(Cc2ccccc2-c2ccccc2)C1 ZINC000769404596 1129907190 /nfs/dbraw/zinc/90/71/90/1129907190.db2.gz OYRIODIUSRWIDO-QGZVFWFLSA-N 1 3 294.442 3.737 20 0 CHADHO COc1cc([C@H](C)N[C@H](C)C[C@H](C)[NH3+])cc2ccccc21 ZINC000902514705 1130018011 /nfs/dbraw/zinc/01/80/11/1130018011.db2.gz USBCXDUTCMTHLW-MJBXVCDLSA-N 1 3 286.419 3.625 20 0 CHADHO Cc1cc(C)cc(CCNC2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC2)c1 ZINC000903099304 1130111274 /nfs/dbraw/zinc/11/12/74/1130111274.db2.gz DOYZIBLUXHARNC-CTXDPNEZSA-N 1 3 298.474 3.593 20 0 CHADHO Cc1cc(C)cc(CCNC2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)c1 ZINC000903099304 1130111278 /nfs/dbraw/zinc/11/12/78/1130111278.db2.gz DOYZIBLUXHARNC-CTXDPNEZSA-N 1 3 298.474 3.593 20 0 CHADHO CCCC[C@H](CC)N[C@@H](CC[NH+](C)C)c1cccnc1 ZINC000903383781 1130169196 /nfs/dbraw/zinc/16/91/96/1130169196.db2.gz OOOBHUQYIDKCFU-IRXDYDNUSA-N 1 3 277.456 3.633 20 0 CHADHO CN(Cc1cccc(Cl)c1Cl)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903425928 1130175020 /nfs/dbraw/zinc/17/50/20/1130175020.db2.gz AVRMCZVTKQVMIW-PWSUYJOCSA-N 1 3 287.234 3.553 20 0 CHADHO Cc1c(Cl)ccc(CN2CCC[C@@H](C[NH3+])[C@@H](C)C2)c1F ZINC001206036774 1130254528 /nfs/dbraw/zinc/25/45/28/1130254528.db2.gz PVYQVPFSPFEVNG-AAEUAGOBSA-N 1 3 298.833 3.594 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2ccccc2C2CC2)[C@@H](C)C1 ZINC000678277433 1130389430 /nfs/dbraw/zinc/38/94/30/1130389430.db2.gz JHNNTKUKKZQPPB-HNAYVOBHSA-N 1 3 286.463 3.726 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2ccccc2C2CC2)[C@@H](C)C1 ZINC000678277433 1130389435 /nfs/dbraw/zinc/38/94/35/1130389435.db2.gz JHNNTKUKKZQPPB-HNAYVOBHSA-N 1 3 286.463 3.726 20 0 CHADHO Fc1ccc(C=C2CC[NH2+]CC2)cc1CN1CCCCC1 ZINC001240879677 1130500922 /nfs/dbraw/zinc/50/09/22/1130500922.db2.gz WWVHPAUIUVLHOU-UHFFFAOYSA-N 1 3 288.410 3.578 20 0 CHADHO CC1(C)CC[C@@H]1[NH2+]C1CCN(CC2CCCCC2)CC1 ZINC000793523007 1130562354 /nfs/dbraw/zinc/56/23/54/1130562354.db2.gz DFNWUNTZKFKSBS-KRWDZBQOSA-N 1 3 278.484 3.809 20 0 CHADHO c1ccc(C2(CN3CCC[C@@]4(CC[NH2+]C4)C3)CCCC2)cc1 ZINC001234993465 1130701387 /nfs/dbraw/zinc/70/13/87/1130701387.db2.gz NYVRNYDMXQHHHD-IBGZPJMESA-N 1 3 298.474 3.574 20 0 CHADHO Cc1cc(C)c(CN2CCC[C@@]3(CCC[NH2+]3)CC2)cc1C ZINC001235042354 1130705660 /nfs/dbraw/zinc/70/56/60/1130705660.db2.gz AVMVPEBWLVCSBN-IBGZPJMESA-N 1 3 286.463 3.720 20 0 CHADHO CCCCc1ccc(C[N@@H+]2CCCC23CCNCC3)cc1 ZINC001235144030 1130714286 /nfs/dbraw/zinc/71/42/86/1130714286.db2.gz IKRICSPDHYIYMB-UHFFFAOYSA-N 1 3 286.463 3.747 20 0 CHADHO CCCCc1ccc(C[N@H+]2CCCC23CCNCC3)cc1 ZINC001235144030 1130714292 /nfs/dbraw/zinc/71/42/92/1130714292.db2.gz IKRICSPDHYIYMB-UHFFFAOYSA-N 1 3 286.463 3.747 20 0 CHADHO c1sc2ccccc2c1C[N@@H+]1CCCC12CCNCC2 ZINC001235144401 1130715213 /nfs/dbraw/zinc/71/52/13/1130715213.db2.gz KTLWHOYBNYGIBE-UHFFFAOYSA-N 1 3 286.444 3.619 20 0 CHADHO c1sc2ccccc2c1C[N@H+]1CCCC12CCNCC2 ZINC001235144401 1130715216 /nfs/dbraw/zinc/71/52/16/1130715216.db2.gz KTLWHOYBNYGIBE-UHFFFAOYSA-N 1 3 286.444 3.619 20 0 CHADHO c1sc2ccccc2c1CN1CCCC12CC[NH2+]CC2 ZINC001235144401 1130715219 /nfs/dbraw/zinc/71/52/19/1130715219.db2.gz KTLWHOYBNYGIBE-UHFFFAOYSA-N 1 3 286.444 3.619 20 0 CHADHO Fc1ccccc1[C@@H]1CCCN1Cc1ccc2c(c1)C[NH2+]C2 ZINC001235719028 1130774125 /nfs/dbraw/zinc/77/41/25/1130774125.db2.gz QNPHWTUQNFQZOC-IBGZPJMESA-N 1 3 296.389 3.766 20 0 CHADHO NC[C@@H]1CCC[N@@H+]1Cc1ccc(/C=C/c2ccccc2)cc1 ZINC001235726455 1130774174 /nfs/dbraw/zinc/77/41/74/1130774174.db2.gz ZNSCZQLUSUKGTJ-IBDYFIJFSA-N 1 3 292.426 3.780 20 0 CHADHO NC[C@@H]1CCC[N@H+]1Cc1ccc(/C=C/c2ccccc2)cc1 ZINC001235726455 1130774178 /nfs/dbraw/zinc/77/41/78/1130774178.db2.gz ZNSCZQLUSUKGTJ-IBDYFIJFSA-N 1 3 292.426 3.780 20 0 CHADHO Cc1c(C)c(C)c(C[N@H+]2C[C@H](N)CC[C@@H]2C)c(C)c1C ZINC001235905050 1130801489 /nfs/dbraw/zinc/80/14/89/1130801489.db2.gz KPAJBFSCOJQOMK-APPDUMDISA-N 1 3 274.452 3.540 20 0 CHADHO Cc1c(C)c(C)c(C[N@@H+]2C[C@H](N)CC[C@@H]2C)c(C)c1C ZINC001235905050 1130801495 /nfs/dbraw/zinc/80/14/95/1130801495.db2.gz KPAJBFSCOJQOMK-APPDUMDISA-N 1 3 274.452 3.540 20 0 CHADHO Cc1cc(Oc2ccccc2)ccc1C[N@@H+](CCN)C(C)C ZINC001235947129 1130813302 /nfs/dbraw/zinc/81/33/02/1130813302.db2.gz HVEPVURYOJCOIR-UHFFFAOYSA-N 1 3 298.430 3.956 20 0 CHADHO Cc1cc(Oc2ccccc2)ccc1C[N@H+](CCN)C(C)C ZINC001235947129 1130813308 /nfs/dbraw/zinc/81/33/08/1130813308.db2.gz HVEPVURYOJCOIR-UHFFFAOYSA-N 1 3 298.430 3.956 20 0 CHADHO [NH3+][C@@H]1[C@@H]2CC[C@H]1CN(Cc1ccc(-c3ccccc3)cc1)C2 ZINC001235958687 1130816743 /nfs/dbraw/zinc/81/67/43/1130816743.db2.gz IIESDKCWMZZCKA-ACDBMABISA-N 1 3 292.426 3.523 20 0 CHADHO CC[C@H]1CO[C@](C)(CCC(C)C)N1CCC12CC([NH3+])(C1)C2 ZINC001235962208 1130818474 /nfs/dbraw/zinc/81/84/74/1130818474.db2.gz MRANZFBWEXNNSX-KNXWPPODSA-N 1 3 294.483 3.521 20 0 CHADHO CC1(C)CN(Cc2ccc3c(c2)C[NH2+]C3)Cc2ccccc21 ZINC001236084485 1130852852 /nfs/dbraw/zinc/85/28/52/1130852852.db2.gz AGYBKVNNIPGSKZ-UHFFFAOYSA-N 1 3 292.426 3.583 20 0 CHADHO C[N@H+](Cc1c[nH]c2ccc(Cl)cc12)[C@H]1CCCC[C@@H]1N ZINC001236212956 1130890557 /nfs/dbraw/zinc/89/05/57/1130890557.db2.gz MWCLREHYNDGFBT-HOCLYGCPSA-N 1 3 291.826 3.523 20 0 CHADHO C[N@@H+](Cc1c[nH]c2ccc(Cl)cc12)[C@H]1CCCC[C@@H]1N ZINC001236212956 1130890565 /nfs/dbraw/zinc/89/05/65/1130890565.db2.gz MWCLREHYNDGFBT-HOCLYGCPSA-N 1 3 291.826 3.523 20 0 CHADHO CC(C)c1cccc(C[N@H+](C)[C@H]2CCCC[C@@H]2N)c1 ZINC001236214070 1130891115 /nfs/dbraw/zinc/89/11/15/1130891115.db2.gz DUKJBQMQIXDRBZ-IRXDYDNUSA-N 1 3 260.425 3.512 20 0 CHADHO CC(C)c1cccc(C[N@@H+](C)[C@H]2CCCC[C@@H]2N)c1 ZINC001236214070 1130891119 /nfs/dbraw/zinc/89/11/19/1130891119.db2.gz DUKJBQMQIXDRBZ-IRXDYDNUSA-N 1 3 260.425 3.512 20 0 CHADHO C[N@H+](Cc1ccc(F)c2ccccc12)[C@H]1CCCC[C@@H]1N ZINC001236220636 1130895837 /nfs/dbraw/zinc/89/58/37/1130895837.db2.gz ZCCSGZBJBALBQD-ROUUACIJSA-N 1 3 286.394 3.681 20 0 CHADHO C[N@@H+](Cc1ccc(F)c2ccccc12)[C@H]1CCCC[C@@H]1N ZINC001236220636 1130895846 /nfs/dbraw/zinc/89/58/46/1130895846.db2.gz ZCCSGZBJBALBQD-ROUUACIJSA-N 1 3 286.394 3.681 20 0 CHADHO CCN(CCCC[NH3+])Cc1ccc(Cl)cc1Cl ZINC001236265853 1130909773 /nfs/dbraw/zinc/90/97/73/1130909773.db2.gz NZIOJKQFMCYKJP-UHFFFAOYSA-N 1 3 275.223 3.554 20 0 CHADHO CC/C=C\CC[N@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236373274 1130923267 /nfs/dbraw/zinc/92/32/67/1130923267.db2.gz VVWBOTRVLRWILT-MJSXRHKHSA-N 1 3 264.457 3.587 20 0 CHADHO CC/C=C\CC[N@@H+](C[C@@H]1CCCNC1)C1CCCC1 ZINC001236373274 1130923270 /nfs/dbraw/zinc/92/32/70/1130923270.db2.gz VVWBOTRVLRWILT-MJSXRHKHSA-N 1 3 264.457 3.587 20 0 CHADHO CC/C=C\CCC[N@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236373159 1130923651 /nfs/dbraw/zinc/92/36/51/1130923651.db2.gz UIESAGJUZBILCH-LIMHQNJXSA-N 1 3 278.484 3.977 20 0 CHADHO CC/C=C\CCC[N@@H+](C[C@H]1CCCNC1)C1CCCC1 ZINC001236373159 1130923654 /nfs/dbraw/zinc/92/36/54/1130923654.db2.gz UIESAGJUZBILCH-LIMHQNJXSA-N 1 3 278.484 3.977 20 0 CHADHO C[C@H]1C[C@H]1C[N@H+](Cc1ccc(Cl)cc1)C1CCNCC1 ZINC001236452566 1130945104 /nfs/dbraw/zinc/94/51/04/1130945104.db2.gz FVTIAFFBRZFKNZ-ZFWWWQNUSA-N 1 3 292.854 3.550 20 0 CHADHO C[C@H]1C[C@H]1C[N@@H+](Cc1ccc(Cl)cc1)C1CCNCC1 ZINC001236452566 1130945106 /nfs/dbraw/zinc/94/51/06/1130945106.db2.gz FVTIAFFBRZFKNZ-ZFWWWQNUSA-N 1 3 292.854 3.550 20 0 CHADHO C[C@H]1C[C@H]1CN(Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001236452566 1130945110 /nfs/dbraw/zinc/94/51/10/1130945110.db2.gz FVTIAFFBRZFKNZ-ZFWWWQNUSA-N 1 3 292.854 3.550 20 0 CHADHO Cc1ccc(C[N@H+](CC(C)(C)C)C2CCNCC2)s1 ZINC001236457463 1130947108 /nfs/dbraw/zinc/94/71/08/1130947108.db2.gz LBUAHALBTDANRS-UHFFFAOYSA-N 1 3 280.481 3.657 20 0 CHADHO Cc1ccc(C[N@@H+](CC(C)(C)C)C2CCNCC2)s1 ZINC001236457463 1130947111 /nfs/dbraw/zinc/94/71/11/1130947111.db2.gz LBUAHALBTDANRS-UHFFFAOYSA-N 1 3 280.481 3.657 20 0 CHADHO Cc1ccc(CN(CC(C)(C)C)C2CC[NH2+]CC2)s1 ZINC001236457463 1130947114 /nfs/dbraw/zinc/94/71/14/1130947114.db2.gz LBUAHALBTDANRS-UHFFFAOYSA-N 1 3 280.481 3.657 20 0 CHADHO CCc1cccc(C)c1CN(C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC001236602114 1130981395 /nfs/dbraw/zinc/98/13/95/1130981395.db2.gz UBPCYWAELKXEQO-MRXNPFEDSA-N 1 3 286.463 3.521 20 0 CHADHO Cc1cc(F)ccc1[C@@H](C)[NH2+]C[C@H]1CCCN(C(C)C)C1 ZINC000815576591 1131001384 /nfs/dbraw/zinc/00/13/84/1131001384.db2.gz UHMCHBRDCLGUTE-HZPDHXFCSA-N 1 3 292.442 3.905 20 0 CHADHO CCCN(Cc1ccc(C(C)(C)C)cc1)C[C@H]1CC[NH2+]C1 ZINC001236834898 1131018788 /nfs/dbraw/zinc/01/87/88/1131018788.db2.gz JNQAFLHBRIJEBH-KRWDZBQOSA-N 1 3 288.479 3.806 20 0 CHADHO CCCN(Cc1cccc(C(C)(C)C)c1)C[C@@H]1CC[NH2+]C1 ZINC001236836823 1131019084 /nfs/dbraw/zinc/01/90/84/1131019084.db2.gz YGSGQHVUFXFLPG-QGZVFWFLSA-N 1 3 288.479 3.806 20 0 CHADHO CN1CCCC[C@@H]1CC[N@H+](C)[C@@H]1CCc2c1cccc2F ZINC001116195866 1131133452 /nfs/dbraw/zinc/13/34/52/1131133452.db2.gz QMWXUAPYRHUJPX-RDTXWAMCSA-N 1 3 290.426 3.619 20 0 CHADHO CN1CCCC[C@@H]1CC[N@@H+](C)[C@@H]1CCc2c1cccc2F ZINC001116195866 1131133455 /nfs/dbraw/zinc/13/34/55/1131133455.db2.gz QMWXUAPYRHUJPX-RDTXWAMCSA-N 1 3 290.426 3.619 20 0 CHADHO CC[C@H](C)[N@H+](C)Cc1ccc2c(c1)C(C(C)C)=NCC2 ZINC001237876668 1131147079 /nfs/dbraw/zinc/14/70/79/1131147079.db2.gz HBXKTXOJYLRXNS-AWEZNQCLSA-N 1 3 272.436 3.918 20 0 CHADHO CC[C@H](C)[N@@H+](C)Cc1ccc2c(c1)C(C(C)C)=NCC2 ZINC001237876668 1131147080 /nfs/dbraw/zinc/14/70/80/1131147080.db2.gz HBXKTXOJYLRXNS-AWEZNQCLSA-N 1 3 272.436 3.918 20 0 CHADHO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(CN)nc2C)s1 ZINC000817895387 1131186536 /nfs/dbraw/zinc/18/65/36/1131186536.db2.gz URFDJEUUCOYGMR-YPMHNXCESA-N 1 3 289.448 3.630 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](C)c1csc2ccccc12 ZINC000817898121 1131186771 /nfs/dbraw/zinc/18/67/71/1131186771.db2.gz CYUKMSWKYSNANE-SRVKXCTJSA-N 1 3 262.422 3.678 20 0 CHADHO CCCCC[C@H]([NH2+][C@H]1CCNC[C@@H]1C)C(C)(C)C ZINC000817969955 1131193617 /nfs/dbraw/zinc/19/36/17/1131193617.db2.gz IMKHPYHLMZEPFF-KKUMJFAQSA-N 1 3 254.462 3.569 20 0 CHADHO C1CC2(C1)C[C@H]([NH2+][C@@H]1CC[C@H]3CCCC[C@@H]3C1)CCN2 ZINC000817985064 1131194988 /nfs/dbraw/zinc/19/49/88/1131194988.db2.gz GFFITFXQTLVWCA-QBPKDAKJSA-N 1 3 276.468 3.610 20 0 CHADHO C1CC2(C1)C[C@H]([NH2+][C@@H]1CC[C@@H]3CCCC[C@@H]3C1)CCN2 ZINC000817985066 1131195352 /nfs/dbraw/zinc/19/53/52/1131195352.db2.gz GFFITFXQTLVWCA-YLFCFFPRSA-N 1 3 276.468 3.610 20 0 CHADHO CCCCCC[C@@H](C)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246252866 1131433636 /nfs/dbraw/zinc/43/36/36/1131433636.db2.gz XSUINFGFLVFAEI-LVQVYYBASA-N 1 3 252.446 3.608 20 0 CHADHO C[NH2+]CC[C@H](C)N[C@@H](c1ccccc1)C1CCCC1 ZINC001246267114 1131435244 /nfs/dbraw/zinc/43/52/44/1131435244.db2.gz FLBYGSZGBNKDSA-YOEHRIQHSA-N 1 3 260.425 3.506 20 0 CHADHO