smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features FC(F)(F)c1ccccc1-n1ccc([C@@H]2OCCN2Cc2ccccc2)c1 216735878 OBJXMUCXLBLBED-FQEVSTJZSA-N 372.390 5.027 70 40 FKIB CC[C@H](NC(=O)/C=C/c1ccc(Cl)cc1Cl)c1ccc(C)cc1C 217908322 RNYRWWCLYJVSHZ-VQFGERMISA-N 362.300 5.891 70 40 FKIB CC(C)Oc1cccc(CNC(=O)CCc2ccc(C(C)(C)C)cc2)c1 218537896 ZXRXKTDEDMSJDU-UHFFFAOYSA-N 353.506 5.020 70 40 FKIB CC(C)c1ccc(CCCNC(=O)c2ccc(Cl)cc2Cl)cc1 217857381 LBXJWWUVNKLYEX-UHFFFAOYSA-N 350.289 5.479 70 40 FKIB C[C@H](Sc1ccccc1)C(=O)Nc1ccccc1C(=O)c1ccccc1 218056676 VOYOZRVFUAIROU-INIZCTEOSA-N 361.466 5.037 70 40 FKIB CC(C)c1ccc(CCCNC(=O)c2cc3c(ccc4ccccc43)o2)cc1 218502689 WIFUVJIOSKOXQK-UHFFFAOYSA-N 371.480 6.072 70 40 FKIB Cc1ccc2c(c1)[C@@H](NC(=O)[C@@H](C)SCc1ccccc1)CC(C)(C)O2 218069986 ZATIHWBOGSVNLA-APWZRJJASA-N 369.530 5.035 70 40 FKIB CC[C@@H](NC(=O)c1cc2c(ccc3ccccc32)o1)c1ccc(C)cc1C 218500158 MYMGNNGDJDHGLL-OAQYLSRUSA-N 357.453 6.084 70 40 FKIB FC(F)(F)c1ccccc1-n1ccc([C@@H]2OCCN2c2ccccc2)c1 216711444 OZEICLDILWFIAS-IBGZPJMESA-N 358.363 5.032 70 40 FKIB Cc1ccc([C@H](C)N(C)C(=O)OC(C)(C)C)cc1NCc1ccccc1 218283822 YEGSITUJJQWQOW-KRWDZBQOSA-N 354.494 5.535 70 40 FKIB CCCCNc1cc([C@@H](C)N(CCCC)Cc2ccccc2)ccc1C 218323707 SPTZFJXCPVMBHM-OAQYLSRUSA-N 352.566 6.570 70 40 FKIB Cc1ccc2c(c1)[C@@H](NC(=O)[C@H](C)SCc1ccccc1)CC(C)(C)O2 218070146 ZATIHWBOGSVNLA-LPHOPBHVSA-N 369.530 5.035 70 40 FKIB CC[C@H](NC(=O)[C@@H](C)Oc1cc(C)c(Cl)c(C)c1)c1ccc(C)cc1C 218715694 UFGSLIXTVSHEQG-XLIONFOSSA-N 373.924 5.608 70 40 FKIB CC[C@H](NC(=O)/C=C/c1ccc(Cl)cc1Cl)c1ccc(C)c(C)c1 217908121 BFRYECXATLHUGT-RQMBKDMJSA-N 362.300 5.891 70 40 FKIB Cc1ccc(SCCC(=O)N[C@H]2CC(C)(C)Oc3cc(C)ccc32)cc1 218149498 JPFPTTFBOLMFSH-IBGZPJMESA-N 369.530 5.204 70 40 FKIB Cc1nc(-c2ccccc2NC(=O)c2ccccc2Br)cs1 217650628 JUNGYODWWKFILK-UHFFFAOYSA-N 373.275 5.133 70 40 FKIB CC(C)(C)c1ccc(C(=O)Nc2ccccc2C(=O)c2ccccc2)cc1 217857834 ISWPHQYNZPQRJC-UHFFFAOYSA-N 357.453 5.467 70 40 FKIB Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)c1ccc(-c2ccccc2)cc1 218165465 IERMQXQBJMQWAG-QFIPXVFZSA-N 371.480 5.694 