smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCN(C[C@@H](O)COC(C)(C)C)[C@@H](C)C(=O)Nc1ccccc1 ZINC000160077661 206277882 /nfs/dbraw/zinc/27/78/82/206277882.db2.gz OEOJKRUBBCYORH-DOTOQJQBSA-N 0 1 336.476 2.902 10 70 EFIEMN O=C(Nc1ccc(O[C@@H]2CCOC2)cc1)N1CCN2CCCC[C@@H]2C1 ZINC000160269500 206287717 /nfs/dbraw/zinc/28/77/17/206287717.db2.gz JXNXEDBLCNOXSR-SJLPKXTDSA-N 0 1 345.443 2.556 10 70 EFIEMN C[C@H](C(=O)N1CCc2ccccc21)N1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000160675495 206309121 /nfs/dbraw/zinc/30/91/21/206309121.db2.gz GRQLYMHBAVYHNX-WRWLIDTKSA-N 0 1 328.456 2.591 10 70 EFIEMN Cc1cc(C[C@H](C)NC(=O)NCCOc2ccccc2Cl)n[nH]1 ZINC000160750051 206311256 /nfs/dbraw/zinc/31/12/56/206311256.db2.gz CRWSHYPPULQROB-NSHDSACASA-N 0 1 336.823 2.681 10 70 EFIEMN COc1ccc(OCCCC(=O)N[C@@H](C)Cc2cc(C)[nH]n2)cc1 ZINC000161103136 206327479 /nfs/dbraw/zinc/32/74/79/206327479.db2.gz QMMHYMVSEAASOV-ZDUSSCGKSA-N 0 1 331.416 2.633 10 70 EFIEMN Cc1cc(C[C@H](C)NC(=O)c2ccc(OC[C@H]3CCCO3)cc2)n[nH]1 ZINC000161210801 206336328 /nfs/dbraw/zinc/33/63/28/206336328.db2.gz NXFRICZLZMYQFY-SCLBCKFNSA-N 0 1 343.427 2.637 10 70 EFIEMN Cc1cc(C[C@H](C)NC(=O)c2ccc(OC[C@@H]3CCCO3)cc2)n[nH]1 ZINC000161210554 206336506 /nfs/dbraw/zinc/33/65/06/206336506.db2.gz NXFRICZLZMYQFY-UGSOOPFHSA-N 0 1 343.427 2.637 10 70 EFIEMN Cc1cc(C[C@H](C)NC(=O)CCC(=O)c2ccc(F)cc2F)n[nH]1 ZINC000161247844 206337712 /nfs/dbraw/zinc/33/77/12/206337712.db2.gz WPRIPCZCCVVLHY-JTQLQIEISA-N 0 1 335.354 2.707 10 70 EFIEMN Cc1cc(C[C@H](C)NC(=O)c2ccc3c(c2)NC(=O)[C@H](C)S3)n[nH]1 ZINC000161475508 206350977 /nfs/dbraw/zinc/35/09/77/206350977.db2.gz PHJUMKWICMZYCE-ONGXEEELSA-N 0 1 344.440 2.512 10 70 EFIEMN Cc1cc(C[C@H](C)NC(=O)c2cc(C)nc3c2cnn3C(C)C)n[nH]1 ZINC000161491992 206351860 /nfs/dbraw/zinc/35/18/60/206351860.db2.gz FWUKQNZNRUNDPN-NSHDSACASA-N 0 1 340.431 2.713 10 70 EFIEMN CN(C)[C@@H](Cc1ccccc1)C(=O)NCCc1cc2ccccc2[nH]1 ZINC000159611681 544797423 /nfs/dbraw/zinc/79/74/23/544797423.db2.gz DGXQNQJIYSOBGZ-FQEVSTJZSA-N 0 1 335.451 3.000 10 70 EFIEMN CCC[C@H](C(=O)Nc1ccc(I)cc1)N(C)C ZINC000161166218 473213020 /nfs/dbraw/zinc/21/30/20/473213020.db2.gz QOOSDJXINKCTPH-GFCCVEGCSA-N 0 1 346.212 2.960 10 70 EFIEMN Cc1cc(C[C@@H](C)NC(=O)c2cc(-c3ccc(F)cc3)on2)n[nH]1 ZINC000161166859 473214114 /nfs/dbraw/zinc/21/41/14/473214114.db2.gz GOMDBOZSFLEPTB-SNVBAGLBSA-N 