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CCC[N@@H+](C)C[C@@H]1CCCC[C@@H]1C 388835110 538438438 /nfs/dbraw/zinc/43/84/38/538438438.db2.gz XBEHTLUJYHTUOC-RYUDHWBXSA-N 1 1 183.339 3.155 20 0 AGADMO CCC[N@@H+](C)C[C@H]1CCCC[C@H]1C 388835113 538438440 /nfs/dbraw/zinc/43/84/40/538438440.db2.gz XBEHTLUJYHTUOC-VXGBXAGGSA-N 1 1 183.339 3.155 20 0 AGADMO CCC[N@@H+](C)C[C@@H]1CCCC[C@H]1C 388835106 538438524 /nfs/dbraw/zinc/43/85/24/538438524.db2.gz XBEHTLUJYHTUOC-NEPJUHHUSA-N 1 1 183.339 3.155 20 0 AGADMO CCC[N@@H+](C)CCCC1CCCC1 388894473 538438773 /nfs/dbraw/zinc/43/87/73/538438773.db2.gz MACZOBBPPCNHMD-UHFFFAOYSA-N 1 1 183.339 3.299 20 0 AGADMO CC1=CCC[N@H+](CCCC(C)C)C1 388939513 538438805 /nfs/dbraw/zinc/43/88/05/538438805.db2.gz WVLIFAOJVYRUDB-UHFFFAOYSA-N 1 1 181.323 3.075 20 0 AGADMO CCCCC[N@H+]1[C@@H](C)CC[C@H]1C 144593155 541306258 /nfs/dbraw/zinc/30/62/58/541306258.db2.gz WACUVDSYILAHNX-PHIMTYICSA-N 1 1 169.312 3.049 20 0 AGADMO CCC[C@H](C)[N@H+]1CCCC(C)(C)C1 144177688 541306427 /nfs/dbraw/zinc/30/64/27/541306427.db2.gz 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CC[N@@H+](C)[C@H]1CCCc2ccccc21 144147748 541307638 /nfs/dbraw/zinc/30/76/38/541307638.db2.gz DGHBWHBSISQFCE-ZDUSSCGKSA-N 1 1 189.302 3.016 20 0 AGADMO C[C@H]1CCCC[N@H+](C2CCCC2)C1 144750068 541307702 /nfs/dbraw/zinc/30/77/02/541307702.db2.gz OEDLISKNROZOMP-NSHDSACASA-N 1 1 181.323 3.051 20 0 AGADMO C[C@@H]1CC[N@@H+](CCCC(C)(C)C)C1 201129915 541314379 /nfs/dbraw/zinc/31/43/79/541314379.db2.gz HCWOEFIVDAWVCI-LLVKDONJSA-N 1 1 183.339 3.155 20 0 AGADMO CCC(CC)C[N@H+]1CCC[C@H](C)C1 200994900 541314573 /nfs/dbraw/zinc/31/45/73/541314573.db2.gz UHEYXXZUWZLVGT-NSHDSACASA-N 1 1 183.339 3.155 20 0 AGADMO C[C@H]1CC[N@@H+](CCCC(C)(C)C)C1 201129947 541314683 /nfs/dbraw/zinc/31/46/83/541314683.db2.gz HCWOEFIVDAWVCI-NSHDSACASA-N 1 1 183.339 3.155 20 0 AGADMO CCC(CC)C[N@H+]1CCC[C@@H](C)C1 200994932 541314713 /nfs/dbraw/zinc/31/47/13/541314713.db2.gz UHEYXXZUWZLVGT-LLVKDONJSA-N 1 1 183.339 3.155 20 0 AGADMO C[C@H]1CC[C@@H](C)[N@H+]1CCC(C)(C)C 201237512 541314757 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CC[C@H](C)[N@H+]1CC[C@H](C)C[C@H](C)C1 306325575 491048504 /nfs/dbraw/zinc/04/85/04/491048504.db2.gz LODZXNZLEXWOLZ-SRVKXCTJSA-N 1 1 183.339 3.153 20 0 AGADMO Cc1cc(C[N@H+](C)C(C)C)c(C)s1 306337966 491048865 /nfs/dbraw/zinc/04/88/65/491048865.db2.gz IHODWTYVVVVDJR-UHFFFAOYSA-N 1 1 197.347 3.205 20 0 AGADMO C[C@H]1CCCC[N@H+]1Cc1cccs1 306355511 491049054 /nfs/dbraw/zinc/04/90/54/491049054.db2.gz CITGQHUJVIDOCE-JTQLQIEISA-N 1 1 195.331 3.123 20 0 AGADMO C[C@@H]1CCCC[N@H+]1Cc1cccs1 306355513 491049077 /nfs/dbraw/zinc/04/90/77/491049077.db2.gz CITGQHUJVIDOCE-SNVBAGLBSA-N 1 1 195.331 3.123 20 0 AGADMO Cc1ccc(C[N@@H+]2CCC[C@H]2C)s1 