70 40 FKIB C[C@@H](CC[C@H](CS(=O)(=O)Cl)[C@@H](C)CC(C)(C)C)CC(C)(C)C 104230802 BYXWNIKZQNBQEI-HRCADAONSA-N 353.012 6.096 70 40 FKIB Cc1ccc([C@@H](C)N(C)C(=O)OC(C)(C)C)cc1NCc1ccccc1 218283768 YEGSITUJJQWQOW-QGZVFWFLSA-N 354.494 5.535 70 40 FKIB Cc1ccc(SCCC(=O)N[C@H]2CC(C)(C)Oc3ccc(C)cc32)cc1 218149334 ZPFKSHOFTOMKIB-IBGZPJMESA-N 369.530 5.204 70 40 FKIB FC(F)(F)c1ccccc1-n1ccc([C@H]2OCCN2c2ccccc2)c1 216711490 OZEICLDILWFIAS-LJQANCHMSA-N 358.363 5.032 70 40 FKIB CC[C@@H](NC(=O)[C@@H](C)Oc1cc(C)c(Cl)c(C)c1)c1ccc(C)c(C)c1 218715313 IGBNMVNLWUGVQK-YLJYHZDGSA-N 373.924 5.608 70 40 FKIB CCOc1ccc(CNc2ccc(Br)c(Cl)c2)cc1OC 218004954 GVRCDLCAYUNEPK-UHFFFAOYSA-N 370.674 5.122 70 40 FKIB Cc1ccccc1NC(=O)N1CCS[C@H]1c1ccc(Cl)c(Cl)c1 217642946 FBBDCMPJMDWFOK-INIZCTEOSA-N 367.301 5.581 70 40 FKIB CC1(C)C[C@@H](NC(=O)/C(=C/c2ccco2)c2ccccc2)c2ccccc2O1 218103622 HEVYEPFIZAQYPA-LSSXRZCCSA-N 373.452 5.239 70 40 FKIB Cc1ccc2c(c1)[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)CC(C)(C)O2 217858834 KATZTDUFJVLMPC-IBGZPJMESA-N 351.490 5.325 70 40 FKIB Cc1ccc2c(c1)[C@@H](NC(=O)c1ccc(-c3ccccc3)cc1)CC(C)(C)O2 218165310 MJAZCROBUVBCGI-QFIPXVFZSA-N 371.480 5.694 70 40 FKIB Cc1cccc(N2CCO[C@@H]2c2ccn(-c3ccc(C(F)(F)F)cc3)c2)c1 216717032 XFOYUDLHMCPKLP-HXUWFJFHSA-N 372.390 5.340 70 40 FKIB CC[C@@H](NC(=O)CSCc1cccc(Cl)c1)c1ccc(C)c(C)c1 218038307 IJAFHOURVNAYCO-LJQANCHMSA-N 361.938 5.458 70 40 FKIB O=C(Nc1ccccc1F)N1CCS[C@H]1c1ccc(Cl)c(Cl)c1 217643136 XSPOVMWCBIZHSB-HNNXBMFYSA-N 371.264 5.412 70 40 FKIB CCOc1cc(CNc2ccc(Br)c(Cl)c2)ccc1OC 218015974 CMUSWUJPVLGGGI-UHFFFAOYSA-N 370.674 5.122 70 40 FKIB O=C(/C(=C/c1ccco1)c1ccccc1)N1CCC(Cc2ccccc2)CC1 218098094 JRYCEPCICHAGTM-LYBHJNIJSA-N 371.480 5.302 70 40 FKIB Cc1ccc(S[C@@H](C)C(=O)N[C@H]2CC(C)(C)Oc3cc(C)ccc32)cc1 218140603 UJSWTLLKTKAJSD-LPHOPBHVSA-N 369.530 5.203 70 40 FKIB CCCC[B-]1(CCCC)OC(Nc2ccccc2C)=Nc2cccc[n+]21 195819323 LUYGHIPIXTXRRS-UHFFFAOYSA-N 351.303 5.303 70 40 FKIB COc1cccc(NC(=O)Nc2ccccc2Sc2ccccc2)c1 217273233 RADIQAQCANSFNR-UHFFFAOYSA-N 350.443 5.490 70 40 FKIB FC(F)(F)c1cccc(-n2ccc([C@@H]3OCCN3c3ccccc3)c2)c1 