0 1 328.347 2.873 10 70 EFIEMN Cc1cc(C[C@H](C)NC(=O)c2c[nH]nc2-c2ccccc2F)n[nH]1 ZINC000161184930 473216313 /nfs/dbraw/zinc/21/63/13/473216313.db2.gz KGSDCYDKPFAYHU-JTQLQIEISA-N 0 1 327.363 2.608 10 70 EFIEMN Cc1cc(C[C@H](C)NC(=O)c2ccn(-c3cccc(Cl)c3)n2)n[nH]1 ZINC000161263585 473221914 /nfs/dbraw/zinc/22/19/14/473221914.db2.gz OZDUXHUQIDVVKM-NSHDSACASA-N 0 1 343.818 2.918 10 70 EFIEMN Cc1ccc(C)c([C@@H]2CN(C(=O)c3ccc(CN)o3)[C@@H](C)CO2)c1 ZINC000161274196 473222440 /nfs/dbraw/zinc/22/24/40/473222440.db2.gz FBDGAADMLYGWSJ-KSSFIOAISA-N 0 1 328.412 2.957 10 70 EFIEMN Brc1ccc2nc(CN3CCOC[C@@H]3C3CC3)[nH]c2c1 ZINC000161271283 473222846 /nfs/dbraw/zinc/22/28/46/473222846.db2.gz VLJZKNDSVVNTGP-CQSZACIVSA-N 0 1 336.233 2.936 10 70 EFIEMN O=C(Nc1nc(-c2ccccn2)n[nH]1)[C@H]1C[C@H]1c1cc(F)ccc1F ZINC000161482383 473239278 /nfs/dbraw/zinc/23/92/78/473239278.db2.gz XMQSJYOKXHKLAW-JQWIXIFHSA-N 0 1 341.321 2.887 10 70 EFIEMN COc1ccc2c(c1)[nH]cc(C(=O)N[C@@H]1CCO[C@@H](C3CC3)C1)c2=O ZINC000159393203 473024464 /nfs/dbraw/zinc/02/44/64/473024464.db2.gz QJHLMTKMUPLNBI-SJKOYZFVSA-N 0 1 342.395 2.636 10 70 EFIEMN Cc1n[nH]c(C(C)C)c1C(=O)Nc1cccc(C(=O)NC2CC2)c1 ZINC000159449746 473029430 /nfs/dbraw/zinc/02/94/30/473029430.db2.gz PLOONXLPUPEELN-UHFFFAOYSA-N 0 1 326.400 2.986 10 70 EFIEMN CCOc1c(Cl)cc(CN2C[C@@H](C(N)=O)CC[C@@H]2C)cc1OC ZINC000159535405 473037373 /nfs/dbraw/zinc/03/73/73/473037373.db2.gz SDSYUPMPMQRYCX-AAEUAGOBSA-N 0 1 340.851 2.833 10 70 EFIEMN C[C@@H](C(=O)OC(C)(C)C)N(C)CC1CCN(C(=O)C(C)(C)C)CC1 ZINC000159991135 473079036 /nfs/dbraw/zinc/07/90/36/473079036.db2.gz HTNQIFYZWKFNSD-AWEZNQCLSA-N 0 1 340.508 2.933 10 70 EFIEMN Cc1nc(CCNC(=O)c2c[n-]c3[nH+]c(C)ccc3c2=O)sc1C ZINC000160091184 473087208 /nfs/dbraw/zinc/08/72/08/473087208.db2.gz OUBIEAFDDRXQKD-UHFFFAOYSA-N 0 1 342.424 2.690 10 70 EFIEMN COc1ccc(-c2ncc(C(=O)N3C[C@H]4CCC[C@@H](C3)N4)s2)cc1 ZINC000160214550 473096720 /nfs/dbraw/zinc/09/67/20/473096720.db2.gz RYVZBYKMHWKXTQ-OKILXGFUSA-N 0 1 343.452 2.785 10 70 EFIEMN CC(C)[C@@H]1CN(C)CCN1C(=O)NCCc1c[nH]c2ccc(F)cc12 ZINC000160236845 473098842 /nfs/dbraw/zinc/09/88/42/473098842.db2.gz RJLDZYGHCKJZED-SFHVURJKSA-N 0 1 346.450 2.831 10 70 EFIEMN CC1(C)CCC(CNC(=O)NCCCCN2CCOCC2)CC1 ZINC000160260936 473102624 /nfs/dbraw/zinc/10/26/24/473102624.db2.gz HUFQGVHRHANJNA-UHFFFAOYSA-N 0 1 325.497 2.614 10 70 EFIEMN