C[C@H](CC1CCCCC1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)N2 ZINC001246316791 1131465939 /nfs/dbraw/zinc/46/59/39/1131465939.db2.gz UFSLLKFQVROVQW-MXASKKJJSA-N 1 3 264.457 3.608 20 0 CHADHO CC[C@@H]1C[C@@H](N[C@H]2CC23CCCCC3)C[C@H](CC)[NH2+]1 ZINC001246333582 1131474759 /nfs/dbraw/zinc/47/47/59/1131474759.db2.gz KEIQKNZGPVZFFC-FZKCQIBNSA-N 1 3 264.457 3.608 20 0 CHADHO CC(C)([NH2+][C@@H]1CCNC2(CCC2)C1)C1CCCCC1 ZINC001246354572 1131485768 /nfs/dbraw/zinc/48/57/68/1131485768.db2.gz NNXXHZPUJIMOME-OAHLLOKOSA-N 1 3 264.457 3.610 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NCCC[C@@H]2CC2(Cl)Cl)c2ccccc21 ZINC000844926066 1131608549 /nfs/dbraw/zinc/60/85/49/1131608549.db2.gz UBFNMKWFEPWGNY-LERXQTSPSA-N 1 3 299.245 3.695 20 0 CHADHO CCOc1ccc(C[N@H+](CC)CCCN(C)C)cc1Cl ZINC001139597559 1131620963 /nfs/dbraw/zinc/62/09/63/1131620963.db2.gz CXQLIYLVIXRLDE-UHFFFAOYSA-N 1 3 298.858 3.512 20 0 CHADHO CCOc1ccc(C[N@@H+](CC)CCCN(C)C)cc1Cl ZINC001139597559 1131620966 /nfs/dbraw/zinc/62/09/66/1131620966.db2.gz CXQLIYLVIXRLDE-UHFFFAOYSA-N 1 3 298.858 3.512 20 0 CHADHO CCCC[C@@H]1C[C@@H]([N@@H+]2CCC3(CCCC3)C2)CCN1 ZINC001246810140 1131783868 /nfs/dbraw/zinc/78/38/68/1131783868.db2.gz YEDPAAAWXPKVQM-CVEARBPZSA-N 1 3 264.457 3.563 20 0 CHADHO CCCC[C@@H]1C[C@@H]([N@H+]2CCC3(CCCC3)C2)CCN1 ZINC001246810140 1131783874 /nfs/dbraw/zinc/78/38/74/1131783874.db2.gz YEDPAAAWXPKVQM-CVEARBPZSA-N 1 3 264.457 3.563 20 0 CHADHO CCC[N@H+](CC(C)C)[C@H]1C[C@@H](CC)N[C@@H](CC)C1 ZINC001246912774 1131813872 /nfs/dbraw/zinc/81/38/72/1131813872.db2.gz SRDDMFJPVFFWRJ-ZSHCYNCHSA-N 1 3 254.462 3.664 20 0 CHADHO CCC[N@@H+](CC(C)C)[C@H]1C[C@@H](CC)N[C@@H](CC)C1 ZINC001246912774 1131813883 /nfs/dbraw/zinc/81/38/83/1131813883.db2.gz SRDDMFJPVFFWRJ-ZSHCYNCHSA-N 1 3 254.462 3.664 20 0 CHADHO C[NH+]1CCC2(CN(Cc3cccc(C(C)(C)C)c3)C2)CC1 ZINC001141106208 1132019338 /nfs/dbraw/zinc/01/93/38/1132019338.db2.gz RWQLGODWFCVWFL-UHFFFAOYSA-N 1 3 286.463 3.512 20 0 CHADHO CN1C(C)(C)CC([NH2+]CC2(CC3CC3)CC2)CC1(C)C ZINC001171630484 1132061669 /nfs/dbraw/zinc/06/16/69/1132061669.db2.gz OWUGSAUUAYUHQC-UHFFFAOYSA-N 1 3 278.484 3.808 20 0 CHADHO C[C@@H]1CC[C@H](C)[C@H]1[NH2+]C1CC(C)(C)N(C)C(C)(C)C1 ZINC001171629207 1132061972 /nfs/dbraw/zinc/06/19/72/1132061972.db2.gz PQROKQAFOCXNOV-NHAGDIPZSA-N 1 3 266.473 3.662 20 0 CHADHO CCC1CC[NH+](C2CC(C)(C)N(C)C(C)(C)C2)CC1 ZINC001171631865 1132062733 /nfs/dbraw/zinc/06/27/33/1132062733.db2.gz OJDICMIESOLERD-UHFFFAOYSA-N 1 3 266.473 3.760 20 0 CHADHO C[C@@H]([NH2+]C1CC(C)(C)N(C)C(C)(C)C1)C(C)(C)C ZINC001171619039 1132065228 /nfs/dbraw/zinc/06/52/28/1132065228.db2.gz FLQIMSKMRFAZCO-GFCCVEGCSA-N 1 3 254.462 3.662 20 0 CHADHO CCOC1CCC([NH2+]C2CC(C)(C)N(C)C(C)(C)C2)CC1 ZINC001171627321 1132068162 /nfs/dbraw/zinc/06/81/62/1132068162.db2.gz PACUQKKGMUIKSL-UHFFFAOYSA-N 1 3 296.499 3.575 20 0 CHADHO CN1C(C)(C)CC([N@H+](C)CC2CCCC2)CC1(C)C ZINC001171639934 1132083025 /nfs/dbraw/zinc/08/30/25/1132083025.db2.gz VSIREOYAGFIWTP-UHFFFAOYSA-N 1 3 266.473 3.760 20 0 CHADHO CN1C(C)(C)CC([N@@H+](C)CC2CCCC2)CC1(C)C ZINC001171639934 1132083032 /nfs/dbraw/zinc/08/30/32/1132083032.db2.gz VSIREOYAGFIWTP-UHFFFAOYSA-N 1 3 266.473 3.760 20 0 CHADHO CC1CN([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172078806 1132122560 /nfs/dbraw/zinc/12/25/60/1132122560.db2.gz IYQKJVOBRWCDHO-BWTSREIZSA-N 1 3 284.447 3.524 20 0 CHADHO CC1CN([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172078806 1132122564 /nfs/dbraw/zinc/12/25/64/1132122564.db2.gz IYQKJVOBRWCDHO-BWTSREIZSA-N 1 3 284.447 3.524 20 0 CHADHO Cc1ccc([C@@H](C)N[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172100553 1132126321 /nfs/dbraw/zinc/12/63/21/1132126321.db2.gz DYOIEYYOWBZRQX-NRSFXHEJSA-N 1 3 272.436 3.661 20 0 CHADHO Cc1ccc([C@@H](C)N[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172100553 1132126325 /nfs/dbraw/zinc/12/63/25/1132126325.db2.gz DYOIEYYOWBZRQX-NRSFXHEJSA-N 1 3 272.436 3.661 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CC[C@H]3CCCC[C@H]3C1)C2 ZINC001172126188 1132126347 /nfs/dbraw/zinc/12/63/47/1132126347.db2.gz UCVHNSNFTYFCNE-WKULXVSPSA-N 1 3 276.468 3.514 20 0 CHADHO CN1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CC[C@H]3CCCC[C@H]3C1)C2 ZINC001172126188 1132126350 /nfs/dbraw/zinc/12/63/50/1132126350.db2.gz UCVHNSNFTYFCNE-WKULXVSPSA-N 1 3 276.468 3.514 20 0 CHADHO Cc1ccc([C@H](C)N[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1F ZINC001172111837 1132134460 /nfs/dbraw/zinc/13/44/60/1132134460.db2.gz WUIQQAHVDAWJOL-LLLHUVSDSA-N 1 3 290.426 3.800 20 0 CHADHO Cc1ccc([C@H](C)N[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1F ZINC001172111837 1132134462 /nfs/dbraw/zinc/13/44/62/1132134462.db2.gz WUIQQAHVDAWJOL-LLLHUVSDSA-N 1 3 290.426 3.800 20 0 CHADHO CC[C@@H](C)OCC[C@H](C)N1CCC([NH3+])(CC2CCC2)CC1 ZINC001172335872 1132175346 /nfs/dbraw/zinc/17/53/46/1132175346.db2.gz LBSVCCUDHVHEAN-JKSUJKDBSA-N 1 3 296.499 3.564 20 0 CHADHO CC[C@@H](CC(C)C)[NH2+]CCCN1CCC(C)CC1 ZINC001172384844 1132210563 /nfs/dbraw/zinc/21/05/63/1132210563.db2.gz JZXHJCKBAOTYEG-INIZCTEOSA-N 1 3 254.462 3.523 20 0 CHADHO CC[C@H](CC(C)C)[NH+]1C(C)(C)CC(N)CC1(C)C ZINC001172390367 1132214572 /nfs/dbraw/zinc/21/45/72/1132214572.db2.gz UYNFVAXNEQLLAO-CQSZACIVSA-N 1 3 254.462 3.791 20 0 CHADHO C[C@@H]1CCCCN1CCC[NH2+]C1CC(C)(C)OC(C)(C)C1 ZINC001172649639 1132288516 /nfs/dbraw/zinc/28/85/16/1132288516.db2.gz RIARWRITCGSBLN-OAHLLOKOSA-N 1 3 296.499 3.577 20 0 CHADHO CC[NH+](CC)C1CCN(C2CC(C)(C)OC(C)(C)C2)CC1 ZINC001172657828 1132291509 /nfs/dbraw/zinc/29/15/09/1132291509.db2.gz FTBCILHXWXCUGJ-UHFFFAOYSA-N 1 3 296.499 3.529 20 0 CHADHO CCN(CC)C1CC[NH+](C2CC(C)(C)OC(C)(C)C2)CC1 ZINC001172657828 1132291514 /nfs/dbraw/zinc/29/15/14/1132291514.db2.gz FTBCILHXWXCUGJ-UHFFFAOYSA-N 1 3 296.499 3.529 20 0 CHADHO CCCN1C[C@@H]2C[NH+](C3CCC4(CCCC4)CC3)C[C@H]2C1 ZINC001172730292 1132304714 /nfs/dbraw/zinc/30/47/14/1132304714.db2.gz CNDDVJIDXZHYKY-IAGOWNOFSA-N 1 3 290.495 3.763 20 0 CHADHO CCCC[C@@H](CC(C)C)[NH2+]CC[C@@H]1CCCN1C ZINC001173248767 1132419270 /nfs/dbraw/zinc/41/92/70/1132419270.db2.gz FYNWSYBACGNXFS-HOTGVXAUSA-N 1 3 254.462 3.665 20 0 CHADHO c1c2c[nH]ccc-2nc1C[N@@H+]1CC[C@H](c2ccccc2)C1 ZINC001232011470 1132411008 /nfs/dbraw/zinc/41/10/08/1132411008.db2.gz LUEUZXSFCWNWKR-HNNXBMFYSA-N 1 3 277.371 3.552 20 0 CHADHO c1c2c[nH]ccc-2nc1C[N@H+]1CC[C@H](c2ccccc2)C1 ZINC001232011470 1132411011 /nfs/dbraw/zinc/41/10/11/1132411011.db2.gz LUEUZXSFCWNWKR-HNNXBMFYSA-N 1 3 277.371 3.552 20 0 CHADHO C[C@H](CN)C[NH2+][C@@H](C)CC(c1ccccc1)c1ccccc1 ZINC001173209969 1132416023 /nfs/dbraw/zinc/41/60/23/1132416023.db2.gz HRULUHCAPBBVPF-SJORKVTESA-N 1 3 296.458 3.782 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@@H+]2CC[C@@H]3CCC[C@@H]3C2)c1 ZINC001232145223 1132427151 /nfs/dbraw/zinc/42/71/51/1132427151.db2.gz YQIMIRWMOGEAKI-DLBZAZTESA-N 1 3 290.426 3.509 20 0 CHADHO CN(C)Cc1cc(F)cc(C[N@H+]2CC[C@@H]3CCC[C@@H]3C2)c1 ZINC001232145223 1132427152 /nfs/dbraw/zinc/42/71/52/1132427152.db2.gz YQIMIRWMOGEAKI-DLBZAZTESA-N 1 3 290.426 3.509 20 0 CHADHO CN(Cc1ccccc1)Cc1cc(F)cc(C[NH+](C)C)c1 ZINC001232145533 1132427557 /nfs/dbraw/zinc/42/75/57/1132427557.db2.gz VAXYVDAIIAWDGZ-UHFFFAOYSA-N 1 3 286.394 3.519 20 0 CHADHO [NH3+]C1C[C@H]2CCC[C@@H](C1)N2Cc1cc2ccccc2s1 ZINC000843053978 1132495225 /nfs/dbraw/zinc/49/52/25/1132495225.db2.gz ODOKHSRFAMNRQJ-GOOCMWNKSA-N 1 3 286.444 3.746 20 0 CHADHO c1ccc(CN2CC(CNc3cc[nH+]c(C4CC4)c3)C2)cc1 ZINC001165468858 1133242803 /nfs/dbraw/zinc/24/28/03/1133242803.db2.gz IFXIISBOWWOQOE-UHFFFAOYSA-N 1 3 293.414 3.503 20 0 CHADHO CC(C)=CCCC1=CC[C@H](CN2CCC([NH3+])CC2)CC1 ZINC001204645972 1133470926 /nfs/dbraw/zinc/47/09/26/1133470926.db2.gz DELIROYCSHDKCA-KRWDZBQOSA-N 1 3 276.468 3.882 20 0 CHADHO CC(C)=CCCC1=CC[C@H](C[NH+]2CCC(N)CC2)CC1 ZINC001204645972 1133470923 /nfs/dbraw/zinc/47/09/23/1133470923.db2.gz DELIROYCSHDKCA-KRWDZBQOSA-N 1 3 276.468 3.882 20 0 CHADHO CCCN1CCC([N@H+](C)Cc2cccc(Cl)c2C)CC1 ZINC001204713336 1133478391 /nfs/dbraw/zinc/47/83/91/1133478391.db2.gz BYEJJOXFBXXXMQ-UHFFFAOYSA-N 1 3 294.870 3.955 20 0 CHADHO CCCN1CCC([N@@H+](C)Cc2cccc(Cl)c2C)CC1 ZINC001204713336 1133478395 /nfs/dbraw/zinc/47/83/95/1133478395.db2.gz BYEJJOXFBXXXMQ-UHFFFAOYSA-N 1 3 294.870 3.955 20 0 CHADHO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc3c(c2)CNC3)c1 ZINC001204848235 1133491455 /nfs/dbraw/zinc/49/14/55/1133491455.db2.gz MACXEXYWXIZKBY-FQEVSTJZSA-N 1 3 292.426 3.935 20 0 CHADHO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ccc3c(c2)CNC3)c1 ZINC001204848235 1133491458 /nfs/dbraw/zinc/49/14/58/1133491458.db2.gz MACXEXYWXIZKBY-FQEVSTJZSA-N 1 3 292.426 3.935 20 0 CHADHO CC(C)CCN1CCC([NH2+]C/C=C/c2ccccc2)CC1 ZINC001204984689 1133512809 /nfs/dbraw/zinc/51/28/09/1133512809.db2.gz NZZRPRQZTMNSRV-RMKNXTFCSA-N 1 3 286.463 3.800 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)C[N@@H+]2CCC[C@@H](N)CC2)cc1 ZINC001205093897 1133528175 /nfs/dbraw/zinc/52/81/75/1133528175.db2.gz HMVDFYCDBRKKCC-VQIMIIECSA-N 1 3 288.479 3.802 20 0 CHADHO CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCC[C@@H](N)CC2)cc1 ZINC001205093897 1133528177 /nfs/dbraw/zinc/52/81/77/1133528177.db2.gz HMVDFYCDBRKKCC-VQIMIIECSA-N 1 3 288.479 3.802 20 0 CHADHO [NH3+][C@@H]1CCCN(Cc2ccc(Cc3ccccc3)cc2)CC1 ZINC001205116560 1133532413 /nfs/dbraw/zinc/53/24/13/1133532413.db2.gz CNIQRXDYAXEQFX-HXUWFJFHSA-N 1 3 294.442 3.591 20 0 CHADHO C[C@@]1([NH3+])CCCN(Cc2c[nH]c3cc(Cl)ccc23)CC1 ZINC001205273267 1133553840 /nfs/dbraw/zinc/55/38/40/1133553840.db2.gz JBHDFWUILWYZNB-MRXNPFEDSA-N 1 3 291.826 3.525 20 0 CHADHO C[C@H]1CCNCC[N@@H+]1Cc1ccc(-c2ccc(F)cc2)cc1 ZINC001205324674 1133560858 /nfs/dbraw/zinc/56/08/58/1133560858.db2.gz DSVQKLKZSVTCKB-HNNXBMFYSA-N 1 3 298.405 3.677 20 0 CHADHO C[C@H]1CCNCC[N@H+]1Cc1ccc(-c2ccc(F)cc2)cc1 ZINC001205324674 1133560860 /nfs/dbraw/zinc/56/08/60/1133560860.db2.gz DSVQKLKZSVTCKB-HNNXBMFYSA-N 1 3 298.405 3.677 20 0 CHADHO C[C@@H]1CCNCC[N@@H+]1Cc1cccc(-c2ccc(F)cc2)c1 ZINC001205326292 1133561494 /nfs/dbraw/zinc/56/14/94/1133561494.db2.gz XXPYSNUYAGSUQQ-OAHLLOKOSA-N 1 3 298.405 3.677 20 0 CHADHO C[C@@H]1CCNCC[N@H+]1Cc1cccc(-c2ccc(F)cc2)c1 ZINC001205326292 1133561496 /nfs/dbraw/zinc/56/14/96/1133561496.db2.gz XXPYSNUYAGSUQQ-OAHLLOKOSA-N 1 3 298.405 3.677 20 0 CHADHO C[C@@H]1CCNCC[N@@H+]1Cc1ccc(-c2ccc(F)cc2)cc1 ZINC001205324676 1133561667 /nfs/dbraw/zinc/56/16/67/1133561667.db2.gz DSVQKLKZSVTCKB-OAHLLOKOSA-N 1 3 298.405 3.677 20 0 CHADHO C[C@@H]1CCNCC[N@H+]1Cc1ccc(-c2ccc(F)cc2)cc1 ZINC001205324676 1133561673 /nfs/dbraw/zinc/56/16/73/1133561673.db2.gz DSVQKLKZSVTCKB-OAHLLOKOSA-N 1 3 298.405 3.677 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001205902994 1133628368 /nfs/dbraw/zinc/62/83/68/1133628368.db2.gz MHQRCIYDFDGVNN-ULQDDVLXSA-N 1 3 298.515 3.667 20 0 CHADHO COC(C)(C)CCC[C@H](C)CC[N@H+]1CCC[C@@H](CN)[C@@H]1C ZINC001205902994 1133628371 /nfs/dbraw/zinc/62/83/71/1133628371.db2.gz MHQRCIYDFDGVNN-ULQDDVLXSA-N 1 3 298.515 3.667 20 0 CHADHO CCCCc1ccc(CN2CCC[C@@H](C[NH3+])[C@@H]2C)s1 ZINC001205901006 1133628904 /nfs/dbraw/zinc/62/89/04/1133628904.db2.gz AMGLBUKCEKCVGL-KBPBESRZSA-N 1 3 280.481 3.650 20 0 CHADHO C[C@@H]1[C@H](CN)CCC[N@@H+]1C[C@H]1C[C@@H]1c1ccc(Cl)cc1 ZINC001205901712 1133628949 /nfs/dbraw/zinc/62/89/49/1133628949.db2.gz FNHRYOPWCDGUAO-DUFGSWQCSA-N 1 3 292.854 3.503 20 0 CHADHO C[C@@H]1[C@H](CN)CCC[N@H+]1C[C@H]1C[C@@H]1c1ccc(Cl)cc1 ZINC001205901712 1133628953 /nfs/dbraw/zinc/62/89/53/1133628953.db2.gz FNHRYOPWCDGUAO-DUFGSWQCSA-N 1 3 292.854 3.503 20 0 CHADHO C[C@@H]1[C@@H](C[NH3+])CCCN1Cc1cccc2c(F)cccc12 ZINC001205914491 1133630191 /nfs/dbraw/zinc/63/01/91/1133630191.db2.gz MMHVVNJVTHOLCH-ZIAGYGMSSA-N 1 3 286.394 3.538 20 0 CHADHO CC(C)CN(CC[C@H]1CCCC[NH2+]1)Cc1ccccc1 ZINC001205922842 1133631626 /nfs/dbraw/zinc/63/16/26/1133631626.db2.gz BNXPACZTBPHQJC-GOSISDBHSA-N 1 3 274.452 3.677 20 0 CHADHO Cc1c(C)c(C)c(C[N@@H+]2CCCC[C@@H](N)C2)c(C)c1C ZINC001205931518 1133632321 /nfs/dbraw/zinc/63/23/21/1133632321.db2.gz KKQIPFDYNZSGPK-QGZVFWFLSA-N 1 3 274.452 3.542 20 0 CHADHO Cc1c(C)c(C)c(C[N@H+]2CCCC[C@@H](N)C2)c(C)c1C ZINC001205931518 1133632328 /nfs/dbraw/zinc/63/23/28/1133632328.db2.gz KKQIPFDYNZSGPK-QGZVFWFLSA-N 1 3 274.452 3.542 20 0 CHADHO Cc1c2ccccc2sc1C[N@@H+]1CCCC[C@H](N)C1 ZINC001205931831 1133632380 /nfs/dbraw/zinc/63/23/80/1133632380.db2.gz LRYYOFMFSLKINA-ZDUSSCGKSA-N 1 3 274.433 3.523 20 0 CHADHO Cc1c2ccccc2sc1C[N@H+]1CCCC[C@H](N)C1 ZINC001205931831 1133632383 /nfs/dbraw/zinc/63/23/83/1133632383.db2.gz LRYYOFMFSLKINA-ZDUSSCGKSA-N 1 3 274.433 3.523 20 0 CHADHO N[C@H]1CCCC[N@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001205932293 1133633243 /nfs/dbraw/zinc/63/32/43/1133633243.db2.gz PZCMJOXNQOWKCU-HNNXBMFYSA-N 1 3 294.398 3.899 20 0 CHADHO N[C@H]1CCCC[N@@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001205932293 1133633245 /nfs/dbraw/zinc/63/32/45/1133633245.db2.gz PZCMJOXNQOWKCU-HNNXBMFYSA-N 1 3 294.398 3.899 20 0 CHADHO Cc1ccc(F)c(CN2CCC[C@@H](C[NH3+])[C@H](C)C2)c1Cl ZINC001205992086 1133639112 /nfs/dbraw/zinc/63/91/12/1133639112.db2.gz DKHSBJHTCABDMH-OLZOCXBDSA-N 1 3 298.833 3.594 20 0 CHADHO C[C@H]1CNCCC[N@@H+]1Cc1ccccc1-c1ccccc1 ZINC001206263213 1133678742 /nfs/dbraw/zinc/67/87/42/1133678742.db2.gz ROAPNHZEFBUYQB-INIZCTEOSA-N 1 3 280.415 3.537 20 0 CHADHO C[C@H]1CNCCC[N@H+]1Cc1ccccc1-c1ccccc1 ZINC001206263213 1133678745 /nfs/dbraw/zinc/67/87/45/1133678745.db2.gz ROAPNHZEFBUYQB-INIZCTEOSA-N 1 3 280.415 3.537 20 0 CHADHO C[C@@H]1CNCC[N@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001206276755 1133680756 /nfs/dbraw/zinc/68/07/56/1133680756.db2.gz HZMPCSBEHDTPJK-OAHLLOKOSA-N 1 3 298.405 3.534 20 0 CHADHO C[C@@H]1CNCC[N@@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001206276755 1133680759 /nfs/dbraw/zinc/68/07/59/1133680759.db2.gz HZMPCSBEHDTPJK-OAHLLOKOSA-N 1 3 298.405 3.534 20 0 CHADHO CC(C)[N@H+](CCCc1cccc(F)c1)[C@H]1CCCNCC1 ZINC001206584370 1133721636 /nfs/dbraw/zinc/72/16/36/1133721636.db2.gz YSFDVUAFLHNADB-SFHVURJKSA-N 1 3 292.442 3.611 20 0 CHADHO CC(C)[N@@H+](CCCc1cccc(F)c1)[C@H]1CCCNCC1 ZINC001206584370 1133721638 /nfs/dbraw/zinc/72/16/38/1133721638.db2.gz YSFDVUAFLHNADB-SFHVURJKSA-N 1 3 292.442 3.611 20 0 CHADHO NC[C@@H]1CCCC[N@H+](C[C@@H]2C[C@@H]2c2ccc(Cl)cc2)C1 ZINC001206606559 1133726742 /nfs/dbraw/zinc/72/67/42/1133726742.db2.gz PHFGOPMOCPKKKX-JLJPHGGASA-N 1 3 292.854 3.504 20 0 CHADHO NC[C@@H]1CCCC[N@@H+](C[C@@H]2C[C@@H]2c2ccc(Cl)cc2)C1 ZINC001206606559 1133726746 /nfs/dbraw/zinc/72/67/46/1133726746.db2.gz PHFGOPMOCPKKKX-JLJPHGGASA-N 1 3 292.854 3.504 20 0 CHADHO C[C@@H](CC[N@@H+]1CCCC[C@H](CN)C1)CC(C)(C)C ZINC001206606457 1133727031 /nfs/dbraw/zinc/72/70/31/1133727031.db2.gz NOXNNASPNSHQMX-LSDHHAIUSA-N 1 3 254.462 3.510 20 0 CHADHO C[C@@H](CC[N@H+]1CCCC[C@H](CN)C1)CC(C)(C)C ZINC001206606457 1133727035 /nfs/dbraw/zinc/72/70/35/1133727035.db2.gz NOXNNASPNSHQMX-LSDHHAIUSA-N 1 3 254.462 3.510 20 0 CHADHO C[C@H]1CC[C@H](CN)C[N@@H+]1CC1(c2ccccc2)CCCC1 ZINC001206760533 1133743107 /nfs/dbraw/zinc/74/31/07/1133743107.db2.gz JCRAOKMRKWHCLY-DLBZAZTESA-N 1 3 286.463 3.558 20 0 CHADHO C[C@H]1CC[C@H](CN)C[N@H+]1CC1(c2ccccc2)CCCC1 ZINC001206760533 1133743110 /nfs/dbraw/zinc/74/31/10/1133743110.db2.gz JCRAOKMRKWHCLY-DLBZAZTESA-N 1 3 286.463 3.558 20 0 CHADHO CN(C)CC(C)(C)C[N@@H+]1CC[C@@H](c2ccccc2Cl)C1 ZINC001207285386 1133789039 /nfs/dbraw/zinc/78/90/39/1133789039.db2.gz IXEMXDVMUVIQAU-CQSZACIVSA-N 1 3 294.870 3.717 20 0 CHADHO CN(C)CC(C)(C)C[N@H+]1CC[C@@H](c2ccccc2Cl)C1 ZINC001207285386 1133789045 /nfs/dbraw/zinc/78/90/45/1133789045.db2.gz IXEMXDVMUVIQAU-CQSZACIVSA-N 1 3 294.870 3.717 20 0 CHADHO CC1=CCC[C@@H](C)[C@@H]1CN1CCC([NH2+]C2CCC2)CC1 ZINC001207741751 1133844080 /nfs/dbraw/zinc/84/40/80/1133844080.db2.gz KIAXDVGNRSLJPQ-CRAIPNDOSA-N 1 3 276.468 3.585 20 0 CHADHO CCN(CC)CC[C@H]([NH2+][C@H]1CC[C@@H]1C)c1ccccc1 ZINC001207805837 1133849668 /nfs/dbraw/zinc/84/96/68/1133849668.db2.gz KZKUQGIVZBIOQB-SZMVWBNQSA-N 1 3 274.452 3.848 20 0 CHADHO Cc1ccc([C@H](C)[NH2+]C2CCN(CC3CC3)CC2)cc1F ZINC000165605421 1133871829 /nfs/dbraw/zinc/87/18/29/1133871829.db2.gz ADAIUCZXUCACHP-AWEZNQCLSA-N 1 3 290.426 3.659 20 0 CHADHO C[C@@H]1CN(CC2(C[NH+](C)C)CCCC2)Cc2ccccc21 ZINC001208184147 1133901685 /nfs/dbraw/zinc/90/16/85/1133901685.db2.gz KLCVKXXISXTNIQ-MRXNPFEDSA-N 1 3 286.463 3.728 20 0 CHADHO CN(CC1(C[NH+](C)C)CCCC1)[C@H]1CCc2ccccc21 ZINC001208189671 1133903263 /nfs/dbraw/zinc/90/32/63/1133903263.db2.gz YCRZMHYQGSWGOS-SFHVURJKSA-N 1 3 286.463 3.728 20 0 CHADHO CCN(Cc1cccc(Cl)c1)C[C@@H]1CCC[N@H+](C)C1 ZINC001208616994 1133919829 /nfs/dbraw/zinc/91/98/29/1133919829.db2.gz LTMAVWMUFNLCBB-OAHLLOKOSA-N 1 3 280.843 3.504 20 0 CHADHO CCN(Cc1cccc(Cl)c1)C[C@@H]1CCC[N@@H+](C)C1 ZINC001208616994 1133919831 /nfs/dbraw/zinc/91/98/31/1133919831.db2.gz LTMAVWMUFNLCBB-OAHLLOKOSA-N 1 3 280.843 3.504 20 0 CHADHO c1ccc(C[N@H+]2CC[C@H](CN3CC[C@H]4CCC[C@H]4C3)C2)cc1 ZINC001208943221 1133965928 /nfs/dbraw/zinc/96/59/28/1133965928.db2.gz SAPYMXCAWBJYSB-ZCNNSNEGSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(C[N@@H+]2CC[C@H](CN3CC[C@H]4CCC[C@H]4C3)C2)cc1 ZINC001208943221 1133965936 /nfs/dbraw/zinc/96/59/36/1133965936.db2.gz SAPYMXCAWBJYSB-ZCNNSNEGSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(CN2CC[C@H](C[N@@H+]3CC[C@H]4CCC[C@H]4C3)C2)cc1 ZINC001208943221 1133965938 /nfs/dbraw/zinc/96/59/38/1133965938.db2.gz SAPYMXCAWBJYSB-ZCNNSNEGSA-N 1 3 298.474 3.631 20 0 CHADHO c1ccc(CN2CC[C@H](C[N@H+]3CC[C@H]4CCC[C@H]4C3)C2)cc1 ZINC001208943221 1133965946 /nfs/dbraw/zinc/96/59/46/1133965946.db2.gz SAPYMXCAWBJYSB-ZCNNSNEGSA-N 1 3 298.474 3.631 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@@H+]1CCc1cccs1 ZINC001209227103 1133991608 /nfs/dbraw/zinc/99/16/08/1133991608.db2.gz JAVFVTDFBAFHNK-JKSUJKDBSA-N 1 3 292.492 3.629 20 0 CHADHO CN1CCC[C@H]1C[C@H]1CCCC[N@H+]1CCc1cccs1 ZINC001209227103 1133991612 /nfs/dbraw/zinc/99/16/12/1133991612.db2.gz JAVFVTDFBAFHNK-JKSUJKDBSA-N 1 3 292.492 3.629 20 0 CHADHO Cc1nc2ccc(Nc3cc[nH+]c(N4CCCC4)c3)cc2[nH]1 ZINC001213072453 1134421299 /nfs/dbraw/zinc/42/12/99/1134421299.db2.gz UQRKDAVPPHERAO-UHFFFAOYSA-N 1 3 293.374 3.610 20 0 CHADHO Cc1c(Cl)cccc1CN1CCC[C@@]12CCC[NH2+]CC2 ZINC001222321362 1135225362 /nfs/dbraw/zinc/22/53/62/1135225362.db2.gz UFRWHSQOBWUMTR-QGZVFWFLSA-N 1 3 292.854 3.757 20 0 CHADHO CC[C@H](N[C@@H]1CCC[C@H]([NH+](C)C)C1)c1cccc(C)c1 ZINC000353525787 529657690 /nfs/dbraw/zinc/65/76/90/529657690.db2.gz ZEWIBWPEGSGPNQ-SQNIBIBYSA-N 1 3 274.452 3.909 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCC[C@H](N(C)C)C1)c1cccc(C)c1 ZINC000353525787 529657694 /nfs/dbraw/zinc/65/76/94/529657694.db2.gz ZEWIBWPEGSGPNQ-SQNIBIBYSA-N 1 3 274.452 3.909 20 0 CHADHO CC[C@H](NCC(C)(C)C[NH+](C)C)c1ccc(C)cc1 ZINC000019905853 170917410 /nfs/dbraw/zinc/91/74/10/170917410.db2.gz BSKVDIHIPXFSSO-INIZCTEOSA-N 1 3 262.441 3.624 20 0 CHADHO CC1(C)CC([NH2+]C2CCCCCC2)CC(C)(C)N1 ZINC000020143106 171029199 /nfs/dbraw/zinc/02/91/99/171029199.db2.gz XJGLVTYXAMYZIN-UHFFFAOYSA-N 1 3 252.446 3.608 20 0 CHADHO CCC[C@H](NC1CC[NH+](CCC)CC1)c1ccccc1 ZINC000020190019 171056986 /nfs/dbraw/zinc/05/69/86/171056986.db2.gz OHCLFWFFQURUGL-SFHVURJKSA-N 1 3 274.452 3.992 20 0 CHADHO CC[C@@H](NCCC[NH+]1CCCCC1)c1ccccc1 ZINC000020547767 171245138 /nfs/dbraw/zinc/24/51/38/171245138.db2.gz SSCKQXVUGLKJKX-QGZVFWFLSA-N 1 3 260.425 3.603 20 0 CHADHO Cc1ccccc1CNC[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000192917295 227383346 /nfs/dbraw/zinc/38/33/46/227383346.db2.gz KEWMOWWHCKESKH-IBGZPJMESA-N 1 3 294.442 3.607 20 0 CHADHO Cc1ccccc1CNC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192917295 227383351 /nfs/dbraw/zinc/38/33/51/227383351.db2.gz KEWMOWWHCKESKH-IBGZPJMESA-N 1 3 294.442 3.607 20 0 CHADHO C[C@@H]([NH3+])[C@H]1CCCN(Cc2cccc(-c3ccccc3)c2)C1 ZINC000347045669 226026626 /nfs/dbraw/zinc/02/66/26/226026626.db2.gz NVFQACYZBBMNPR-UZLBHIALSA-N 1 3 294.442 3.913 20 0 CHADHO CC[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(C)cc1 ZINC000037048147 260065863 /nfs/dbraw/zinc/06/58/63/260065863.db2.gz PTUGUJFWLZWPPQ-HQSKLWIPSA-N 1 3 272.436 3.661 20 0 CHADHO CC[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(C)cc1 ZINC000037048147 260065865 /nfs/dbraw/zinc/06/58/65/260065865.db2.gz PTUGUJFWLZWPPQ-HQSKLWIPSA-N 1 3 272.436 3.661 20 0 CHADHO CC[C@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1cccc(Cl)c1 ZINC000037649103 260115385 /nfs/dbraw/zinc/11/53/85/260115385.db2.gz CPWICGKPQTUAFJ-DYVFJYSZSA-N 1 3 292.854 3.865 20 0 CHADHO CC[C@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1cccc(Cl)c1 ZINC000037649103 260115386 /nfs/dbraw/zinc/11/53/86/260115386.db2.gz CPWICGKPQTUAFJ-DYVFJYSZSA-N 1 3 292.854 3.865 20 0 CHADHO CC[C@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(Cl)cc1 ZINC000037649139 260115602 /nfs/dbraw/zinc/11/56/02/260115602.db2.gz MBWCJTLJAHBZCI-GUYCJALGSA-N 1 3 292.854 3.865 20 0 CHADHO CC[C@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1 ZINC000037649139 260115604 /nfs/dbraw/zinc/11/56/04/260115604.db2.gz MBWCJTLJAHBZCI-GUYCJALGSA-N 1 3 292.854 3.865 20 0 CHADHO C[NH2+]CCC1CCN([C@H](C)c2cccc(Cl)c2)CC1 ZINC000070188786 260153834 /nfs/dbraw/zinc/15/38/34/260153834.db2.gz YDZRFXQKTIMCJF-CYBMUJFWSA-N 1 3 280.843 3.723 20 0 CHADHO C[C@H]1CCC[C@@H](C[NH2+]C2CCN(C(C)(C)C)CC2)C1 ZINC000089608412 260189833 /nfs/dbraw/zinc/18/98/33/260189833.db2.gz SQIDHMBLBXWCFR-LSDHHAIUSA-N 1 3 266.473 3.665 