216710751 AZXVQCIKSWZRPR-IBGZPJMESA-N 358.363 5.032 70 40 FKIB Cc1cc(C(=O)N2CCS[C@H]2c2ccc(Cl)c(Cl)c2)c(C)o1 217641138 MHTWXYAFDOTODY-INIZCTEOSA-N 356.274 5.091 70 40 FKIB CC[C@H](NC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(C)cc1C 218669180 WWFAEEWIGRWPCP-AVRDEDQJSA-N 367.533 5.636 70 40 FKIB Cc1cccc(N2CCO[C@H]2c2ccn(-c3ccccc3C(F)(F)F)c2)c1 216716967 ZOUUMYQVDNHVPE-FQEVSTJZSA-N 372.390 5.340 70 40 FKIB CCCOc1ccc(CNc2ccc(Br)c(Cl)c2)cc1 218005652 NURJHAXIXWGRIL-UHFFFAOYSA-N 354.675 5.503 70 40 FKIB CCCOc1ccccc1CCCNC(=O)c1ccc(-c2ccccc2)cc1 218164388 BDHKRLRBSRSBFV-UHFFFAOYSA-N 373.496 5.505 70 40 FKIB CC(C)c1ccc(CCCNC(=O)c2ccc(-c3ccccc3)cc2)cc1 218167338 NOKGSDGNQUBQNQ-UHFFFAOYSA-N 357.497 5.840 70 40 FKIB COc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)c1ccc(C(C)(C)C)cc1 217859429 OISOXJHNRJBWDF-IBGZPJMESA-N 367.489 5.025 70 40 FKIB CC[C@H](NC(=O)CCSc1ccc(Cl)cc1)c1ccc(C)cc1C 218090041 RIRMVHJLXFYBLJ-IBGZPJMESA-N 361.938 5.707 70 40 FKIB Nc1cc(Nc2ccc(Oc3ccccc3)cc2)nc(-c2ccc(F)cc2)n1 217757033 UMJCMRKISSSKBP-UHFFFAOYSA-N 372.403 5.401 70 40 FKIB CCCOc1ccccc1CCCNC(=O)c1ccc(C(C)(C)C)cc1 217858053 INYMKTVLETWBAK-UHFFFAOYSA-N 353.506 5.136 70 40 FKIB Cc1cc(C)c(S(=O)(=O)Cl)c(Cc2ccc(-c3ccccc3)cc2)c1 102041668 LPCWPFNEZUCGCS-UHFFFAOYSA-N 370.901 5.489 70 40 FKIB CC[C@H](NC(=O)CCc1ccc(C(C)(C)C)cc1)c1ccc(C)cc1C 218542019 SVVKJUABAZMLAF-QFIPXVFZSA-N 351.534 5.801 70 40 FKIB CC[C@H](NC(=O)COc1ccc(Cl)cc1Cl)c1ccc(C)cc1C 217837767 RNDHIQIBLDJFDL-KRWDZBQOSA-N 366.288 5.257 70 40 FKIB CC1(C)C[C@H](NC(=O)c2cc3c(ccc4ccccc43)o2)c2ccccc2O1 218497908 RBFBJPQIAPLNIA-IBGZPJMESA-N 371.436 5.618 70 40 FKIB CC(C)(C)c1ccc(CCC(=O)NCCCc2ccccc2Cl)cc1 218538451 GNZPPYYBGGEQOC-UHFFFAOYSA-N 357.925 5.319 70 40 FKIB CC[C@@H](NC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(C)cc1C 218669106 WWFAEEWIGRWPCP-PGRDOPGGSA-N 367.533 5.636 70 40 FKIB COc1ccc(Cl)cc1CNc1ccc(Br)c(Cl)c1 218007432 JBSXYSCLWZATQS-UHFFFAOYSA-N 361.066 5.377 70 40 FKIB Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)c1ccc(-c2ccccc2)cc1 218165520 