Cc1cccc2nc(CNC(=O)[C@H]3CCCN3c3nccs3)[nH]c21 ZINC000160289888 473104675 /nfs/dbraw/zinc/10/46/75/473104675.db2.gz MYVBZESFQQBNSJ-CYBMUJFWSA-N 0 1 341.440 2.613 10 70 EFIEMN Cc1nc(CCC(=O)N2C[C@H]3CCC[C@@H](C2)N3)oc1-c1ccccc1 ZINC000160408703 473119641 /nfs/dbraw/zinc/11/96/41/473119641.db2.gz RNONBYKBADSGTP-CALCHBBNSA-N 0 1 339.439 2.936 10 70 EFIEMN O=C(COc1ccc(Cl)c2cccnc12)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000160417568 473121128 /nfs/dbraw/zinc/12/11/28/473121128.db2.gz NDYFMVUDLSVXIY-BETUJISGSA-N 0 1 345.830 2.620 10 70 EFIEMN Cc1cccc2nc(CNC(=O)c3ccc(-c4ccco4)[nH]c3=O)[nH]c21 ZINC000160514858 473136179 /nfs/dbraw/zinc/13/61/79/473136179.db2.gz XHYCSNRXXWAGES-UHFFFAOYSA-N 0 1 348.362 2.750 10 70 EFIEMN O=C(c1cc(-c2cccc(Cl)c2)on1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000160520515 473137195 /nfs/dbraw/zinc/13/71/95/473137195.db2.gz TVXHMSQLXMHASN-OKILXGFUSA-N 0 1 331.803 2.962 10 70 EFIEMN Cc1cccc2nc(CNC(=O)Nc3cc(C(N)=O)ccc3C)[nH]c21 ZINC000160532724 473137579 /nfs/dbraw/zinc/13/75/79/473137579.db2.gz FPLANSBGVAGERQ-UHFFFAOYSA-N 0 1 337.383 2.600 10 70 EFIEMN Cc1cc2c(cc1C)[C@@H](NCC(=O)NCC(F)(F)F)CCCO2 ZINC000160575315 473145385 /nfs/dbraw/zinc/14/53/85/473145385.db2.gz HWKFIYBKYZWODO-ZDUSSCGKSA-N 0 1 330.350 2.785 10 70 EFIEMN Cc1ccc(-c2nc(C)c(C(=O)N3C[C@H]4CCC[C@@H](C3)N4)s2)o1 ZINC000160606595 473150437 /nfs/dbraw/zinc/15/04/37/473150437.db2.gz ZXVGDAMSCVGWEZ-BETUJISGSA-N 0 1 331.441 2.986 10 70 EFIEMN Cc1cc(C[C@H](C)NC(=O)c2cnn(CC(C)C)c2C2CC2)n[nH]1 ZINC000160638486 473155621 /nfs/dbraw/zinc/15/56/21/473155621.db2.gz RXMXOQWUYIUNQV-LBPRGKRZSA-N 0 1 329.448 2.809 10 70 EFIEMN Cc1cc(C[C@H](C)NC(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)n[nH]1 ZINC000160713865 473165577 /nfs/dbraw/zinc/16/55/77/473165577.db2.gz INIOZZKQTIVMHG-YVEFUNNKSA-N 0 1 344.415 2.639 10 70 EFIEMN CCN1CCN(c2ccc(CNC(=O)[C@H]3CCC[C@H](C)C3)cn2)CC1 ZINC000160759899 473172845 /nfs/dbraw/zinc/17/28/45/473172845.db2.gz PIVFMQRKTPUJTN-WMZOPIPTSA-N 0 1 344.503 2.666 10 70 EFIEMN CCCn1nccc1NC(=O)c1cc(-c2ccc(OC)cc2)n[nH]1 ZINC000160790678 473174994 /nfs/dbraw/zinc/17/49/94/473174994.db2.gz KAQDVTUEAKZODB-UHFFFAOYSA-N 0 1 325.372 2.944 10 70 EFIEMN O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)N1CCN2CCCC[C@@H]2C1 ZINC000160964903 473194787 /nfs/dbraw/zinc/19/47/87/473194787.db2.gz SFRFUNTXGGASDB-GUDVDZBRSA-N 