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)Cc1ccc(Cl)cc1)CN1CCCC1 ZINC000223033874 260260523 /nfs/dbraw/zinc/26/05/23/260260523.db2.gz AYTRKHLKUKLMEQ-CABCVRRESA-N 1 3 294.870 3.593 20 0 CHADHO CSc1ccc([C@H](C)N[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000091959901 260267221 /nfs/dbraw/zinc/26/72/21/260267221.db2.gz LJMYAGNKCUUPPZ-YDHLFZDLSA-N 1 3 278.465 3.542 20 0 CHADHO CSc1ccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000091959901 260267222 /nfs/dbraw/zinc/26/72/22/260267222.db2.gz LJMYAGNKCUUPPZ-YDHLFZDLSA-N 1 3 278.465 3.542 20 0 CHADHO CC(C)C[C@H](N[C@H]1CCC[C@H]([NH3+])C1)c1ccccc1 ZINC000093212575 260273196 /nfs/dbraw/zinc/27/31/96/260273196.db2.gz VNFHCCKORQPFBW-ULQDDVLXSA-N 1 3 260.425 3.633 20 0 CHADHO CCC[C@H]([NH2+][C@@H]1CCN2CCC[C@H]2C1)C1CCCC1 ZINC000313428951 260293144 /nfs/dbraw/zinc/29/31/44/260293144.db2.gz OSANKKKQJWFYAB-IKGGRYGDSA-N 1 3 264.457 3.562 20 0 CHADHO C[C@H](NCCCC[N@@H+]1CCCC[C@H]1C)c1ccco1 ZINC000157890936 261154530 /nfs/dbraw/zinc/15/45/30/261154530.db2.gz ULWIRZDMIORSBA-CABCVRRESA-N 1 3 264.413 3.585 20 0 CHADHO C[C@H](NCCCC[N@H+]1CCCC[C@H]1C)c1ccco1 ZINC000157890936 261154532 /nfs/dbraw/zinc/15/45/32/261154532.db2.gz ULWIRZDMIORSBA-CABCVRRESA-N 1 3 264.413 3.585 20 0 CHADHO CC[N@H+](C)Cc1cccc(CN[C@H](C)c2cncc(C)c2)c1 ZINC000184344432 262017500 /nfs/dbraw/zinc/01/75/00/262017500.db2.gz WKXOQWVBZWHSJG-MRXNPFEDSA-N 1 3 297.446 3.693 20 0 CHADHO CC[N@@H+](C)Cc1cccc(CN[C@H](C)c2cncc(C)c2)c1 ZINC000184344432 262017502 /nfs/dbraw/zinc/01/75/02/262017502.db2.gz WKXOQWVBZWHSJG-MRXNPFEDSA-N 1 3 297.446 3.693 20 0 CHADHO CCC[NH2+][C@@H]1CCCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21 ZINC000514085698 262159878 /nfs/dbraw/zinc/15/98/78/262159878.db2.gz WQXFPZSTEQYWJL-CEXWTWQISA-N 1 3 286.463 3.677 20 0 CHADHO CCC[NH2+][C@@H]1CCCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 ZINC000514085700 262159915 /nfs/dbraw/zinc/15/99/15/262159915.db2.gz WQXFPZSTEQYWJL-GUDVDZBRSA-N 1 3 286.463 3.677 20 0 CHADHO C[C@H](CCCC[NH3+])N[C@@H](C)c1ccccc1Cl ZINC000310566613 262167119 /nfs/dbraw/zinc/16/71/19/262167119.db2.gz XUQCODZHCSMJRC-NEPJUHHUSA-N 1 3 254.805 3.508 20 0 CHADHO C[C@H](CCCC[NH3+])N[C@H](C)c1ccccc1Cl ZINC000310566616 262167124 /nfs/dbraw/zinc/16/71/24/262167124.db2.gz XUQCODZHCSMJRC-VXGBXAGGSA-N 1 3 254.805 3.508 20 0 CHADHO CCN(CC)CCC[NH2+][C@@H](C)c1ccc(C)cc1C ZINC000019943097 262181413 /nfs/dbraw/zinc/18/14/13/262181413.db2.gz WSOQOJRXCHNUIM-INIZCTEOSA-N 1 3 262.441 3.686 20 0 CHADHO CC(C)C[C@H](C)C[NH2+][C@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000499627019 262204715 /nfs/dbraw/zinc/20/47/15/262204715.db2.gz RETPPRISYJQMIG-BBWFWOEESA-N 1 3 280.500 3.911 20 0 CHADHO CC[NH+](CC)CCC[C@H](C)NCc1ccccc1Cl ZINC000019914649 262205995 /nfs/dbraw/zinc/20/59/95/262205995.db2.gz FTBIFQYGXIJSNE-AWEZNQCLSA-N 1 3 282.859 3.940 20 0 CHADHO CN1CCC[C@H]1CC[N@@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000502721299 262225912 /nfs/dbraw/zinc/22/59/12/262225912.db2.gz IPDYHIFIXGMJKG-IRXDYDNUSA-N 1 3 292.854 3.961 20 0 CHADHO CN1CCC[C@H]1CC[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000502721299 262225914 /nfs/dbraw/zinc/22/59/14/262225914.db2.gz IPDYHIFIXGMJKG-IRXDYDNUSA-N 1 3 292.854 3.961 20 0 CHADHO Cc1ccc([C@@H](C)NC2CC[NH+](C(C)C)CC2)c(C)c1 ZINC000020189235 262233135 /nfs/dbraw/zinc/23/31/35/262233135.db2.gz NVLPNQNFNNIYLR-MRXNPFEDSA-N 1 3 274.452 3.827 20 0 CHADHO C[C@H]([NH2+]CCCN1CCCC1)c1ccc2ccccc2c1 ZINC000021013865 262374084 /nfs/dbraw/zinc/37/40/84/262374084.db2.gz YTMJVMLFXYDYNE-INIZCTEOSA-N 1 3 282.431 3.976 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCCc2sccc21)CN1CCCCC1 ZINC000061328596 262393973 /nfs/dbraw/zinc/39/39/73/262393973.db2.gz SBNWULZJBKEQLP-GDBMZVCRSA-N 1 3 292.492 3.837 20 0 CHADHO C[C@H]1CCCCN1CCC[NH2+][C@@H]1CCCc2sccc21 ZINC000061324534 262393988 /nfs/dbraw/zinc/39/39/88/262393988.db2.gz YFBSIWLQXVZCIZ-GOEBONIOSA-N 1 3 292.492 3.980 20 0 CHADHO CC1CCN(CCC[NH2+][C@@H]2CCCc3sccc32)CC1 ZINC000061325287 262394249 /nfs/dbraw/zinc/39/42/49/262394249.db2.gz FJHBOPQHCZDIOY-MRXNPFEDSA-N 1 3 292.492 3.837 20 0 CHADHO CC(C)(C)N1CCC([NH2+][C@H]2CCCc3sccc32)CC1 ZINC000061328477 262394377 /nfs/dbraw/zinc/39/43/77/262394377.db2.gz OUQQUSGCLMMFIQ-HNNXBMFYSA-N 1 3 292.492 3.978 20 0 CHADHO CC(C)(C)N1CCC([NH2+]C[C@H]2CCC[C@@H]2C2CC2)CC1 ZINC000414207159 262824648 /nfs/dbraw/zinc/82/46/48/262824648.db2.gz ZENXGGYHNWJDTQ-NVXWUHKLSA-N 1 3 278.484 3.665 20 0 CHADHO [NH3+]CCCN1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000414700011 263033219 /nfs/dbraw/zinc/03/32/19/263033219.db2.gz ULMNYNKIVKUPRL-CQSZACIVSA-N 1 3 286.341 3.581 20 0 CHADHO CC(C)C[C@@H](Cc1cccc(Cl)c1)[NH2+]C1CCNCC1 ZINC000414783315 263046957 /nfs/dbraw/zinc/04/69/57/263046957.db2.gz QMVJWOFTGZZMIM-KRWDZBQOSA-N 1 3 294.870 3.639 20 0 CHADHO C[C@H](C[NH2+][C@@H]1CCCC[C@H]1CN)c1cccc(Cl)c1 ZINC000414791461 263048977 /nfs/dbraw/zinc/04/89/77/263048977.db2.gz BFQPZZTZMOXGOS-IVMMDQJWSA-N 1 3 280.843 3.551 20 0 CHADHO CCc1ccc(CNCc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000414809760 263052351 /nfs/dbraw/zinc/05/23/51/263052351.db2.gz NBAPSOGMCSRNJV-CQSZACIVSA-N 1 3 268.404 3.559 20 0 CHADHO CCC([NH3+])(CC)CN[C@H]1CCC[C@@H]1c1ccc(F)cc1 ZINC000414813855 263053187 /nfs/dbraw/zinc/05/31/87/263053187.db2.gz URHDBDUTEDCLAO-CVEARBPZSA-N 1 3 278.415 3.569 20 0 CHADHO CC(C)C[C@H](C[NH2+][C@@H](C)[C@H]1CCCNC1)c1ccccc1 ZINC000414828040 263056014 /nfs/dbraw/zinc/05/60/14/263056014.db2.gz YTWMZKMZBIQMQA-YTQUADARSA-N 1 3 288.479 3.794 20 0 CHADHO Fc1cc(-c2ccccc2)ccc1CNCC[C@@H]1CC[NH2+]C1 ZINC000414832257 263056613 /nfs/dbraw/zinc/05/66/13/263056613.db2.gz OGMZPBHINWCHKR-HNNXBMFYSA-N 1 3 298.405 3.582 20 0 CHADHO CCC[C@H](CCc1ccccc1)[NH2+][C@H](C)[C@H]1CCCNC1 ZINC000414857857 263074316 /nfs/dbraw/zinc/07/43/16/263074316.db2.gz QIUCOYPFLIRCFF-NZSAHSFTSA-N 1 3 288.479 3.766 20 0 CHADHO N[C@H]1CCC[C@@H]([NH2+]CC2CCC(c3ccccc3)CC2)C1 ZINC000414919390 263123995 /nfs/dbraw/zinc/12/39/95/263123995.db2.gz UROYYNVHCMRBAK-SOTJZCEJSA-N 1 3 286.463 3.820 20 0 CHADHO C[C@@H]1CNCC[C@H]1[NH2+]Cc1ccc(-c2ccccc2)s1 ZINC000414959646 263164953 /nfs/dbraw/zinc/16/49/53/263164953.db2.gz QALNFRAQGAQKHG-CZUORRHYSA-N 1 3 286.444 3.503 20 0 CHADHO [NH3+]CCC[C@H](NCc1cccc(Cl)c1)c1ccccc1 ZINC000415047109 263257977 /nfs/dbraw/zinc/25/79/77/263257977.db2.gz DUALPBSMWXEWIM-KRWDZBQOSA-N 1 3 288.822 3.910 20 0 CHADHO [NH3+]CCC[C@@H](NCc1cc(F)cc(F)c1)c1ccccc1 ZINC000415056735 263259016 /nfs/dbraw/zinc/25/90/16/263259016.db2.gz QMMXSROSHAYNHN-QGZVFWFLSA-N 1 3 290.357 3.535 20 0 CHADHO CC(C)(C)CC[NH2+]C[C@H]1CCN(CCc2ccccc2)C1 ZINC000187816851 263269513 /nfs/dbraw/zinc/26/95/13/263269513.db2.gz KPSNRJSVHKQDRN-GOSISDBHSA-N 1 3 288.479 3.577 20 0 CHADHO CCSc1ccccc1[C@@H](C)[NH2+]C[C@@H](C)CN(C)C ZINC000425952057 264070662 /nfs/dbraw/zinc/07/06/62/264070662.db2.gz RPGSMIPQGUTECH-ZIAGYGMSSA-N 1 3 280.481 3.647 20 0 CHADHO CC[C@@H](N[C@H]1CCC[NH2+]CC1)c1cccc(Cl)c1 ZINC000128966016 264313158 /nfs/dbraw/zinc/31/31/58/264313158.db2.gz ZLIRQICGGLWRHV-LSDHHAIUSA-N 1 3 266.816 3.523 20 0 CHADHO C[N@H+](CCCN[C@H]1CC(C)(C)OC1(C)C)C1CCCCC1 ZINC000094423979 265243163 /nfs/dbraw/zinc/24/31/63/265243163.db2.gz PEQDHFIBLIEMKH-INIZCTEOSA-N 1 3 296.499 3.577 20 0 CHADHO C[N@@H+](CCCN[C@H]1CC(C)(C)OC1(C)C)C1CCCCC1 ZINC000094423979 265243167 /nfs/dbraw/zinc/24/31/67/265243167.db2.gz PEQDHFIBLIEMKH-INIZCTEOSA-N 1 3 296.499 3.577 20 0 CHADHO CC(C)(C)[C@H]1C[C@H](NC2CC([NH+]3CCCCC3)C2)CS1 ZINC000369671082 267258175 /nfs/dbraw/zinc/25/81/75/267258175.db2.gz ROLSTCNGPMLYRB-BHDPWAOGSA-N 1 3 296.524 3.513 20 0 CHADHO COc1ccccc1-c1ccc(CN[C@H](C)C[C@@H](C)[NH3+])cc1 ZINC000575181196 327866186 /nfs/dbraw/zinc/86/61/86/327866186.db2.gz UDJSCKVMPYNGCZ-HUUCEWRRSA-N 1 3 298.430 3.578 20 0 CHADHO CCN1CC[C@@H]([NH2+]Cc2ccc(-c3ccccc3)o2)[C@H](C)C1 ZINC000531683889 328021063 /nfs/dbraw/zinc/02/10/63/328021063.db2.gz SEJBQIMSLBZVEA-CRAIPNDOSA-N 1 3 298.430 3.767 20 0 CHADHO CN1CCC[C@@H]1CC[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000534019864 328033097 /nfs/dbraw/zinc/03/30/97/328033097.db2.gz LTGOTTGCWSGMFB-RHSMWYFYSA-N 1 3 292.854 3.961 20 0 CHADHO CN1CCC[C@@H]1CC[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000534019864 328033098 /nfs/dbraw/zinc/03/30/98/328033098.db2.gz LTGOTTGCWSGMFB-RHSMWYFYSA-N 1 3 292.854 3.961 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000414946064 328279072 /nfs/dbraw/zinc/27/90/72/328279072.db2.gz SJSOQGHUOAGXIL-VDNDLQMASA-N 1 3 292.854 3.564 20 0 CHADHO Cc1cccc2c1[C@@H](C)C[C@H]2NC1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000296064926 328288828 /nfs/dbraw/zinc/28/88/28/328288828.db2.gz WESDGZPMESYEEW-XTOXLMAPSA-N 1 3 284.447 3.758 20 0 CHADHO Cc1cccc2c1[C@@H](C)C[C@H]2NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000296064926 328288830 /nfs/dbraw/zinc/28/88/30/328288830.db2.gz WESDGZPMESYEEW-XTOXLMAPSA-N 1 3 284.447 3.758 20 0 CHADHO C[C@@H](N)[C@@H](C)[NH2+]Cc1ccc(-c2ccccc2Cl)s1 ZINC000415011895 328298459 /nfs/dbraw/zinc/29/84/59/328298459.db2.gz RJNICVIIJMXFKK-GHMZBOCLSA-N 1 3 294.851 3.894 20 0 CHADHO CCc1ccc(CN2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000506890254 332781480 /nfs/dbraw/zinc/78/14/80/332781480.db2.gz KWWLUCPBRUWYGP-UHFFFAOYSA-N 1 3 286.463 3.557 20 0 CHADHO C[NH+](C)CC1CCN(Cc2ccc(C(C)(C)C)s2)CC1 ZINC000506933327 332782198 /nfs/dbraw/zinc/78/21/98/332782198.db2.gz WLBGLKVNFZGSCX-UHFFFAOYSA-N 1 3 294.508 3.819 20 0 CHADHO c1ccc2c(c1)cccc2CN[C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000262063955 327128693 /nfs/dbraw/zinc/12/86/93/327128693.db2.gz FIAHUVNZWQACRY-VAMGGRTRSA-N 1 3 294.442 3.850 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC000536496437 327241501 /nfs/dbraw/zinc/24/15/01/327241501.db2.gz GZRZJOZVFBDJPR-CXAGYDPISA-N 1 3 292.854 3.649 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC000536496437 327241502 /nfs/dbraw/zinc/24/15/02/327241502.db2.gz GZRZJOZVFBDJPR-CXAGYDPISA-N 1 3 292.854 3.649 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC000536496437 327241503 /nfs/dbraw/zinc/24/15/03/327241503.db2.gz GZRZJOZVFBDJPR-CXAGYDPISA-N 1 3 292.854 3.649 20 0 CHADHO C[C@H](C[NH2+][C@@H](C)c1ccc(F)c2ccccc21)CN(C)C ZINC000559859998 327265616 /nfs/dbraw/zinc/26/56/16/327265616.db2.gz VYBNDWCJZDMRLR-KGLIPLIRSA-N 1 3 288.410 3.827 20 0 CHADHO C[C@H](CN[C@@H](C)c1ccc(F)c2ccccc21)C[NH+](C)C ZINC000559859998 327265617 /nfs/dbraw/zinc/26/56/17/327265617.db2.gz VYBNDWCJZDMRLR-KGLIPLIRSA-N 1 3 288.410 3.827 20 0 CHADHO CC[C@H]1CC[C@H]1[NH2+]CC1CCN(Cc2cccs2)CC1 ZINC000562019475 327440500 /nfs/dbraw/zinc/44/05/00/327440500.db2.gz LJNOMVONVSKVFS-DOTOQJQBSA-N 1 3 292.492 3.738 20 0 CHADHO