IERMQXQBJMQWAG-JOCHJYFZSA-N 371.480 5.694 70 40 FKIB CCCN(Cc1ccccc1)[C@@H](C)c1ccc(C)c(NCc2ccccc2)c1 218322506 XATUATCOYLXIRL-QFIPXVFZSA-N 372.556 6.580 70 40 FKIB Cc1ccccc1NC(=O)N1CCS[C@@H]1c1ccc(Cl)c(Cl)c1 217642869 FBBDCMPJMDWFOK-MRXNPFEDSA-N 367.301 5.581 70 40 FKIB Cc1ccc(S[C@H](C)C(=O)NCCCc2ccc(OC(C)C)cc2)cc1 218137762 ABTUNUDRMBWCBE-GOSISDBHSA-N 371.546 5.012 70 40 FKIB CC[C@@H](NC(=O)CCCOc1ccc(Cl)cc1)c1ccc(C)c(C)c1 218737726 ZPONPASIHOQHDH-HXUWFJFHSA-N 359.897 5.383 70 40 FKIB CC(C)Oc1ccc(CNc2ccc(Br)c(Cl)c2)cc1 218007204 APOHYTWAONBFHI-UHFFFAOYSA-N 354.675 5.502 70 40 FKIB O=C(NCCCc1ccccc1Cl)/C(=C/c1ccco1)c1ccccc1 218102082 YDVJNZCLUINFCK-CAPFRKAQSA-N 365.860 5.223 70 40 FKIB Cc1ccc2c(c1)[C@H](NC(=O)/C=C/c1ccc(Cl)cc1)CC(C)(C)O2 217960134 LKGNHNXBNPWVBP-JGZYNSJSSA-N 355.865 5.080 70 40 FKIB CC[C@H](NC(=O)CSCc1cccc(Cl)c1)c1ccc(C)cc1C 218038600 HDLNPMRYVZVZFI-IBGZPJMESA-N 361.938 5.458 70 40 FKIB Cc1ccc(N2CCO[C@@H]2c2ccn(-c3cccc(C(F)(F)F)c3)c2)cc1 216718978 RDPUOJIWHDIYEA-HXUWFJFHSA-N 372.390 5.340 70 40 FKIB O=C(Nc1cccs1)N1CCS[C@H]1c1ccc(C(F)(F)F)cc1 217633148 XSKNLTYIBSXTEV-ZDUSSCGKSA-N 358.410 5.046 70 40 FKIB CCCOc1ccccc1CCCNC(=O)[C@H](C)Sc1ccc(C)cc1 218138649 DNVXHTVYSOGALH-SFHVURJKSA-N 371.546 5.013 70 40 FKIB CCCCNc1cc([C@@H](C)N(CCCC)C(=O)OC(C)(C)C)ccc1C 218286075 HZUWPZCVGKLJIP-GOSISDBHSA-N 362.558 6.305 70 40 FKIB Brc1cccc(Cn2ccc(-c3cc4ccccc4o3)n2)c1 216690212 RYUYWHCBDAHUCA-UHFFFAOYSA-N 353.219 5.107 70 40 FKIB CC(C)c1ccc(CCCNC(=O)[C@H](C)SCc2ccccc2)cc1 218075909 ISXUTIMDZLXBJW-SFHVURJKSA-N 355.547 5.181 70 40 FKIB O=C(/C=C/c1ccc(Cl)cc1Cl)NCCCc1ccccc1Cl 217904727 TXBAAFTYFDRBRQ-CSKARUKUSA-N 368.691 5.409 70 40 FKIB Cc1ccc(N2CCO[C@H]2c2ccn(-c3ccc(C(F)(F)F)cc3)c2)cc1 216719820 DQXGRWRRSKTJPK-FQEVSTJZSA-N 372.390 5.340 70 40 FKIB Cc1cccc(N2CCO[C@@H]2c2ccn(-c3cccc(C(F)(F)F)c3)c2)c1 216716250 ZTPAUOGEDKXCBY-HXUWFJFHSA-N 372.390 5.340 70 40 FKIB CCOC(=O)c1c(C)n(CCc2ccccc2)c2ccc(OC(C)C)cc12 217762407 RQQHMWGLEFEKJQ-UHFFFAOYSA-N 365.473 5.156 70 40 FKIB CC(C)(C)c1ccc(/C=C/C(=O)NCCCc2ccccc2Cl)cc1 217950479 