0 1 343.471 2.786 10 70 EFIEMN CC(C)N(CCc1nccs1)[C@H]1CCN(CC(F)(F)F)C1=O ZINC000159855629 528916720 /nfs/dbraw/zinc/91/67/20/528916720.db2.gz MXGJYEZFRUCOGQ-NSHDSACASA-N 0 1 335.395 2.559 10 70 EFIEMN CCO[C@@H](C)c1nc(CN2CCN(C[C@](C)(O)CC)CC2)cs1 ZINC000161283186 529102905 /nfs/dbraw/zinc/10/29/05/529102905.db2.gz QMPOHRBJCVPMIK-WMLDXEAASA-N 0 1 341.521 2.519 10 70 EFIEMN CCc1cc(C)c(C(=O)Nc2cc(C(N)=O)ccc2CN(C)C)o1 ZINC000161427801 529525049 /nfs/dbraw/zinc/52/50/49/529525049.db2.gz XWOKTZQXFPQAFU-UHFFFAOYSA-N 0 1 329.400 2.563 10 70 EFIEMN Cc1cccc2nc(CNC(=O)C[C@H]3c4ccccc4NC3=O)[nH]c21 ZINC000160365756 544805655 /nfs/dbraw/zinc/80/56/55/544805655.db2.gz JDCXJTJYCRLWMX-ZDUSSCGKSA-N 0 1 334.379 2.614 10 70 EFIEMN C[C@@H](c1cccc(F)c1)N1CCN(CCC(=O)N2CCCCC2)CC1 ZINC000159497768 310687972 /nfs/dbraw/zinc/68/79/72/310687972.db2.gz MYAPMGCBRFDUES-KRWDZBQOSA-N 0 1 347.478 2.907 10 70 EFIEMN COc1cccc2c1CC[C@H]2NC(=O)[C@@H](Cc1ccccc1)N(C)C ZINC000160072667 310694512 /nfs/dbraw/zinc/69/45/12/310694512.db2.gz KKSOWXZZGXOUAE-RTBURBONSA-N 0 1 338.451 2.972 10 70 EFIEMN Cc1cc(C[C@@H](C)NC(=O)c2cc(Br)ccc2F)n[nH]1 ZINC000161083533 473205120 /nfs/dbraw/zinc/20/51/20/473205120.db2.gz YCPWZSRODZVOKU-MRVPVSSYSA-N 0 1 340.196 2.981 10 70 EFIEMN Cc1cc(C[C@H](C)NC(=O)CCc2nnc(-c3ccsc3)o2)n[nH]1 ZINC000161133524 473209935 /nfs/dbraw/zinc/20/99/35/473209935.db2.gz XTANMCXQQMQGQW-JTQLQIEISA-N 0 1 345.428 2.510 10 70 EFIEMN COC(=O)CCn1nc(C)c(CN(C)Cc2ccc(F)cc2)c1C ZINC000161146192 473212094 /nfs/dbraw/zinc/21/20/94/473212094.db2.gz NNRCZHXDELNIEV-UHFFFAOYSA-N 0 1 333.407 2.834 10 70 EFIEMN CCN(CC)[C@@H](C(=O)N[C@H](C)Cc1cc(C)n[nH]1)c1ccccc1 ZINC000161158155 473213445 /nfs/dbraw/zinc/21/34/45/473213445.db2.gz ZTWCTFUQJUJMQG-RDTXWAMCSA-N 0 1 328.460 2.848 10 70 EFIEMN Cc1cc(C[C@H](C)NC(=O)c2cc(-c3ccc(F)cc3)on2)n[nH]1 ZINC000161166995 473214508 /nfs/dbraw/zinc/21/45/08/473214508.db2.gz GOMDBOZSFLEPTB-JTQLQIEISA-N 0 1 328.347 2.873 10 70 EFIEMN Cc1cc(C[C@H](C)NC(=O)CCc2cccc(OC(C)(C)C)n2)n[nH]1 ZINC000161189921 473216488 /nfs/dbraw/zinc/21/64/88/473216488.db2.gz HSAJSHDOLBCUHO-ZDUSSCGKSA-N 0 1 344.459 2.970 10 70 EFIEMN Cc1cc(C[C@H](C)NC(=O)CSc2nc3ccccc3o2)n[nH]1 ZINC000161347223 473228696 /nfs/dbraw/zinc/22/86/96/473228696.db2.gz UDHCNEXUWQFAHD-JTQLQIEISA-N 0 1 330.413 2.699 10 70 EFIEMN Cc1cc(C[C@H](C)NC(=O)c2cccc(NC(=O)[C@H]3C[C@@H]3C)c2)n[nH]1 