CC[C@H](Cc1ccccc1)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000116382630 328693879 /nfs/dbraw/zinc/69/38/79/328693879.db2.gz WDXNPCYMJXYTBE-MRXNPFEDSA-N 1 3 288.479 3.907 20 0 CHADHO CCC[C@H]([NH2+]CC1(CN(C)C)CCCC1)c1cccnc1 ZINC000183950591 329254994 /nfs/dbraw/zinc/25/49/94/329254994.db2.gz YWXVNSNPULMENH-KRWDZBQOSA-N 1 3 289.467 3.634 20 0 CHADHO C[C@H]([NH2+][C@H]1CCC[C@@H](N(C)C)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000583131559 329318933 /nfs/dbraw/zinc/31/89/33/329318933.db2.gz SWQGEOYVNMMIDD-UJCHZGTJSA-N 1 3 286.463 3.641 20 0 CHADHO CN(C)Cc1ccc(C[NH2+][C@H]2CCC23CCCC3)cc1 ZINC000189045492 329375179 /nfs/dbraw/zinc/37/51/79/329375179.db2.gz XPMNKIGRDRSGKS-KRWDZBQOSA-N 1 3 272.436 3.561 20 0 CHADHO CC(C)C[C@@H](CN1CCC2(CC[NH2+]2)CC1)c1ccccc1 ZINC000422561197 330149349 /nfs/dbraw/zinc/14/93/49/330149349.db2.gz JRZLYYQGTTVRQX-SFHVURJKSA-N 1 3 286.463 3.644 20 0 CHADHO Cc1ccccc1[C@H](CC(C)C)NC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422705426 330151213 /nfs/dbraw/zinc/15/12/13/330151213.db2.gz BWXVPXCVPLCGLE-RZRMAFQFSA-N 1 3 286.463 3.955 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@@H]1CCCC[C@H]1C(C)C ZINC000422708669 330151470 /nfs/dbraw/zinc/15/14/70/330151470.db2.gz CEWSQDCMCVLUIG-QILLFSRXSA-N 1 3 289.467 3.714 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+][C@H](C)CCCC(C)C ZINC000422734168 330152859 /nfs/dbraw/zinc/15/28/59/330152859.db2.gz SCWPHHFGXBHQDY-KGLIPLIRSA-N 1 3 277.456 3.714 20 0 CHADHO C[C@@H](CCC[NH3+])N[C@@H](C)c1cccc(Cl)c1Cl ZINC000422756310 330153521 /nfs/dbraw/zinc/15/35/21/330153521.db2.gz HUNFVJFCDVAAFJ-UWVGGRQHSA-N 1 3 275.223 3.771 20 0 CHADHO Cc1ccc(SCC[NH2+][C@@H]2C[C@H](N)c3ccccc32)cc1 ZINC000422764723 330153894 /nfs/dbraw/zinc/15/38/94/330153894.db2.gz KIPRGALDXYYATQ-ZWKOTPCHSA-N 1 3 298.455 3.822 20 0 CHADHO Cc1ccc([C@@H](C)C[NH2+][C@@H](C)c2ccc(CN)nc2C)cc1 ZINC000422760666 330154059 /nfs/dbraw/zinc/15/40/59/330154059.db2.gz LCDDUKBESJDTNY-GJZGRUSLSA-N 1 3 297.446 3.611 20 0 CHADHO Cc1ccc([C@H](C)CN[C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000422766827 330154222 /nfs/dbraw/zinc/15/42/22/330154222.db2.gz QIGIIYADWWVGEE-NXWXRZEISA-N 1 3 286.463 3.609 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]CC1(c2cccs2)CCCCC1 ZINC000422772738 330154312 /nfs/dbraw/zinc/15/43/12/330154312.db2.gz XQMYOTZBQDCIBB-UONOGXRCSA-N 1 3 280.481 3.665 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCC1(c2cccs2)CCCCC1 ZINC000422772738 330154314 /nfs/dbraw/zinc/15/43/14/330154314.db2.gz XQMYOTZBQDCIBB-UONOGXRCSA-N 1 3 280.481 3.665 20 0 CHADHO c1ccc([C@H](NC2C[C@H]3CC[C@@H](C2)[NH2+]3)C2CCCC2)cc1 ZINC000422778785 330154495 /nfs/dbraw/zinc/15/44/95/330154495.db2.gz HUJDSMTWDZTKEB-SWDXFRIISA-N 1 3 284.447 3.791 20 0 CHADHO CCCC[C@H](CC)C[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000422743682 330155319 /nfs/dbraw/zinc/15/53/19/330155319.db2.gz IYHKMYKRWKVWQI-ZFWWWQNUSA-N 1 3 277.456 3.716 20 0 CHADHO Cc1cc(C)cc(CCN[C@@H]2C[C@H]([NH3+])c3ccccc32)c1 ZINC000422794270 330155586 /nfs/dbraw/zinc/15/55/86/330155586.db2.gz YYHIGYQZHSRSSD-RBUKOAKNSA-N 1 3 280.415 3.580 20 0 CHADHO CC[C@@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)C(C)(C)c1ccccc1 ZINC000422793386 330155608 /nfs/dbraw/zinc/15/56/08/330155608.db2.gz YDBFJIJQGUOBMA-UJJTZGENSA-N 1 3 286.463 3.615 20 0 CHADHO CC(C)[C@H](C[NH2+][C@H]1CCCC[C@@H]1CN)c1ccccc1 ZINC000422808751 330155896 /nfs/dbraw/zinc/15/58/96/330155896.db2.gz LLKLJEOFLFFMFB-SQNIBIBYSA-N 1 3 274.452 3.533 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](C)c1ccc(-c2ccncc2)cc1 ZINC000422804256 330156035 /nfs/dbraw/zinc/15/60/35/330156035.db2.gz FAHVYACSAMWVLX-KKUMJFAQSA-N 1 3 283.419 3.525 20 0 CHADHO CC(C)[C@H](CN[C@@H]1C[C@@H]([NH3+])c2ccccc21)c1cccnc1 ZINC000422835549 330156790 /nfs/dbraw/zinc/15/67/90/330156790.db2.gz PPLFDFCPLFDHDB-IPMKNSEASA-N 1 3 295.430 3.556 20 0 CHADHO CC(C)[C@H](CN[C@H]1C[C@H]([NH3+])c2ccccc21)c1cccnc1 ZINC000422835547 330156978 /nfs/dbraw/zinc/15/69/78/330156978.db2.gz PPLFDFCPLFDHDB-FHWLQOOXSA-N 1 3 295.430 3.556 20 0 CHADHO Cc1nc(CN)ccc1[C@@H](C)[NH2+]CC[C@@H](C)c1ccccc1 ZINC000422849922 330157508 /nfs/dbraw/zinc/15/75/08/330157508.db2.gz MOEFYJJCDGDCJT-HUUCEWRRSA-N 1 3 297.446 3.693 20 0 CHADHO C[C@H]([NH3+])C[C@H](C)N[C@@H](C)Cc1ccc(Cl)cc1Cl ZINC000422864867 330158150 /nfs/dbraw/zinc/15/81/50/330158150.db2.gz WPHWWYONDHPRPY-DCAQKATOSA-N 1 3 289.250 3.640 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@@H](C)Cc1ccc(Cl)cc1Cl ZINC000422864867 330158152 /nfs/dbraw/zinc/15/81/52/330158152.db2.gz WPHWWYONDHPRPY-DCAQKATOSA-N 1 3 289.250 3.640 20 0 CHADHO C[C@H](N[C@H](c1cccc(F)c1)C1CCCC1)[C@H]1CC[NH2+]C1 ZINC000422873905 330158707 /nfs/dbraw/zinc/15/87/07/330158707.db2.gz MKKQUZZWCMIADP-OWQGQXMQSA-N 1 3 290.426 3.645 20 0 CHADHO c1ccc2c(c1)CC[C@@H]2C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCCN1 ZINC000422910249 330159774 /nfs/dbraw/zinc/15/97/74/330159774.db2.gz PYGMSWZVAGIQOX-VBSBHUPXSA-N 1 3 298.474 3.617 20 0 CHADHO C[C@H](C[C@H](C)N)[NH2+]CC1(c2cccc(F)c2)CCCCC1 ZINC000422908387 330159795 /nfs/dbraw/zinc/15/97/95/330159795.db2.gz YJIICGFPKOPBOQ-LSDHHAIUSA-N 1 3 292.442 3.743 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])NCC1(c2cccc(F)c2)CCCCC1 ZINC000422908387 330159797 /nfs/dbraw/zinc/15/97/97/330159797.db2.gz YJIICGFPKOPBOQ-LSDHHAIUSA-N 1 3 292.442 3.743 20 0 CHADHO c1ccc2c(c1)CC[C@@H]2C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCCN1 ZINC000422910248 330159913 /nfs/dbraw/zinc/15/99/13/330159913.db2.gz PYGMSWZVAGIQOX-RSPOEFSDSA-N 1 3 298.474 3.617 20 0 CHADHO [NH3+][C@@H]1C[C@@H](N[C@@H](Cc2ccccc2)C2CC2)c2ccccc21 ZINC000422914706 330160384 /nfs/dbraw/zinc/16/03/84/330160384.db2.gz VOVLXUFSVDZBOG-HSALFYBXSA-N 1 3 292.426 3.742 20 0 CHADHO Cc1cccc(C)c1CCN[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422925219 330160966 /nfs/dbraw/zinc/16/09/66/330160966.db2.gz AQJXEMMSGRONTQ-OALUTQOASA-N 1 3 280.415 3.580 20 0 CHADHO c1ccc(CC2(CN[C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)CC2)cc1 ZINC000422998906 330163559 /nfs/dbraw/zinc/16/35/59/330163559.db2.gz RPPZIFZHZSSZNY-GUDVDZBRSA-N 1 3 298.474 3.520 20 0 CHADHO C[C@@H](CCC[NH3+])NC1(c2c(Cl)cccc2Cl)CC1 ZINC000422958923 330164291 /nfs/dbraw/zinc/16/42/91/330164291.db2.gz ZLPKMHLRHRGYIP-JTQLQIEISA-N 1 3 287.234 3.700 20 0 CHADHO [NH3+][C@H]1C[C@@H](NCCC2Cc3ccccc3C2)c2ccccc21 ZINC000423017753 330165388 /nfs/dbraw/zinc/16/53/88/330165388.db2.gz WZXYFQBRDKSCFD-VQTJNVASSA-N 1 3 292.426 3.526 20 0 CHADHO C[C@H](N[C@@H]1CCC[NH2+]CC1)c1cc2ccccc2s1 ZINC000423062650 330168064 /nfs/dbraw/zinc/16/80/64/330168064.db2.gz UOXLFFKBDUTLAH-GXTWGEPZSA-N 1 3 274.433 3.694 20 0 CHADHO C1CCC2(CC1)CCC([NH2+][C@H]1CCCNCC1)CC2 ZINC000423066821 330168314 /nfs/dbraw/zinc/16/83/14/330168314.db2.gz FKDQWYXBTYEZOM-HNNXBMFYSA-N 1 3 264.457 3.611 20 0 CHADHO C[C@@H](N)C[C@@H](C)[NH2+]C1CCC2(CCCCC2)CC1 ZINC000423076778 330168521 /nfs/dbraw/zinc/16/85/21/330168521.db2.gz ZSOBFDHLPISNEB-ZIAGYGMSSA-N 1 3 252.446 3.595 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000423084391 330168923 /nfs/dbraw/zinc/16/89/23/330168923.db2.gz HYGTVMLXMNQVQG-LAQRGFTBSA-N 1 3 290.426 3.569 20 0 CHADHO N[C@@H]1C[C@H]([NH2+][C@H]2C[C@H](c3ccccc3F)C2)c2ccccc21 ZINC000423093538 330169583 /nfs/dbraw/zinc/16/95/83/330169583.db2.gz HXLUBQNQBWOBBM-YJZQOORCSA-N 1 3 296.389 3.806 20 0 CHADHO NC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[C@@H](c2ccccc2F)C1 ZINC000423097617 330169928 /nfs/dbraw/zinc/16/99/28/330169928.db2.gz QWQWZSKMHBGDJD-LLDVTBCESA-N 1 3 290.426 3.569 20 0 CHADHO CC1(c2ccccc2)CC(N[C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000423102166 330170345 /nfs/dbraw/zinc/17/03/45/330170345.db2.gz OEFXCLGWBSTMJX-FNNTYFIOSA-N 1 3 298.474 3.617 20 0 CHADHO NC[C@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423105644 330170561 /nfs/dbraw/zinc/17/05/61/330170561.db2.gz ZDNWGOWSTUXPQM-MUIFIZLQSA-N 1 3 292.854 3.693 20 0 CHADHO [NH3+][C@@H]1C[C@@H](NC[C@H]2CCCC(F)(F)C2)c2ccccc21 ZINC000423114576 330170901 /nfs/dbraw/zinc/17/09/01/330170901.db2.gz LSGZYLUUPKQDNE-NILFDRSVSA-N 1 3 280.362 3.546 20 0 CHADHO C[C@H](C[C@H](C)[NH3+])N[C@H](C)c1ccc(F)c2ccccc21 ZINC000423132427 330171785 /nfs/dbraw/zinc/17/17/85/330171785.db2.gz UNZQJEGVSSQPTK-YNEHKIRRSA-N 1 3 274.383 3.755 20 0 CHADHO [NH3+][C@H]1CCCCC[C@@H]1NCCc1cc2ccccc2s1 ZINC000423132575 330171848 /nfs/dbraw/zinc/17/18/48/330171848.db2.gz JIMJTNXGPIGGIF-HOTGVXAUSA-N 1 3 288.460 3.693 20 0 CHADHO C[C@@]1(CN[C@@H]2C[C@H]([NH3+])c3ccccc32)C[C@H]1c1ccccc1 ZINC000423132979 330171925 /nfs/dbraw/zinc/17/19/25/330171925.db2.gz JTUKESQKTGUGOK-HAGHYFMRSA-N 1 3 292.426 3.915 20 0 CHADHO c1ccc([C@@H]2C[C@H]2C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCCN2)cc1 ZINC000423138452 330172328 /nfs/dbraw/zinc/17/23/28/330172328.db2.gz STYZJRVKVNKCIL-LJDSDSDDSA-N 1 3 298.474 3.691 20 0 CHADHO Clc1ccc([C@H]2CCC[C@H]([NH2+]C3CCNCC3)C2)cc1 ZINC000423150799 330172761 /nfs/dbraw/zinc/17/27/61/330172761.db2.gz CJOKIYYXQBHKEF-YOEHRIQHSA-N 1 3 292.854 3.708 20 0 CHADHO Clc1ccc([C@H]2CCC[C@@H]([NH2+]C3CCNCC3)C2)cc1 ZINC000423150798 330172956 /nfs/dbraw/zinc/17/29/56/330172956.db2.gz CJOKIYYXQBHKEF-WMLDXEAASA-N 1 3 292.854 3.708 20 0 CHADHO CCC[C@@H]([NH2+][C@@H](C)c1ccc(CN)nc1C)C(C)(C)C ZINC000423154456 330173298 /nfs/dbraw/zinc/17/32/98/330173298.db2.gz HSYIFTUKHYHFGT-XJKSGUPXSA-N 1 3 277.456 3.714 20 0 CHADHO Cc1ccc(CN[C@H]2CC[NH2+]CC[C@H]2C)c2ccccc12 ZINC000423172106 330174444 /nfs/dbraw/zinc/17/44/44/330174444.db2.gz RIMZWDLAPSDYTK-BEFAXECRSA-N 1 3 282.431 3.626 20 0 CHADHO C[C@H](N)C[C@H](C)[NH2+][C@H]1C[C@H](c2ccccc2)C[C@H](C)C1 ZINC000423174193 330174679 /nfs/dbraw/zinc/17/46/79/330174679.db2.gz BOJKKOKHFOCZFC-OLEVXBPZSA-N 1 3 274.452 3.674 20 0 CHADHO CNCCC[NH2+][C@@H]1CCC[C@H](c2cccc(Cl)c2)C1 ZINC000423199164 330176538 /nfs/dbraw/zinc/17/65/38/330176538.db2.gz JJHWMORVIRBPTL-GOEBONIOSA-N 1 3 280.843 3.565 20 0 CHADHO C[NH2+]CCCN[C@@H]1CCC[C@H](c2cccc(Cl)c2)C1 ZINC000423199164 330176540 /nfs/dbraw/zinc/17/65/40/330176540.db2.gz JJHWMORVIRBPTL-GOEBONIOSA-N 1 3 280.843 3.565 20 0 CHADHO C[C@H](N[C@H]1CC[C@@H](C)c2ccsc21)[C@H]1CCC[NH2+]C1 ZINC000423209971 330177654 /nfs/dbraw/zinc/17/76/54/330177654.db2.gz FQYDVOVESRWIJL-OSFYFWSMSA-N 1 3 278.465 3.664 20 0 CHADHO C[C@H]([NH2+][C@H]1CC[C@@H](C)c2ccsc21)[C@H]1CCCNC1 ZINC000423209971 330177655 /nfs/dbraw/zinc/17/76/55/330177655.db2.gz FQYDVOVESRWIJL-OSFYFWSMSA-N 1 3 278.465 3.664 20 0 CHADHO C[C@@H]([NH2+][C@@H](C)[C@@H]1CCCNC1)[C@H](C)c1ccc(Cl)cc1 ZINC000423219593 330179279 /nfs/dbraw/zinc/17/92/79/330179279.db2.gz UJZHWWZFJKJFNG-KNCOVGOOSA-N 1 3 294.870 3.810 20 0 CHADHO C[C@H](N[C@@H]1CCCc2c3ccccc3[nH]c21)[C@@H]1CCC[NH2+]C1 