DIPSVBOJEVEIQX-NTCAYCPXSA-N 355.909 5.400 70 40 FKIB C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCCCc1ccc(Cl)cc1 218662976 RMWZEMAWNUXWDC-INIZCTEOSA-N 373.924 5.154 70 40 FKIB Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)[C@H](C)SCc1ccccc1 218070569 OPYRTNJSLMKVQH-QFBILLFUSA-N 369.530 5.035 70 40 FKIB CC[C@H](NC(=O)CSCc1ccc(Cl)cc1)c1ccc(C)c(C)c1 218044736 XWLVEOOWUHBDMR-IBGZPJMESA-N 361.938 5.458 70 40 FKIB CC[C@@H](NC(=O)[C@H](C)Sc1ccc(Cl)cc1)c1ccc(C)c(C)c1 217992640 FTQRGKUXFIONCX-HNAYVOBHSA-N 361.938 5.705 70 40 FKIB CC(C)Oc1cccc(CNC(=O)/C=C/c2ccc(C(C)(C)C)cc2)c1 217950056 ZBHMWFMHKJJZCB-SDNWHVSQSA-N 351.490 5.101 70 40 FKIB O=C(CCSc1ccc(Cl)cc1)NCCCc1ccccc1Cl 218086371 KMZSEDMZAJSDGA-UHFFFAOYSA-N 368.329 5.225 70 40 FKIB CC[C@H](NC(=O)[C@H](C)Oc1cc(C)c(Cl)c(C)c1)c1ccc(C)cc1C 218715833 UFGSLIXTVSHEQG-PXNSSMCTSA-N 373.924 5.608 70 40 FKIB Cc1ccc(S[C@H](C)C(=O)N[C@H]2CC(C)(C)Oc3cc(C)ccc32)cc1 218140684 UJSWTLLKTKAJSD-APWZRJJASA-N 369.530 5.203 70 40 FKIB C[C@H](Oc1ccc(Cl)cc1)C(=O)Nc1ccc(OC2CCCC2)cc1 218675295 ARWHYPJAPKXPFT-AWEZNQCLSA-N 359.853 5.067 70 40 FKIB Cc1ccc(N2CCO[C@H]2c2ccn(-c3cccc(C(F)(F)F)c3)c2)cc1 216719028 RDPUOJIWHDIYEA-FQEVSTJZSA-N 372.390 5.340 70 40 FKIB Cc1ccc(S[C@@H](C)C(=O)N[C@H]2CC(C)(C)Oc3ccc(C)cc32)cc1 218140252 XGFCGHHBDPFVGM-LPHOPBHVSA-N 369.530 5.203 70 40 FKIB CCCOc1ccccc1CCCNC(=O)CCSc1ccc(C)cc1 218148413 CCDGNBJHAWSOKL-UHFFFAOYSA-N 371.546 5.015 70 40 FKIB CCN(Cc1ccccc1)[C@@H](C)c1ccc(C)c(NCc2ccccc2)c1 218321213 ARRVJJIDIDVUOO-NRFANRHFSA-N 358.529 6.190 70 40 FKIB CCCCCCCCCCCCCCCC[Si](Cl)(Cl)Cl 195751806 RYPYGDUZKOPBEL-UHFFFAOYSA-N 359.885 8.123 70 40 FKIB CC[C@@H](NC(=O)/C=C/c1ccc(Cl)cc1Cl)c1ccc(C)c(C)c1 217908065 BFRYECXATLHUGT-LHUXKHBRSA-N 362.300 5.891 70 40 FKIB CCOc1ccc(CCCNC(=O)/C=C/c2ccc(C(C)(C)C)cc2)cc1 217952175 QSDCZLUSOGZVES-SFQUDFHCSA-N 365.517 5.145 70 40 FKIB CCCOc1ccccc1CCCNC(=O)[C@@H](C)Sc1ccc(C)cc1 218138563 DNVXHTVYSOGALH-GOSISDBHSA-N 371.546 5.013 70 40 FKIB COc1ccc(CNc2ccc(Br)c(Cl)c2)cc1Cl 218007676 HGYCACJWTYZJCZ-UHFFFAOYSA-N 361.066 5.377 70 40 FKIB