ZINC000161500469 473239929 /nfs/dbraw/zinc/23/99/29/473239929.db2.gz PLFLGHQCACFLRB-PRXAMGSTSA-N 0 1 340.427 2.674 10 70 EFIEMN Cc1cccc2nc(CNC(=O)C(=O)Nc3ccc4[nH]ccc4c3)[nH]c21 ZINC000159364485 473022175 /nfs/dbraw/zinc/02/21/75/473022175.db2.gz KDPRTNMZOADKHB-UHFFFAOYSA-N 0 1 347.378 2.608 10 70 EFIEMN Cc1cccc2nc(CCC(=O)NC[C@]3(O)CCc4ccccc43)[nH]c21 ZINC000159429216 473027231 /nfs/dbraw/zinc/02/72/31/473027231.db2.gz VNMMYWBGTBADIT-OAQYLSRUSA-N 0 1 349.434 2.754 10 70 EFIEMN CN(C)[C@H](CNc1ccnc2c(F)cc(F)cc12)c1cnn(C)c1 ZINC000159544327 473036850 /nfs/dbraw/zinc/03/68/50/473036850.db2.gz WFKCXNQTXVDNCY-MRXNPFEDSA-N 0 1 331.370 2.961 10 70 EFIEMN C[C@H](NC(=O)[C@H]1CCCc2[nH]ncc21)c1ccccc1-n1cccn1 ZINC000159644790 473046537 /nfs/dbraw/zinc/04/65/37/473046537.db2.gz SOHYGJMQKHZALY-ZFWWWQNUSA-N 0 1 335.411 2.893 10 70 EFIEMN C[C@@H](NC(=O)[C@H]1CCCc2[nH]ncc21)c1ccccc1-n1cccn1 ZINC000159644939 473046751 /nfs/dbraw/zinc/04/67/51/473046751.db2.gz SOHYGJMQKHZALY-HIFRSBDPSA-N 0 1 335.411 2.893 10 70 EFIEMN O=C(c1cccc(OCc2cccnc2)c1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000159653305 473048931 /nfs/dbraw/zinc/04/89/31/473048931.db2.gz BDRILEFCTVMWMK-HDICACEKSA-N 0 1 337.423 2.627 10 70 EFIEMN O=C(c1cccnc1SC(F)(F)F)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000159719624 473054663 /nfs/dbraw/zinc/05/46/63/473054663.db2.gz XOGPSDOJVSYNQN-AOOOYVTPSA-N 0 1 331.363 2.660 10 70 EFIEMN Clc1ccc(C2=NO[C@H](CN3CCC(n4cncn4)CC3)C2)cc1 ZINC000159787852 473060539 /nfs/dbraw/zinc/06/05/39/473060539.db2.gz NMRRPXQIWGGXPM-INIZCTEOSA-N 0 1 345.834 2.762 10 70 EFIEMN Clc1ccc(C2=NO[C@@H](CN3CCC(n4cncn4)CC3)C2)cc1 ZINC000159788016 473061239 /nfs/dbraw/zinc/06/12/39/473061239.db2.gz NMRRPXQIWGGXPM-MRXNPFEDSA-N 0 1 345.834 2.762 10 70 EFIEMN C[C@H](C(=O)N1c2ccccc2CC[C@@H]1C)N(C)C[C@@H]1CCC[C@@H]1O ZINC000159824241 473063268 /nfs/dbraw/zinc/06/32/68/473063268.db2.gz BCORLBDVNJVHFO-HIRMHNASSA-N 0 1 330.472 2.836 10 70 EFIEMN CC(C)N(CCc1nccs1)CC(=O)NCc1ccc(F)cc1 ZINC000159850913 473065934 /nfs/dbraw/zinc/06/59/34/473065934.db2.gz ZFIGQJQTWRURKG-UHFFFAOYSA-N 0 1 335.448 2.852 10 70 EFIEMN COc1cc(F)c(NC(=O)N[C@H](C)Cc2cc(C)[nH]n2)cc1OC ZINC000159883371 473068391 /nfs/dbraw/zinc/06/83/91/473068391.db2.gz RNGKKJQMFLBIEB-SECBINFHSA-N 0 1 336.367 2.627 10 70 EFIEMN COc1cc(F)c(NC(=O)N[C@@H](C)Cc2cc(C)[nH]n2)cc1OC