ZINC000423222070 330179562 /nfs/dbraw/zinc/17/95/62/330179562.db2.gz ZMJZVKKYKFHBOR-PMUMKWKESA-N 1 3 297.446 3.523 20 0 CHADHO C[C@H]([NH2+][C@@H]1CCCc2c3ccccc3[nH]c21)[C@@H]1CCCNC1 ZINC000423222070 330179564 /nfs/dbraw/zinc/17/95/64/330179564.db2.gz ZMJZVKKYKFHBOR-PMUMKWKESA-N 1 3 297.446 3.523 20 0 CHADHO CC(C)Sc1ccc([C@H](C)NCC[C@H](C)[NH3+])cc1 ZINC000423224135 330179949 /nfs/dbraw/zinc/17/99/49/330179949.db2.gz IHWWIRYROQLJPU-STQMWFEESA-N 1 3 266.454 3.575 20 0 CHADHO CCC[C@@H](NCC[C@H](C)[NH3+])c1ccc(Cl)cc1 ZINC000423232033 330180623 /nfs/dbraw/zinc/18/06/23/330180623.db2.gz MDGDXCWIBUXDGJ-SMDDNHRTSA-N 1 3 254.805 3.508 20 0 CHADHO C[NH2+]C[C@@H](C)CN[C@@H](CC1CC1)c1ccc(Cl)cc1 ZINC000423269170 330184282 /nfs/dbraw/zinc/18/42/82/330184282.db2.gz GWCQGOTWHKVWTM-WBMJQRKESA-N 1 3 280.843 3.626 20 0 CHADHO CSc1ccc([C@H](C)N[C@H]2CCCC[C@@H]2C[NH3+])cc1F ZINC000423274148 330184850 /nfs/dbraw/zinc/18/48/50/330184850.db2.gz KCZMRJKCPDZCER-LNSITVRQSA-N 1 3 296.455 3.716 20 0 CHADHO CC[C@H](CSc1ccc(Cl)cc1)N[C@H](C[NH3+])C1CC1 ZINC000423277471 330185019 /nfs/dbraw/zinc/18/50/19/330185019.db2.gz OEMKGPNPPYFETP-UKRRQHHQSA-N 1 3 298.883 3.538 20 0 CHADHO C[NH2+]C[C@@H](C)CN[C@H]1CCCc2c3ccccc3sc21 ZINC000423276714 330185120 /nfs/dbraw/zinc/18/51/20/330185120.db2.gz OWLWLMQGZFMGGA-DOMZBBRYSA-N 1 3 288.460 3.724 20 0 CHADHO CC(C)Sc1ccc([C@@H](C)[NH2+]CC(C)(C)N)cc1 ZINC000423281371 330185338 /nfs/dbraw/zinc/18/53/38/330185338.db2.gz BDFNUMLAFIWCPD-GFCCVEGCSA-N 1 3 266.454 3.575 20 0 CHADHO CC(C)[C@@H]([NH2+]CC(C)(C)N)c1cccc(C(F)(F)F)c1 ZINC000423281366 330185458 /nfs/dbraw/zinc/18/54/58/330185458.db2.gz BCFMLUBALHJURN-CYBMUJFWSA-N 1 3 288.357 3.729 20 0 CHADHO CC(C)(N)C[NH2+][C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000423288465 330186324 /nfs/dbraw/zinc/18/63/24/330186324.db2.gz SFJSRCZZBZJFJB-CQSZACIVSA-N 1 3 266.816 3.508 20 0 CHADHO CCC[C@H](NCc1ccc([C@H](C)[NH3+])cc1)c1cccnc1 ZINC000423290870 330187058 /nfs/dbraw/zinc/18/70/58/330187058.db2.gz FTCNLZMILIOMLO-KSSFIOAISA-N 1 3 283.419 3.732 20 0 CHADHO Cc1ccc2c(c1)[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)CC2 ZINC000423292863 330187611 /nfs/dbraw/zinc/18/76/11/330187611.db2.gz ORVGPTWPWBWQSB-LIRRHRJNSA-N 1 3 280.415 3.792 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2cc(F)cc(F)c2)cc1 ZINC000423293155 330187821 /nfs/dbraw/zinc/18/78/21/330187821.db2.gz PZWKKVQIQGNNJK-RYUDHWBXSA-N 1 3 290.357 3.835 20 0 CHADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2CCc3ccc(F)cc32)cc1 ZINC000423293804 330188000 /nfs/dbraw/zinc/18/80/00/330188000.db2.gz SCHGVZCEXGJJFH-KPZWWZAWSA-N 1 3 284.378 3.623 20 0 CHADHO Cc1ccc([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000423296585 330188639 /nfs/dbraw/zinc/18/86/39/330188639.db2.gz ZLZVMQFBOMZFHU-GJZGRUSLSA-N 1 3 268.404 3.866 20 0 CHADHO C[C@@H](NC[C@@H](C)C[NH3+])c1ccc(-c2ccccc2)s1 ZINC000423302658 330189012 /nfs/dbraw/zinc/18/90/12/330189012.db2.gz HQWRJLNPLCOLBO-QWHCGFSZSA-N 1 3 274.433 3.661 20 0 CHADHO C[C@@H](NC[C@@H](C)C[NH3+])c1ccc(-c2cccs2)cc1 ZINC000423304394 330189309 /nfs/dbraw/zinc/18/93/09/330189309.db2.gz YPZFAIQQMCMXDE-QWHCGFSZSA-N 1 3 274.433 3.661 20 0 CHADHO C[C@H](CN)C[NH2+][C@@H]1CCC[C@@H](c2cccc(Cl)c2)C1 ZINC000423309522 330189403 /nfs/dbraw/zinc/18/94/03/330189403.db2.gz PYFCOOKGWWTKCQ-XNRPHZJLSA-N 1 3 280.843 3.551 20 0 CHADHO CC[C@H]([NH2+]C[C@@H](N)C1CC1)c1ccc(Cl)c(Cl)c1 ZINC000423312261 330189546 /nfs/dbraw/zinc/18/95/46/330189546.db2.gz DBCHQZOMPMEGQW-KGLIPLIRSA-N 1 3 287.234 3.771 20 0 CHADHO N[C@H](C[NH2+][C@H](c1ccc(Cl)c(Cl)c1)C1CC1)C1CC1 ZINC000423313174 330189883 /nfs/dbraw/zinc/18/98/83/330189883.db2.gz FGWSNIGBKHQCOE-CABCVRRESA-N 1 3 299.245 3.771 20 0 CHADHO CC(C)Sc1ccc([C@H](C)[NH2+]C[C@@H](N)C2CC2)cc1 ZINC000423317879 330190049 /nfs/dbraw/zinc/19/00/49/330190049.db2.gz KUCZZZNYBGTMSB-BLLLJJGKSA-N 1 3 278.465 3.575 20 0 CHADHO CC(C)[C@H]([NH2+]CC1(N)CCC1)c1cc2ccccc2o1 ZINC000423326988 330190587 /nfs/dbraw/zinc/19/05/87/330190587.db2.gz MQLUCQIGOGCWLK-INIZCTEOSA-N 1 3 272.392 3.601 20 0 CHADHO CCc1c2ccccc2oc1[C@@H](C)NCC1=CC[NH2+]CC1 ZINC000423337867 330191861 /nfs/dbraw/zinc/19/18/61/330191861.db2.gz HSWFYTQUKBZDNY-CYBMUJFWSA-N 1 3 284.403 3.566 20 0 CHADHO CCc1ccc([C@H](C)NCc2ccc3c(c2)C[NH2+]C3)cc1 ZINC000423360753 330193578 /nfs/dbraw/zinc/19/35/78/330193578.db2.gz QTGMGZMDJGZHCK-AWEZNQCLSA-N 1 3 280.415 3.703 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@H](Cc2ccccc2)c2ccccc2)CCN1 ZINC000423366376 330194509 /nfs/dbraw/zinc/19/45/09/330194509.db2.gz COLPQIUCRSKXOC-LSTHTHJFSA-N 1 3 294.442 3.701 20 0 CHADHO c1ccc([C@H]2CCC[C@H]2[NH2+]Cc2ccc3c(c2)CNC3)cc1 ZINC000423366036 330194525 /nfs/dbraw/zinc/19/45/25/330194525.db2.gz BLORQOFQQRKUQP-WOJBJXKFSA-N 1 3 292.426 3.716 20 0 CHADHO CC[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1cccs1 ZINC000423366174 330194671 /nfs/dbraw/zinc/19/46/71/330194671.db2.gz XKONBXXAJMZQHX-HNNXBMFYSA-N 1 3 272.417 3.592 20 0 CHADHO Cc1cc([C@H](C)NCc2ccc3c(c2)C[NH2+]C3)cc(C)c1F ZINC000423370186 330194943 /nfs/dbraw/zinc/19/49/43/330194943.db2.gz FHLARLGTGOGQHK-AWEZNQCLSA-N 1 3 298.405 3.897 20 0 CHADHO C[C@@H]1C[C@@H](N[C@H](c2cccs2)C2CCCC2)CC[NH2+]1 ZINC000423369228 330195096 /nfs/dbraw/zinc/19/50/96/330195096.db2.gz FTSQQYYJZOQNRZ-INWMFGNUSA-N 1 3 278.465 3.710 20 0 CHADHO C[C@@H]1C[C@@H]([NH2+][C@H](c2cccs2)C2CCCC2)CCN1 ZINC000423369228 330195097 /nfs/dbraw/zinc/19/50/97/330195097.db2.gz FTSQQYYJZOQNRZ-INWMFGNUSA-N 1 3 278.465 3.710 20 0 CHADHO CC(C)[C@H](CCc1ccccc1)[NH2+][C@@H]1CCC[C@H](N)C1 ZINC000423372210 330195196 /nfs/dbraw/zinc/19/51/96/330195196.db2.gz GXDOVDXIJDPDOV-KSZLIROESA-N 1 3 274.452 3.503 20 0 CHADHO Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@H]1CCN[C@H](C)C1 ZINC000423371408 330195234 /nfs/dbraw/zinc/19/52/34/330195234.db2.gz FLUWRUMQWXQEBX-GLJUWKHASA-N 1 3 297.446 3.584 20 0 CHADHO Cc1cc(C)c([C@H](C)N[C@H]2CCC[C@H]([NH3+])C2)cc1C ZINC000423372094 330195352 /nfs/dbraw/zinc/19/53/52/330195352.db2.gz GTDVSWLAURWAAA-JYJNAYRXSA-N 1 3 260.425 3.532 20 0 CHADHO CC[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1cccc(C)c1 ZINC000423401106 330196211 /nfs/dbraw/zinc/19/62/11/330196211.db2.gz VUIPWTCQLFQOLI-IBGZPJMESA-N 1 3 280.415 3.839 20 0 CHADHO Cc1cc2c(cc1C)[C@H](N[C@H]1CCC[C@H]([NH3+])C1)CCS2 ZINC000423406163 330196682 /nfs/dbraw/zinc/19/66/82/330196682.db2.gz YRFZSAPVRIZPLY-OFQRWUPVSA-N 1 3 290.476 3.700 20 0 CHADHO Cc1cc2c(cc1C)[C@H](N[C@H]1CCC[C@@H]([NH3+])C1)CCS2 ZINC000423406159 330196861 /nfs/dbraw/zinc/19/68/61/330196861.db2.gz YRFZSAPVRIZPLY-IJEWVQPXSA-N 1 3 290.476 3.700 20 0 CHADHO C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+][C@@H]1CCC[C@@H](N)C1 ZINC000423374275 330198560 /nfs/dbraw/zinc/19/85/60/330198560.db2.gz SOIRHTLUZNZCAI-YXAMBPQSSA-N 1 3 280.843 3.692 20 0 CHADHO c1ccc([C@@H]2CC[C@H]([NH2+]Cc3ccc4c(c3)CNC4)C2)cc1 ZINC000423376053 330198592 /nfs/dbraw/zinc/19/85/92/330198592.db2.gz JABQOFJHSIIPQV-XLIONFOSSA-N 1 3 292.426 3.716 20 0 CHADHO C[C@@H]([NH2+][C@H]1CCN[C@H](C)C1)c1cccc(-c2ccncc2)c1 ZINC000423382419 330199127 /nfs/dbraw/zinc/19/91/27/330199127.db2.gz OXGXUSJURPUWRD-CLCXKQKWSA-N 1 3 295.430 3.540 20 0 CHADHO CC[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1cccc(Cl)c1 ZINC000423383196 330199174 /nfs/dbraw/zinc/19/91/74/330199174.db2.gz PGEXXCFVDVUPOL-DFBGVHRSSA-N 1 3 266.816 3.521 20 0 CHADHO C[C@@H](N[C@@H]1CC[NH2+][C@H](C)C1)c1cccc2ccccc21 ZINC000423381770 330199223 /nfs/dbraw/zinc/19/92/23/330199223.db2.gz OOOFAQMWLFCVLC-IIAWOOMASA-N 1 3 268.404 3.631 20 0 CHADHO C[C@@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1cccc2ccccc21 ZINC000423381770 330199225 /nfs/dbraw/zinc/19/92/25/330199225.db2.gz OOOFAQMWLFCVLC-IIAWOOMASA-N 1 3 268.404 3.631 20 0 CHADHO C[C@H]([NH2+]Cc1ccc2c(c1)CNC2)[C@@H]1CCCC[C@H]1C ZINC000423382912 330199251 /nfs/dbraw/zinc/19/92/51/330199251.db2.gz KAWWQNYOKDURPX-QWQRMKEZSA-N 1 3 272.436 3.594 20 0 CHADHO C[C@@H]1C[NH2+]CC[C@@H]1N[C@H](c1ccccc1)C1CCCC1 ZINC000423385200 330199504 /nfs/dbraw/zinc/19/95/04/330199504.db2.gz GOLFEVCZYZCAOA-FHLIZLRMSA-N 1 3 272.436 3.506 20 0 CHADHO C[C@@H]1CNCC[C@@H]1[NH2+][C@H](c1ccccc1)C1CCCC1 ZINC000423385200 330199506 /nfs/dbraw/zinc/19/95/06/330199506.db2.gz GOLFEVCZYZCAOA-FHLIZLRMSA-N 1 3 272.436 3.506 20 0 CHADHO C[C@H]1C[C@H]([NH2+]C2CCC3(CCCCC3)CC2)CCN1 ZINC000423385790 330199585 /nfs/dbraw/zinc/19/95/85/330199585.db2.gz RBEFRMXVSPCQOP-GOEBONIOSA-N 1 3 264.457 3.610 20 0 CHADHO CC(C)[C@H]([NH2+][C@H]1CCN[C@H](C)C1)c1ccc(Cl)cc1 ZINC000423384931 330199657 /nfs/dbraw/zinc/19/96/57/330199657.db2.gz QOGLLJVFLYTFAP-KCXAZCMYSA-N 1 3 280.843 3.767 20 0 CHADHO C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@H](c3ccc(Cl)cc3)C2)CCN1 ZINC000423387601 330199842 /nfs/dbraw/zinc/19/98/42/330199842.db2.gz SOJLORXZLHIULR-NQZOLGFYSA-N 1 3 292.854 3.706 20 0 CHADHO N[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@@H]2c2ccccc2)C1 ZINC000423387357 330200115 /nfs/dbraw/zinc/20/01/15/330200115.db2.gz MMEJHBHULQORGR-XMTFNYHQSA-N 1 3 272.436 3.572 20 0 CHADHO Cc1ccc([C@H](N[C@H]2CC[NH2+][C@@H](C)C2)C2CCC2)cc1 ZINC000423393570 330200722 /nfs/dbraw/zinc/20/07/22/330200722.db2.gz YUWXGCOWVZNOPI-JCGIZDLHSA-N 1 3 272.436 3.566 20 0 CHADHO Cc1ccc([C@H]([NH2+][C@H]2CCN[C@@H](C)C2)C2CCC2)cc1 ZINC000423393570 330200723 /nfs/dbraw/zinc/20/07/23/330200723.db2.gz YUWXGCOWVZNOPI-JCGIZDLHSA-N 1 3 272.436 3.566 20 0 CHADHO C[C@H](N[C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccc(F)cc1Cl ZINC000423430786 330200833 /nfs/dbraw/zinc/20/08/33/330200833.db2.gz IJTPPCQRYMUMAM-JMPLFQLZSA-N 1 3 296.817 3.518 20 0 CHADHO Cc1c2ccccc2oc1[C@@H](C)N[C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423452885 330203153 /nfs/dbraw/zinc/20/31/53/330203153.db2.gz ZKTANGOEBNLQNO-XOKHGSTOSA-N 1 3 298.430 3.780 20 0 CHADHO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H](C)[C@@H](C)N ZINC000423452444 330203161 /nfs/dbraw/zinc/20/31/61/330203161.db2.gz WIFDXRAGGYLPSH-WOPDTQHZSA-N 1 3 289.448 3.505 20 0 CHADHO CC[C@H](N)C[NH2+][C@@H](C)c1ccc(-c2ccccc2OC)cc1 ZINC000423459461 330203881 /nfs/dbraw/zinc/20/38/81/330203881.db2.gz IBQWXGYXYAUTQG-YOEHRIQHSA-N 1 3 298.430 3.750 20 0 CHADHO CC[C@H](N)C[NH2+][C@H](c1ccc(C(F)(F)F)cc1)C(C)C ZINC000423465181 330204352 /nfs/dbraw/zinc/20/43/52/330204352.db2.gz MOZPEOAPIBQJDC-KBPBESRZSA-N 1 3 288.357 3.729 20 0 CHADHO CC[C@@H](N[C@@H](CCC[NH3+])c1ccccc1)c1ccncc1 ZINC000423499046 330208020 /nfs/dbraw/zinc/20/80/20/330208020.db2.gz ADUMSZOYWSDFLP-MSOLQXFVSA-N 1 3 283.419 3.603 20 0 CHADHO [NH3+]CCC[C@H](N[C@@H]1CCc2ccc(F)cc21)c1ccccc1 ZINC000423507723 330208974 /nfs/dbraw/zinc/20/89/74/330208974.db2.gz QHDTXCSJRKUZQB-RBUKOAKNSA-N 1 3 