306400497 491050112 /nfs/dbraw/zinc/05/01/12/491050112.db2.gz LELWOYQSDPEOPB-SECBINFHSA-N 1 1 195.331 3.041 20 0 AGADMO Cc1ccc(C[N@@H+]2CCC[C@@H]2C)s1 306400499 491050134 /nfs/dbraw/zinc/05/01/34/491050134.db2.gz LELWOYQSDPEOPB-VIFPVBQESA-N 1 1 195.331 3.041 20 0 AGADMO CC(C)C[C@@H](C)[N@H+]1CCC[C@@H](C)C1 306424207 491050822 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1 192.306 3.018 20 0 AGADMO Cc1[nH+]ccn1C[C@H]1CCC[C@H](C)C1 306436274 491051153 /nfs/dbraw/zinc/05/11/53/491051153.db2.gz GIPKZCZOJLZGSC-JQWIXIFHSA-N 1 1 192.306 3.018 20 0 AGADMO Cc1[nH+]ccn1C[C@@H]1CCC[C@H](C)C1 306436273 491051162 /nfs/dbraw/zinc/05/11/62/491051162.db2.gz GIPKZCZOJLZGSC-CMPLNLGQSA-N 1 1 192.306 3.018 20 0 AGADMO Cc1[nH+]ccn1C[C@H]1CCC[C@@H](C)C1 306436275 491051164 /nfs/dbraw/zinc/05/11/64/491051164.db2.gz GIPKZCZOJLZGSC-PWSUYJOCSA-N 1 1 192.306 3.018 20 0 AGADMO C[N@@H+](CC1CCCCCC1)C1CC1 306502394 491052423 /nfs/dbraw/zinc/05/24/23/491052423.db2.gz OOVAOIVFDSMIGP-UHFFFAOYSA-N 1 1 181.323 3.051 20 0 AGADMO CC1=CC[N@@H+]([C@H](C)CC(C)C)CC1 306545908 491052995 /nfs/dbraw/zinc/05/29/95/491052995.db2.gz WIPQQHRHZDNOHT-GFCCVEGCSA-N 1 1 181.323 3.073 20 0 AGADMO CC1=CC[N@@H+]([C@@H](C)CC(C)C)CC1 306545910 491053026 /nfs/dbraw/zinc/05/30/26/491053026.db2.gz WIPQQHRHZDNOHT-LBPRGKRZSA-N 1 1 181.323 3.073 20 0 AGADMO CC(C)CC[N@H+]1CCCC[C@H](C)C1 306548794 491053113 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3.297 20 0 AGADMO CC[C@H](C)[N@H+]1CCC[C@@H](CC)CC1 306605075 491053987 /nfs/dbraw/zinc/05/39/87/491053987.db2.gz PCTYADINDDKEAD-NWDGAFQWSA-N 1 1 183.339 3.297 20 0 AGADMO CC(C)C[N@H+]1CC[C@@H](C)C(C)(C)C1 306691910 491054489 /nfs/dbraw/zinc/05/44/89/491054489.db2.gz OREOXJVAFWOUAP-LLVKDONJSA-N 1 1 183.339 3.010 20 0 AGADMO CC(C)C[N@H+]1CC[C@H](C)C(C)(C)C1 306691911 491054524 /nfs/dbraw/zinc/05/45/24/491054524.db2.gz OREOXJVAFWOUAP-NSHDSACASA-N 1 1 183.339 3.010 20 0 AGADMO CC[N@H+]1CC[C@H]1c1ccc(Cl)cc1 306690322 491054557 /nfs/dbraw/zinc/05/45/57/491054557.db2.gz MBVGNYGREBBDPT-NSHDSACASA-N 1 1 195.693 3.107 20 0 AGADMO CC[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 306690321 491054597 /nfs/dbraw/zinc/05/45/97/491054597.db2.gz MBVGNYGREBBDPT-LLVKDONJSA-N 1 1 195.693 3.107 20 0 AGADMO CC[C@H](C)[N@H+]1CCCC(C)(C)CC1 306719893 491055033 /nfs/dbraw/zinc/05/50/33/491055033.db2.gz YQPAMEREJMAJHJ-NSHDSACASA-N 1 1 183.339 3.297 20 0 AGADMO CC[C@@H](C)[N@H+]1CCCC(C)(C)CC1 306719892 491055145 /nfs/dbraw/zinc/05/51/45/491055145.db2.gz YQPAMEREJMAJHJ-LLVKDONJSA-N 1 1 183.339 3.297 20 0 AGADMO CC(C)[N@@H+](C)C[C@@H]1CCCC[C@H]1C 306760746 491055430 /nfs/dbraw/zinc/05/54/30/491055430.db2.gz RJGRGVZDPJLSEQ-NEPJUHHUSA-N 1 1 183.339 3.153 20 0 AGADMO CC(C)[N@@H+](C)C[C@@H]1CCCC[C@@H]1C 306760763 