ZINC000159883495 473069297 /nfs/dbraw/zinc/06/92/97/473069297.db2.gz RNGKKJQMFLBIEB-VIFPVBQESA-N 0 1 336.367 2.627 10 70 EFIEMN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N2C[C@H]3CCC[C@@H](C2)N3)c1 ZINC000159946915 473074734 /nfs/dbraw/zinc/07/47/34/473074734.db2.gz AHYHMVDHSZFZFL-OKILXGFUSA-N 0 1 349.862 2.901 10 70 EFIEMN Cc1cc(C[C@H](C)NC(=O)N(C)[C@H](C)Cc2ccc(O)cc2)n[nH]1 ZINC000160065091 473084318 /nfs/dbraw/zinc/08/43/18/473084318.db2.gz COHHINRMVDYNAS-GXTWGEPZSA-N 0 1 330.432 2.627 10 70 EFIEMN O=C(c1ccc(-c2nc(C3CC3)no2)cc1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000160217684 473098527 /nfs/dbraw/zinc/09/85/27/473098527.db2.gz PLQPMCFRAJJSFX-IYBDPMFKSA-N 0 1 338.411 2.581 10 70 EFIEMN Cc1ccc(-c2n[nH]c(NC(=O)C(=O)c3ccc4c(c3)CCC4)n2)o1 ZINC000160301929 473104946 /nfs/dbraw/zinc/10/49/46/473104946.db2.gz PNBSJLJQDBGAFC-UHFFFAOYSA-N 0 1 336.351 2.683 10 70 EFIEMN CCc1c(NC(=O)c2cnc3c(c2)ncn3C)[nH]nc1-c1ccncc1 ZINC000160367580 473113123 /nfs/dbraw/zinc/11/31/23/473113123.db2.gz YXGZBIOUSRMTGW-UHFFFAOYSA-N 0 1 347.382 2.568 10 70 EFIEMN COc1cccc(OC)c1C(=O)NCc1nc2cccc(C)c2[nH]1 ZINC000160374544 473114599 /nfs/dbraw/zinc/11/45/99/473114599.db2.gz UQGQXRROVGCFAI-UHFFFAOYSA-N 0 1 325.368 2.819 10 70 EFIEMN Cc1cccc2nc(CNC(=O)c3cccc(OCC(F)F)n3)[nH]c21 ZINC000160476989 473130050 /nfs/dbraw/zinc/13/00/50/473130050.db2.gz KUMBATPZXXLHNL-UHFFFAOYSA-N 0 1 346.337 2.840 10 70 EFIEMN O=C(CCc1ccc(Br)cc1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000160684432 473160049 /nfs/dbraw/zinc/16/00/49/473160049.db2.gz JWJYLYDLYSIKST-GASCZTMLSA-N 0 1 337.261 2.735 10 70 EFIEMN CC[C@](C)(O)CN1CCO[C@H](c2ccc(Br)cc2)C1 ZINC000160692677 473162483 /nfs/dbraw/zinc/16/24/83/473162483.db2.gz BLYSLINOOFSAJA-GJZGRUSLSA-N 0 1 328.250 2.983 10 70 EFIEMN CCOC(=O)c1c(C)oc2nc(CN3CCC[C@H](C)CC3)nc(N)c21 ZINC000160718620 473165489 /nfs/dbraw/zinc/16/54/89/473165489.db2.gz VUJHBCFVZRHFLX-NSHDSACASA-N 0 1 346.431 2.912 10 70 EFIEMN CC(C)(C)c1nc(CCNC(=O)[C@H]2CCCc3[nH]ncc32)cs1 ZINC000160779869 473173425 /nfs/dbraw/zinc/17/34/25/473173425.db2.gz DCSVRZXQOZTRKP-LBPRGKRZSA-N 0 1 332.473 2.943 10 70 EFIEMN CCOc1c(Cl)cc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3)cc1OC ZINC000159830333 520595567 /nfs/dbraw/zinc/59/55/67/520595567.db2.gz 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