298.405 3.883 20 0 CHADHO C[C@@H](N[C@H](CCC[NH3+])c1ccccc1)c1cccs1 ZINC000423510046 330209099 /nfs/dbraw/zinc/20/90/99/330209099.db2.gz RWHUHCBEVYBSEO-UKRRQHHQSA-N 1 3 274.433 3.879 20 0 CHADHO C[C@H]([NH2+]CC1(N)C2CC3CC(C2)CC1C3)c1cccs1 ZINC000423515993 330209429 /nfs/dbraw/zinc/20/94/29/330209429.db2.gz AJLVNAKNQAULDL-PQJKGVAHSA-N 1 3 290.476 3.552 20 0 CHADHO CC(C)c1cccc([C@H](C)[NH2+]CC2=CCN(C)CC2)c1 ZINC000527876398 330291298 /nfs/dbraw/zinc/29/12/98/330291298.db2.gz NAZPPHSMFPVKGP-HNNXBMFYSA-N 1 3 272.436 3.723 20 0 CHADHO Cc1ccc(C2CC(NCCC[NH+]3CCCCC3)C2)cc1 ZINC000036843472 330293160 /nfs/dbraw/zinc/29/31/60/330293160.db2.gz KMPCGKYTLXYEBX-UHFFFAOYSA-N 1 3 286.463 3.707 20 0 CHADHO Clc1cccc(C2CC([NH2+]CCCN3CCCC3)C2)c1 ZINC000036843509 330293243 /nfs/dbraw/zinc/29/32/43/330293243.db2.gz FDHLFHKJEDDDLA-UHFFFAOYSA-N 1 3 292.854 3.662 20 0 CHADHO Clc1cccc(C2CC(NCCC[NH+]3CCCC3)C2)c1 ZINC000036843509 330293244 /nfs/dbraw/zinc/29/32/44/330293244.db2.gz FDHLFHKJEDDDLA-UHFFFAOYSA-N 1 3 292.854 3.662 20 0 CHADHO CC[N@@H+]1CC[C@@H](N(C)Cc2c(C)cc(C)cc2C)[C@H](C)C1 ZINC000533072664 330326874 /nfs/dbraw/zinc/32/68/74/330326874.db2.gz WZBXYBBOSYBNBI-IEBWSBKVSA-N 1 3 288.479 3.774 20 0 CHADHO CC[N@H+]1CC[C@@H](N(C)Cc2c(C)cc(C)cc2C)[C@H](C)C1 ZINC000533072664 330326875 /nfs/dbraw/zinc/32/68/75/330326875.db2.gz WZBXYBBOSYBNBI-IEBWSBKVSA-N 1 3 288.479 3.774 20 0 CHADHO CC(C)Cc1ccc([C@H](C)NC[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000044534592 330329894 /nfs/dbraw/zinc/32/98/94/330329894.db2.gz FHZWOOBSUGIPED-WMZOPIPTSA-N 1 3 288.479 3.878 20 0 CHADHO CC(C)Cc1ccc([C@H](C)NC[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000044534592 330329895 /nfs/dbraw/zinc/32/98/95/330329895.db2.gz FHZWOOBSUGIPED-WMZOPIPTSA-N 1 3 288.479 3.878 20 0 CHADHO C[C@@H](NC[C@H]1CCC[N@H+](C)C1)c1ccc2ccccc2c1 ZINC000044535111 330330049 /nfs/dbraw/zinc/33/00/49/330330049.db2.gz GVFPGJWSLLOYAZ-HZPDHXFCSA-N 1 3 282.431 3.832 20 0 CHADHO C[C@@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccc2ccccc2c1 ZINC000044535111 330330050 /nfs/dbraw/zinc/33/00/50/330330050.db2.gz GVFPGJWSLLOYAZ-HZPDHXFCSA-N 1 3 282.431 3.832 20 0 CHADHO [NH3+][C@H]1C[C@@H](N[C@@H]2CCC[C@H](C3CC3)C2)c2ccccc21 ZINC000424385624 330349555 /nfs/dbraw/zinc/34/95/55/330349555.db2.gz WNQDNXVLNCLWDP-IHETXDGRSA-N 1 3 270.420 3.690 20 0 CHADHO CCN1CC[C@H]([NH2+]Cc2ccc(C)cc2SC)[C@H](C)C1 ZINC000119271371 330371553 /nfs/dbraw/zinc/37/15/53/330371553.db2.gz DMQBWLNZMZSTTH-ZBFHGGJFSA-N 1 3 292.492 3.537 20 0 CHADHO CC(C)[C@H]([NH2+][C@H]1CCC[C@H](N(C)C)C1)c1ccccc1 ZINC000537016714 330379403 /nfs/dbraw/zinc/37/94/03/330379403.db2.gz SQZGFGJAFXVMSM-BZSNNMDCSA-N 1 3 274.452 3.846 20 0 CHADHO CC(C)[C@H](N[C@H]1CCC[C@H]([NH+](C)C)C1)c1ccccc1 ZINC000537016714 330379404 /nfs/dbraw/zinc/37/94/04/330379404.db2.gz SQZGFGJAFXVMSM-BZSNNMDCSA-N 1 3 274.452 3.846 20 0 CHADHO C[NH+](C)CCCCNCc1ccc(F)c(Cl)c1Cl ZINC000432244534 330595788 /nfs/dbraw/zinc/59/57/88/330595788.db2.gz CRLVEFGNUNANFC-UHFFFAOYSA-N 1 3 293.213 3.564 20 0 CHADHO C[C@@H]1CC[C@H](N[C@H]2CC[N@@H+]3CCCC[C@@H]23)c2sccc21 ZINC000453070132 331086440 /nfs/dbraw/zinc/08/64/40/331086440.db2.gz ZZEMZJHAGNGXOS-OEAJRASXSA-N 1 3 290.476 3.903 20 0 CHADHO C[C@@H]1CC[C@H](N[C@H]2CC[N@H+]3CCCC[C@@H]23)c2sccc21 ZINC000453070132 331086441 /nfs/dbraw/zinc/08/64/41/331086441.db2.gz ZZEMZJHAGNGXOS-OEAJRASXSA-N 1 3 290.476 3.903 20 0 CHADHO CCC[C@H]([NH2+]C[C@@H]1CCN(CCC)C1)C(C)(C)C ZINC000453086555 331087918 /nfs/dbraw/zinc/08/79/18/331087918.db2.gz HZQQKHDVCGYYHF-GJZGRUSLSA-N 1 3 254.462 3.523 20 0 CHADHO CCC1([NH2+]C2CCN([C@H]3CCC[C@H](C)C3)CC2)CC1 ZINC000453277547 331110205 /nfs/dbraw/zinc/11/02/05/331110205.db2.gz DKRRQWZYQNGAJV-HOCLYGCPSA-N 1 3 264.457 3.562 20 0 CHADHO CCC1(NC2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)CC1 ZINC000453277547 331110206 /nfs/dbraw/zinc/11/02/06/331110206.db2.gz DKRRQWZYQNGAJV-HOCLYGCPSA-N 1 3 264.457 3.562 20 0 CHADHO C[C@H](NCC[C@@H]1CCC[N@H+](C)C1)c1cc2ccccc2o1 ZINC000459732680 331296740 /nfs/dbraw/zinc/29/67/40/331296740.db2.gz MNMMNLOFENQHJF-GJZGRUSLSA-N 1 3 286.419 3.815 20 0 CHADHO C[C@H](NCC[C@@H]1CCC[N@@H+](C)C1)c1cc2ccccc2o1 ZINC000459732680 331296741 /nfs/dbraw/zinc/29/67/41/331296741.db2.gz MNMMNLOFENQHJF-GJZGRUSLSA-N 1 3 286.419 3.815 20 0 CHADHO c1cc(C2CCCC2)ccc1CNC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000462795060 331329411 /nfs/dbraw/zinc/32/94/11/331329411.db2.gz MDXCRJDUOGYJIQ-QGZVFWFLSA-N 1 3 298.474 3.918 20 0 CHADHO c1cc(C2CCCC2)ccc1CNC[C@H]1CC[N@H+](C2CC2)C1 ZINC000462795060 331329412 /nfs/dbraw/zinc/32/94/12/331329412.db2.gz MDXCRJDUOGYJIQ-QGZVFWFLSA-N 1 3 298.474 3.918 20 0 CHADHO c1cc(C2CCCC2)ccc1C[NH2+]C[C@H]1CCN(C2CC2)C1 ZINC000462795060 331329413 /nfs/dbraw/zinc/32/94/13/331329413.db2.gz MDXCRJDUOGYJIQ-QGZVFWFLSA-N 1 3 298.474 3.918 20 0 CHADHO CC[NH+](CC)CC1CCN([C@H](C)c2ccccc2F)CC1 ZINC000488419823 332005990 /nfs/dbraw/zinc/00/59/90/332005990.db2.gz MIHSQXBGBJYVKI-OAHLLOKOSA-N 1 3 292.442 3.941 20 0 CHADHO CC(C)[C@@H]1C[C@H](NCCC[N@H+](C)C2CCCCC2)CS1 ZINC000488419648 332006134 /nfs/dbraw/zinc/00/61/34/332006134.db2.gz HGALUJJZROOULT-RDJZCZTQSA-N 1 3 298.540 3.761 20 0 CHADHO CC(C)[C@@H]1C[C@H](NCCC[N@@H+](C)C2CCCCC2)CS1 ZINC000488419648 332006136 /nfs/dbraw/zinc/00/61/36/332006136.db2.gz HGALUJJZROOULT-RDJZCZTQSA-N 1 3 298.540 3.761 20 0 CHADHO CC(C)C1CC([NH2+][C@@H](C)[C@@H]2CCCN(C3CCC3)C2)C1 ZINC000488509292 332014719 /nfs/dbraw/zinc/01/47/19/332014719.db2.gz VNICXEPIQCPGOD-NJINODPHSA-N 1 3 278.484 3.664 20 0 CHADHO CCC[N@@H+]1CC[C@H](CN[C@@H]2c3cc(C)ccc3C[C@@H]2C)C1 ZINC000490172053 332083612 /nfs/dbraw/zinc/08/36/12/332083612.db2.gz JYJGEVBSOGESMN-FCEWJHQRSA-N 1 3 286.463 3.550 20 0 CHADHO CCC[N@H+]1CC[C@H](CN[C@@H]2c3cc(C)ccc3C[C@@H]2C)C1 ZINC000490172053 332083614 /nfs/dbraw/zinc/08/36/14/332083614.db2.gz JYJGEVBSOGESMN-FCEWJHQRSA-N 1 3 286.463 3.550 20 0 CHADHO CCCN1CC[C@H](C[NH2+][C@@H]2c3cc(C)ccc3C[C@@H]2C)C1 ZINC000490172053 332083615 /nfs/dbraw/zinc/08/36/15/332083615.db2.gz JYJGEVBSOGESMN-FCEWJHQRSA-N 1 3 286.463 3.550 20 0 CHADHO CC[NH+](CC)CC1CCN(Cc2cc(F)ccc2C)CC1 ZINC000491077950 332147449 /nfs/dbraw/zinc/14/74/49/332147449.db2.gz NDNOROYVEVNELK-UHFFFAOYSA-N 1 3 292.442 3.688 20 0 CHADHO CC(C)(C)N1CCC([NH2+]C[C@@H]2CCCC(F)(F)C2)CC1 ZINC000502330580 332653985 /nfs/dbraw/zinc/65/39/85/332653985.db2.gz GBJKKPMARJAWKX-CYBMUJFWSA-N 1 3 288.426 3.664 20 0 CHADHO Cc1cc(C)c(CN[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@@H]32)c(C)c1 ZINC000513652796 333029342 /nfs/dbraw/zinc/02/93/42/333029342.db2.gz BWAYTYXBLXGLJF-QRQLOZEOSA-N 1 3 286.463 3.574 20 0 CHADHO Cc1cc(C)c(CN[C@@H]2CC[N@H+](C)[C@H]3CCC[C@@H]32)c(C)c1 ZINC000513652796 333029344 /nfs/dbraw/zinc/02/93/44/333029344.db2.gz BWAYTYXBLXGLJF-QRQLOZEOSA-N 1 3 286.463 3.574 20 0 CHADHO C[N@@H+]1CC[C@H](NCc2ccc3ccccc3c2)[C@H]2CCC[C@@H]21 ZINC000513668370 333030998 /nfs/dbraw/zinc/03/09/98/333030998.db2.gz XNSADEMSFIQZFF-AABGKKOBSA-N 1 3 294.442 3.802 20 0 CHADHO C[N@H+]1CC[C@H](NCc2ccc3ccccc3c2)[C@H]2CCC[C@@H]21 ZINC000513668370 333030999 /nfs/dbraw/zinc/03/09/99/333030999.db2.gz XNSADEMSFIQZFF-AABGKKOBSA-N 1 3 294.442 3.802 20 0 CHADHO C(C[NH2+][C@H]1CCCCC12CCCC2)CN1CCCC1 ZINC000311455439 333068710 /nfs/dbraw/zinc/06/87/10/333068710.db2.gz KKLKWCIUVRXASI-INIZCTEOSA-N 1 3 264.457 3.565 20 0 CHADHO C[C@@H]1C[C@H](C)C[N@@H+](CCCCNCc2ccc(Cl)o2)C1 ZINC000517537122 333101594 /nfs/dbraw/zinc/10/15/94/333101594.db2.gz FKSMCXHHWXDCNT-OKILXGFUSA-N 1 3 298.858 3.781 20 0 CHADHO C[C@@H]1C[C@H](C)C[N@H+](CCCCNCc2ccc(Cl)o2)C1 ZINC000517537122 333101596 /nfs/dbraw/zinc/10/15/96/333101596.db2.gz FKSMCXHHWXDCNT-OKILXGFUSA-N 1 3 298.858 3.781 20 0 CHADHO CCCN(CCC)CCC[NH2+][C@@H](C)C1CCSCC1 ZINC000187152273 333168198 /nfs/dbraw/zinc/16/81/98/333168198.db2.gz HXLUICNKLADBDK-HNNXBMFYSA-N 1 3 286.529 3.620 20 0 CHADHO CC(C)C[C@H](N[C@@H]1CCC[C@@H]([NH3+])C1)c1ccccc1 ZINC000222942530 333202582 /nfs/dbraw/zinc/20/25/82/333202582.db2.gz VNFHCCKORQPFBW-ZACQAIPSSA-N 1 3 260.425 3.633 20 0 CHADHO CCC[NH+]1CCC(CNCc2sccc2Cl)CC1 ZINC000193086239 333242568 /nfs/dbraw/zinc/24/25/68/333242568.db2.gz NUWHDIIDRWROLW-UHFFFAOYSA-N 1 3 286.872 3.613 20 0 CHADHO C[C@H](c1cccc(F)c1)N1CCC(C[NH+]2CCCC2)CC1 ZINC000194740564 333277018 /nfs/dbraw/zinc/27/70/18/333277018.db2.gz DNVFWZIBOJMSOM-OAHLLOKOSA-N 1 3 290.426 3.695 20 0 CHADHO Cc1ccc(CN2CCC([C@H]3CCC[NH2+]3)CC2)cc1Cl ZINC000235998912 333372977 /nfs/dbraw/zinc/37/29/77/333372977.db2.gz QIASUMSHRIMPRM-QGZVFWFLSA-N 1 3 292.854 3.612 20 0 CHADHO Cc1nc(CN)ccc1[C@H](C)[NH2+]CC[C@@H]1CCCC1(C)C ZINC000530210034 333528064 /nfs/dbraw/zinc/52/80/64/333528064.db2.gz KIQYKIGUNISUKF-ZFWWWQNUSA-N 1 3 289.467 3.716 20 0 CHADHO Cc1cc(CN2CCC(CCC[NH+](C)C)CC2)ccc1F ZINC000538751915 333624485 /nfs/dbraw/zinc/62/44/85/333624485.db2.gz WIPQOORBWXWKDL-UHFFFAOYSA-N 1 3 292.442 3.688 20 0 CHADHO CC[C@@H](c1ccccc1)N1CC[C@H](C[NH+](CC)CC)C1 ZINC000076002078 334065866 /nfs/dbraw/zinc/06/58/66/334065866.db2.gz LYOOWHYPBOQGCH-AEFFLSMTSA-N 1 3 274.452 3.801 20 0 CHADHO CC[C@@H](c1ccccc1)[N@@H+]1CC[C@H](CN(CC)CC)C1 ZINC000076002078 334065868 /nfs/dbraw/zinc/06/58/68/334065868.db2.gz LYOOWHYPBOQGCH-AEFFLSMTSA-N 1 3 274.452 3.801 20 0 CHADHO CC[C@@H](c1ccccc1)[N@H+]1CC[C@H](CN(CC)CC)C1 ZINC000076002078 334065870 /nfs/dbraw/zinc/06/58/70/334065870.db2.gz LYOOWHYPBOQGCH-AEFFLSMTSA-N 1 3 274.452 3.801 20 0 CHADHO C[C@@H]1CC[N@H+](CCCN2CCCCC2)[C@@H]2CCCC[C@@H]12 ZINC000547737599 334113504 /nfs/dbraw/zinc/11/35/04/334113504.db2.gz ZZKPMJSVJIYBRL-FGTMMUONSA-N 1 3 278.484 3.763 20 0 CHADHO C[C@@H]1CC[N@@H+](CCCN2CCCCC2)[C@@H]2CCCC[C@@H]12 ZINC000547737599 334113505 /nfs/dbraw/zinc/11/35/05/334113505.db2.gz ZZKPMJSVJIYBRL-FGTMMUONSA-N 1 3 278.484 3.763 20 0 CHADHO CCN1CC[C@@H]([N@H+](C)Cc2ccc(Cl)s2)[C@@H](C)C1 ZINC000245417742 334191454 /nfs/dbraw/zinc/19/14/54/334191454.db2.gz GGCYYGRZRZAVAY-WCQYABFASA-N 1 3 286.872 3.564 20 0 CHADHO CCN1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)s2)[C@@H](C)C1 ZINC000245417742 334191455 /nfs/dbraw/zinc/19/14/55/334191455.db2.gz GGCYYGRZRZAVAY-WCQYABFASA-N 1 3 286.872 3.564 20 0 CHADHO CC[N@@H+]1CC[C@H](N(C)CCc2ccccc2Cl)[C@@H](C)C1 ZINC000245420256 334191894 /nfs/dbraw/zinc/19/18/94/334191894.db2.gz HJPLCBBLVXQASX-YOEHRIQHSA-N 1 3 294.870 3.545 20 0 CHADHO CC[N@H+]1CC[C@H](N(C)CCc2ccccc2Cl)[C@@H](C)C1 ZINC000245420256 334191896 /nfs/dbraw/zinc/19/18/96/334191896.db2.gz HJPLCBBLVXQASX-YOEHRIQHSA-N 1 3 294.870 3.545 20 0 CHADHO CCC[N@H+](C)C[C@@H]1CCN([C@H]2CCCc3ccccc32)C1 ZINC000245427147 334191999 /nfs/dbraw/zinc/19/19/99/334191999.db2.gz LVRADUGFSNRJIX-LPHOPBHVSA-N 1 3 286.463 3.728 20 0 CHADHO CCC[N@@H+](C)C[C@@H]1CCN([C@H]2CCCc3ccccc32)C1 