491055508 /nfs/dbraw/zinc/05/55/08/491055508.db2.gz RJGRGVZDPJLSEQ-RYUDHWBXSA-N 1 1 183.339 3.153 20 0 AGADMO CC(C)[N@@H+](C)C[C@H]1CCCC[C@@H]1C 306760752 491055567 /nfs/dbraw/zinc/05/55/67/491055567.db2.gz RJGRGVZDPJLSEQ-NWDGAFQWSA-N 1 1 183.339 3.153 20 0 AGADMO CC(C)[N@@H+](C)C[C@H]1CCCC[C@H]1C 306760771 491055580 /nfs/dbraw/zinc/05/55/80/491055580.db2.gz RJGRGVZDPJLSEQ-VXGBXAGGSA-N 1 1 183.339 3.153 20 0 AGADMO Cc1ccsc1C[N@@H+]1CCC[C@H]1C 306781394 491055654 /nfs/dbraw/zinc/05/56/54/491055654.db2.gz DUGRBBCPWPWNPO-SNVBAGLBSA-N 1 1 195.331 3.041 20 0 AGADMO Cc1ccsc1C[N@@H+]1CCC[C@@H]1C 306781385 491055657 /nfs/dbraw/zinc/05/56/57/491055657.db2.gz DUGRBBCPWPWNPO-JTQLQIEISA-N 1 1 195.331 3.041 20 0 AGADMO CC(C)[N@@H+](C)C[C@@H]1CCC[C@H](C)C1 306849338 491056134 /nfs/dbraw/zinc/05/61/34/491056134.db2.gz NROJCQMWMNUAII-NWDGAFQWSA-N 1 1 183.339 3.153 20 0 AGADMO CC(C)[N@@H+](C)C[C@@H]1CCC[C@@H](C)C1 306849340 491056160 /nfs/dbraw/zinc/05/61/60/491056160.db2.gz NROJCQMWMNUAII-VXGBXAGGSA-N 1 1 183.339 3.153 20 0 AGADMO CC(C)[N@@H+](C)C[C@H]1CCC[C@H](C)C1 306849339 491056179 /nfs/dbraw/zinc/05/61/79/491056179.db2.gz NROJCQMWMNUAII-RYUDHWBXSA-N 1 1 183.339 3.153 20 0 AGADMO CC(C)[N@@H+](C)C[C@H]1CCC[C@@H](C)C1 306849337 491056237 /nfs/dbraw/zinc/05/62/37/491056237.db2.gz NROJCQMWMNUAII-NEPJUHHUSA-N 1 1 183.339 3.153 20 0 AGADMO C[C@H]1CC[C@@H](C)[N@H+]1CC1CCCC1 306868631 491056319 /nfs/dbraw/zinc/05/63/19/491056319.db2.gz RLJQGSMAMTVJOS-PHIMTYICSA-N 1 1 181.323 3.049 20 0 AGADMO CC[N@H+]1CC[C@H](C(C)(C)C)C[C@@H]1C 306924213 491056478 /nfs/dbraw/zinc/05/64/78/491056478.db2.gz IRKOMYDIPSTDCJ-QWRGUYRKSA-N 1 1 183.339 3.153 20 0 AGADMO CC[N@H+]1CC[C@@H](C(C)(C)C)C[C@@H]1C 306924214 491056515 /nfs/dbraw/zinc/05/65/15/491056515.db2.gz IRKOMYDIPSTDCJ-WDEREUQCSA-N 1 1 183.339 3.153 20 0 AGADMO CC[N@H+]1CC[C@@H](C(C)(C)C)C[C@H]1C 306924211 491056582 /nfs/dbraw/zinc/05/65/82/491056582.db2.gz IRKOMYDIPSTDCJ-GHMZBOCLSA-N 1 1 183.339 3.153 20 0 AGADMO CC[N@H+]1CC[C@H](C(C)(C)C)C[C@H]1C 306924212 491056589 /nfs/dbraw/zinc/05/65/89/491056589.db2.gz IRKOMYDIPSTDCJ-MNOVXSKESA-N 1 1 183.339 3.153 20 0 AGADMO C[C@@H]1CCCC[N@H+]1CC1(C)CCC1 306956663 491056956 /nfs/dbraw/zinc/05/69/56/491056956.db2.gz RWOAAAJXTLIBOG-LLVKDONJSA-N 1 1 181.323 3.051 20 0 AGADMO C[C@H]1CCCC[N@H+]1CC1(C)CCC1 306956664 491057029 /nfs/dbraw/zinc/05/70/29/491057029.db2.gz RWOAAAJXTLIBOG-NSHDSACASA-N 1 1 181.323 3.051 20 0 AGADMO CC(C)=CC[N@H+](C)C1CCCCC1 306993942 491057468 /nfs/dbraw/zinc/05/74/68/491057468.db2.gz MDDZKKIBUJQORO-UHFFFAOYSA-N 1 1 181.323 3.217 20 0 AGADMO C[C@H]1CCCC[N@H+]1Cc1ccsc1 307033282 491058026 /nfs/dbraw/zinc/05/80/26/491058026.db2.gz LPVONUMJJWCLGO-JTQLQIEISA-N 1 1 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