ZINC000245427147 334192000 /nfs/dbraw/zinc/19/20/00/334192000.db2.gz LVRADUGFSNRJIX-LPHOPBHVSA-N 1 3 286.463 3.728 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@@H+]([C@H]2CCCc3ccccc32)C1 ZINC000245427147 334192001 /nfs/dbraw/zinc/19/20/01/334192001.db2.gz LVRADUGFSNRJIX-LPHOPBHVSA-N 1 3 286.463 3.728 20 0 CHADHO CCCN(C)C[C@@H]1CC[N@H+]([C@H]2CCCc3ccccc32)C1 ZINC000245427147 334192002 /nfs/dbraw/zinc/19/20/02/334192002.db2.gz LVRADUGFSNRJIX-LPHOPBHVSA-N 1 3 286.463 3.728 20 0 CHADHO Cc1cc(C)c(CN(C)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1C ZINC000245748860 334217255 /nfs/dbraw/zinc/21/72/55/334217255.db2.gz NKUYYGHEQJMJIO-WMZOPIPTSA-N 1 3 274.452 3.526 20 0 CHADHO Cc1cc(C)c(CN(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1C ZINC000245748860 334217256 /nfs/dbraw/zinc/21/72/56/334217256.db2.gz NKUYYGHEQJMJIO-WMZOPIPTSA-N 1 3 274.452 3.526 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](C)C(C)(C)c2ccccc2)C1 ZINC000246984753 334273374 /nfs/dbraw/zinc/27/33/74/334273374.db2.gz JXHYHKFVKKVEIZ-SJORKVTESA-N 1 3 288.479 3.674 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H]2CCCc3cc(F)ccc32)C1 ZINC000246089498 334231199 /nfs/dbraw/zinc/23/11/99/334231199.db2.gz WLRAOQLBVXACLD-KSSFIOAISA-N 1 3 290.426 3.525 20 0 CHADHO C(CN1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)C1CCCC1 ZINC000246421029 334257144 /nfs/dbraw/zinc/25/71/44/334257144.db2.gz CCDMWHARMYHVBR-FUHWJXTLSA-N 1 3 276.468 3.515 20 0 CHADHO C(CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)C1CCCC1 ZINC000246421029 334257145 /nfs/dbraw/zinc/25/71/45/334257145.db2.gz CCDMWHARMYHVBR-FUHWJXTLSA-N 1 3 276.468 3.515 20 0 CHADHO CC[NH+](CC)C[C@H]1CCN([C@H]2CCCc3ccccc32)C1 ZINC000247521989 334284220 /nfs/dbraw/zinc/28/42/20/334284220.db2.gz NMNAUPQUMMLZGH-APWZRJJASA-N 1 3 286.463 3.728 20 0 CHADHO CCN(CC)C[C@H]1CC[N@@H+]([C@H]2CCCc3ccccc32)C1 ZINC000247521989 334284221 /nfs/dbraw/zinc/28/42/21/334284221.db2.gz NMNAUPQUMMLZGH-APWZRJJASA-N 1 3 286.463 3.728 20 0 CHADHO CCN(CC)C[C@H]1CC[N@H+]([C@H]2CCCc3ccccc32)C1 ZINC000247521989 334284223 /nfs/dbraw/zinc/28/42/23/334284223.db2.gz NMNAUPQUMMLZGH-APWZRJJASA-N 1 3 286.463 3.728 20 0 CHADHO CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1C=CCCC1 ZINC000247529785 334284496 /nfs/dbraw/zinc/28/44/96/334284496.db2.gz OCOMCFQUCYFCEC-RBUKOAKNSA-N 1 3 284.447 3.549 20 0 CHADHO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1C=CCCC1 ZINC000247529785 334284498 /nfs/dbraw/zinc/28/44/98/334284498.db2.gz OCOMCFQUCYFCEC-RBUKOAKNSA-N 1 3 284.447 3.549 20 0 CHADHO CCC[N@@H+]1CC[C@@H](CN[C@H](c2ccc(F)cc2)C2CC2)C1 ZINC000552745274 334343807 /nfs/dbraw/zinc/34/38/07/334343807.db2.gz MNDBJGGHXWOSMR-KSSFIOAISA-N 1 3 290.426 3.598 20 0 CHADHO CCC[N@H+]1CC[C@@H](CN[C@H](c2ccc(F)cc2)C2CC2)C1 ZINC000552745274 334343808 /nfs/dbraw/zinc/34/38/08/334343808.db2.gz MNDBJGGHXWOSMR-KSSFIOAISA-N 1 3 290.426 3.598 20 0 CHADHO CCCN1CC[C@@H](C[NH2+][C@H](c2ccc(F)cc2)C2CC2)C1 ZINC000552745274 334343809 /nfs/dbraw/zinc/34/38/09/334343809.db2.gz MNDBJGGHXWOSMR-KSSFIOAISA-N 1 3 290.426 3.598 20 0 CHADHO CC(C)N1CC[C@H](C[NH2+]CC[C@H](C)c2ccccc2)C1 ZINC000250517280 334345505 /nfs/dbraw/zinc/34/55/05/334345505.db2.gz RBZPSXXIIVDTMZ-DLBZAZTESA-N 1 3 274.452 3.500 20 0 CHADHO c1ccc2c(c1)CCC[C@@H]2N[C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000250528626 334345814 /nfs/dbraw/zinc/34/58/14/334345814.db2.gz IXJZNJGXVSVDHH-CADBVGFASA-N 1 3 284.447 3.574 20 0 CHADHO CC(C)c1ccc(CN[C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000250577844 334346579 /nfs/dbraw/zinc/34/65/79/334346579.db2.gz QGITZKOZNBXKOV-GUDVDZBRSA-N 1 3 286.463 3.820 20 0 CHADHO C[C@H](c1ccc(C(C)(C)C)cc1)N1CC[C@H]([NH3+])[C@H](C)C1 ZINC000251538935 334363585 /nfs/dbraw/zinc/36/35/85/334363585.db2.gz ARIDXTVOXOLPDO-CPUCHLNUSA-N 1 3 274.452 3.714 20 0 CHADHO C[C@H](c1ccc2ccccc2c1)N1CC[C@@H]([NH3+])[C@H](C)C1 ZINC000251608399 334365334 /nfs/dbraw/zinc/36/53/34/334365334.db2.gz DJNCNITVVJWAKN-HBUWYVDXSA-N 1 3 268.404 3.570 20 0 CHADHO C[C@@H]1CCC[C@@H]([NH2+]C2CC(C)(C)NC(C)(C)C2)[C@H]1C ZINC000251660000 334366309 /nfs/dbraw/zinc/36/63/09/334366309.db2.gz FZCGOMNBVSJLRZ-VNHYZAJKSA-N 1 3 266.473 3.710 20 0 CHADHO CC[N@@H+]1CC[C@H](CN[C@H](C)c2ccc(C(C)(C)C)cc2)C1 ZINC000252439657 334379909 /nfs/dbraw/zinc/37/99/09/334379909.db2.gz RENKKHDIGMNJHX-HZPDHXFCSA-N 1 3 288.479 3.977 20 0 CHADHO CC[N@H+]1CC[C@H](CN[C@H](C)c2ccc(C(C)(C)C)cc2)C1 ZINC000252439657 334379910 /nfs/dbraw/zinc/37/99/10/334379910.db2.gz RENKKHDIGMNJHX-HZPDHXFCSA-N 1 3 288.479 3.977 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](C)c2ccc(C(C)(C)C)cc2)C1 ZINC000252439657 334379911 /nfs/dbraw/zinc/37/99/11/334379911.db2.gz RENKKHDIGMNJHX-HZPDHXFCSA-N 1 3 288.479 3.977 20 0 CHADHO C[C@H]1C[C@H](N[C@H]2C[C@@H]([NH3+])c3ccccc32)C[C@@H](C)C1 ZINC000252792038 334393384 /nfs/dbraw/zinc/39/33/84/334393384.db2.gz UXSFAGRFDOJJOF-HVCLXXKLSA-N 1 3 258.409 3.546 20 0 CHADHO Cc1cccc2c1[C@H](C)C[C@@H]2NCc1ccc(C[NH3+])cc1 ZINC000565303388 334551040 /nfs/dbraw/zinc/55/10/40/334551040.db2.gz PHZKZFMQRIKSQC-KDOFPFPSSA-N 1 3 280.415 3.792 20 0 CHADHO COc1cc(C)ccc1[C@H](C)NCc1ccc([C@H](C)[NH3+])cc1 ZINC000565710357 334589672 /nfs/dbraw/zinc/58/96/72/334589672.db2.gz ITSLVMMYEHDXBT-GJZGRUSLSA-N 1 3 298.430 3.874 20 0 CHADHO CC(C)[NH2+]CCCN[C@@H](C)CCc1ccc(Cl)s1 ZINC000566088304 334621313 /nfs/dbraw/zinc/62/13/13/334621313.db2.gz IPXRWPWJQSABST-LBPRGKRZSA-N 1 3 288.888 3.700 20 0 CHADHO Cc1ccc(C)c([C@@H](C)NCc2ccc(C[NH3+])cc2)c1 ZINC000572763852 334876508 /nfs/dbraw/zinc/87/65/08/334876508.db2.gz GVCJMDCGAJAFRE-OAHLLOKOSA-N 1 3 268.404 3.613 20 0 CHADHO CCC1(C[NH2+]C2CCN(C3CCCCC3)CC2)CCC1 ZINC000165308876 334894298 /nfs/dbraw/zinc/89/42/98/334894298.db2.gz ZEDWDOSOZOEDGY-UHFFFAOYSA-N 1 3 278.484 3.953 20 0 CHADHO CCC[NH+]1CCC(CN[C@@H](C)c2cccc(F)c2F)CC1 ZINC000183257743 335883445 /nfs/dbraw/zinc/88/34/45/335883445.db2.gz MOAFFFSEXMEFTB-ZDUSSCGKSA-N 1 3 296.405 3.737 20 0 CHADHO Cc1cc([C@H](C)[NH2+]CCCN2CCC(C)CC2)cs1 ZINC000381377097 336060745 /nfs/dbraw/zinc/06/07/45/336060745.db2.gz OHWLUMDSIVCSKI-HNNXBMFYSA-N 1 3 280.481 3.829 20 0 CHADHO CCN1CCC[C@H](C[NH2+]CCC2CCCCCC2)C1 ZINC000581455287 336080206 /nfs/dbraw/zinc/08/02/06/336080206.db2.gz CDKBDESRNKGWGY-QGZVFWFLSA-N 1 3 266.473 3.668 20 0 CHADHO CC[C@H](NCC1CC[NH+](CC)CC1)c1cc(F)ccc1F ZINC000581583202 336106222 /nfs/dbraw/zinc/10/62/22/336106222.db2.gz WONJZNZPTXQFSH-KRWDZBQOSA-N 1 3 296.405 3.737 20 0 CHADHO C/C(=C/c1ccccc1)C[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000236695439 518415404 /nfs/dbraw/zinc/41/54/04/518415404.db2.gz PSVOKGNEHWFVGO-PEZBUJJGSA-N 1 3 286.463 3.942 20 0 CHADHO CCN(C)C[C@@H]1CC[N@H+](Cc2csc3ccccc23)C1 ZINC000072859411 520248481 /nfs/dbraw/zinc/24/84/81/520248481.db2.gz KCAADUOFECPYOU-AWEZNQCLSA-N 1 3 288.460 3.675 20 0 CHADHO CCN(C)C[C@@H]1CC[N@@H+](Cc2csc3ccccc23)C1 ZINC000072859411 520248484 /nfs/dbraw/zinc/24/84/84/520248484.db2.gz KCAADUOFECPYOU-AWEZNQCLSA-N 1 3 288.460 3.675 20 0 CHADHO CC[NH+](CC)Cc1ccc(CNCc2cnccc2C)cc1 ZINC000280001315 520749675 /nfs/dbraw/zinc/74/96/75/520749675.db2.gz RVADKLPKLSSALO-UHFFFAOYSA-N 1 3 297.446 3.522 20 0 CHADHO CCC[C@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccccc1 ZINC000037649494 521162147 /nfs/dbraw/zinc/16/21/47/521162147.db2.gz FWZMQBHBZBPWAT-QAPCUYQASA-N 1 3 272.436 3.602 20 0 CHADHO CCC[C@H](NC[C@H]1CC[N@H+](C2CC2)C1)c1ccccc1 ZINC000037649494 521162153 /nfs/dbraw/zinc/16/21/53/521162153.db2.gz FWZMQBHBZBPWAT-QAPCUYQASA-N 1 3 272.436 3.602 20 0 CHADHO C[NH+](C)Cc1cccc(CN[C@H]2CCc3cc(F)ccc32)c1 ZINC000123584000 521923646 /nfs/dbraw/zinc/92/36/46/521923646.db2.gz BVHNYCLZKPJTLK-IBGZPJMESA-N 1 3 298.405 3.664 20 0 CHADHO CC[C@@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(C)cc1 ZINC000037649152 522857416 /nfs/dbraw/zinc/85/74/16/522857416.db2.gz FCBQOFFGWZJELH-MAUKXSAKSA-N 1 3 272.436 3.520 20 0 CHADHO CC[C@@H](NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(C)cc1 ZINC000037649152 522857420 /nfs/dbraw/zinc/85/74/20/522857420.db2.gz FCBQOFFGWZJELH-MAUKXSAKSA-N 1 3 272.436 3.520 20 0 CHADHO CC[C@@H](N[C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000129626108 522948705 /nfs/dbraw/zinc/94/87/05/522948705.db2.gz OKKDMGPFEUHTQZ-UHOFOFEASA-N 1 3 280.843 3.863 20 0 CHADHO CC[C@@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000129626108 522948716 /nfs/dbraw/zinc/94/87/16/522948716.db2.gz OKKDMGPFEUHTQZ-UHOFOFEASA-N 1 3 280.843 3.863 20 0 CHADHO C[N@H+](Cc1ccccc1)C1CCC(NCc2ccco2)CC1 ZINC000281103532 523342085 /nfs/dbraw/zinc/34/20/85/523342085.db2.gz WCAGJRNQXVYLIV-UHFFFAOYSA-N 1 3 298.430 3.812 20 0 CHADHO C[N@@H+](Cc1ccccc1)C1CCC(NCc2ccco2)CC1 ZINC000281103532 523342094 /nfs/dbraw/zinc/34/20/94/523342094.db2.gz WCAGJRNQXVYLIV-UHFFFAOYSA-N 1 3 298.430 3.812 20 0 CHADHO C[C@H](CCN[C@@H]1C[C@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000157445788 524195562 /nfs/dbraw/zinc/19/55/62/524195562.db2.gz HSFJZLSDYLZSLM-MDASCCDHSA-N 1 3 280.415 3.915 20 0 CHADHO C[C@H](CCc1ccccc1)N[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000157275145 524247553 /nfs/dbraw/zinc/24/75/53/524247553.db2.gz WURXXCRRAWZQEW-MDASCCDHSA-N 1 3 280.415 3.742 20 0 CHADHO C[C@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1cccc(F)c1 ZINC000037786241 525292384 /nfs/dbraw/zinc/29/23/84/525292384.db2.gz OEIHPSZYKSQBTO-ZDUSSCGKSA-N 1 3 278.415 3.739 20 0 CHADHO CSc1ccc([C@H](C)NC[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000037649183 526070658 /nfs/dbraw/zinc/07/06/58/526070658.db2.gz NCEYQEHAFMBTIF-KBPBESRZSA-N 1 3 290.476 3.543 20 0 CHADHO CSc1ccc([C@H](C)NC[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000037649183 526070666 /nfs/dbraw/zinc/07/06/66/526070666.db2.gz NCEYQEHAFMBTIF-KBPBESRZSA-N 1 3 290.476 3.543 20 0 CHADHO CC(C)(C)OCCCCN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000354890196 526549218 /nfs/dbraw/zinc/54/92/18/526549218.db2.gz KETJUXAZEVOXDM-KRWDZBQOSA-N 1 3 296.499 3.532 20 0 CHADHO CCN1CC[C@H](C[NH2+][C@H](CCC(C)C)c2ccoc2)C1 ZINC000353437151 527815076 /nfs/dbraw/zinc/81/50/76/527815076.db2.gz DGNSHRISKWBOKU-NVXWUHKLSA-N 1 3 278.440 3.688 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1C[NH+]1CCC(N2CCCC2)CC1 ZINC000191047196 528107979 /nfs/dbraw/zinc/10/79/79/528107979.db2.gz UWZVILIDIHHFGH-WMZOPIPTSA-N 1 3 276.468 3.539 20 0 CHADHO CC1=CCC[C@H](C)[C@H]1CN1CCC([NH+]2CCCC2)CC1 ZINC000191047196 528107984 /nfs/dbraw/zinc/10/79/84/528107984.db2.gz UWZVILIDIHHFGH-WMZOPIPTSA-N 1 3 276.468 3.539 20 0 CHADHO CCCCc1oc2ccccc2c1CN1CC[C@@H](C[NH3+])C1 ZINC000347137615 529066274 /nfs/dbraw/zinc/06/62/74/529066274.db2.gz UWHGRJQTSQIELN-AWEZNQCLSA-N 1 3 286.419 3.556 20 0 CHADHO