Cc1ccc(SCCNC(=O)/C(=C/c2ccco2)c2ccccc2)cc1 218094822 XICXIWMDVMIDNZ-LTGZKZEYSA-N 363.482 5.037 70 40 FKIB Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)/C=C/c1ccc(Cl)cc1 217960292 MXWCAVJJBUCIJN-JGZYNSJSSA-N 355.865 5.080 70 40 FKIB CCCN(Cc1ccccc1)[C@H](C)c1ccc(C)c(NCc2ccccc2)c1 218322585 XATUATCOYLXIRL-JOCHJYFZSA-N 372.556 6.580 70 40 FKIB COCCOCCCCCCCCCCC[Si](Cl)(Cl)Cl 198597236 DZKTYWHVXBTJDX-UHFFFAOYSA-N 363.829 5.816 70 40 FKIB Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)[C@H](C)SCc1ccccc1 218070498 OPYRTNJSLMKVQH-LPHOPBHVSA-N 369.530 5.035 70 40 FKIB CCCCOc1ccc2c(c1)c(C(=O)OCC)c(C)n2Cc1ccccc1 217766620 HLOHTMVVWYYSAP-UHFFFAOYSA-N 365.473 5.354 70 40 FKIB Cc1ccc(OC[C@H](C)NC(=O)c2cc3c(ccc4ccccc43)o2)cc1 218498557 BCYQPFFXXLTDRQ-INIZCTEOSA-N 359.425 5.092 70 40 FKIB CC[C@@H](NC(=O)CSCc1cccc(Cl)c1)c1ccc(C)cc1C 218038518 HDLNPMRYVZVZFI-LJQANCHMSA-N 361.938 5.458 70 40 FKIB O=C(NCCCc1ccc(Cl)cc1)c1cc2c(ccc3ccccc32)o1 218496429 OVIOEAXLDQBWQS-UHFFFAOYSA-N 363.844 5.602 70 40 FKIB CC[C@@H](NC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(C)cc1C 218668972 WWFAEEWIGRWPCP-XMSQKQJNSA-N 367.533 5.636 70 40 FKIB CCc1ccc(N2CCO[C@H]2c2ccn(-c3ccc(Cl)cc3)c2)cc1 216729290 SMXXUUDSLHRWSM-NRFANRHFSA-N 352.865 5.229 70 40 FKIB Cc1ccc(SCCC(=O)N[C@@H]2CC(C)(C)Oc3cc(C)ccc32)cc1 218149444 JPFPTTFBOLMFSH-LJQANCHMSA-N 369.530 5.204 70 40 FKIB Cc1ccc(SCCC(=O)NCCCc2cccc(OC(C)C)c2)cc1 218147776 LALWBCFWLSGDCP-UHFFFAOYSA-N 371.546 5.013 70 40 FKIB CCN(C(=O)OC(C)(C)C)[C@@H](C)c1ccc(C)c(NCc2ccccc2)c1 218284614 OHUOWSACRYSRPV-SFHVURJKSA-N 368.521 5.925 70 40 FKIB CC(C)c1ccc(CCCNC(=O)CSc2ccc(Cl)cc2)cc1 217985265 RXRRRXKSEIAASW-UHFFFAOYSA-N 361.938 5.305 70 40 FKIB Cc1ccc(S[C@@H](C)C(=O)NCCCc2ccc(OC(C)C)cc2)cc1 218137672 ABTUNUDRMBWCBE-SFHVURJKSA-N 371.546 5.012 70 40 FKIB Cc1ccc2c(c1)[C@H](NC(=O)c1ccc(Cl)cc1Cl)CC(C)(C)O2 217855745 QSZUFXGVAUFLEY-MRXNPFEDSA-N 364.272 5.334 70 40 FKIB Cc1ccc2c(c1)[C@@H](NC(=O)c1ccc(Cl)cc1Cl)CC(C)(C)O2 217855643 QSZUFXGVAUFLEY-INIZCTEOSA-N 364.272 5.334 70 40 FKIB COc1ccc(CC(=O)N[C@@H](c2ccccc2)c2ccc(C)cc2C)cc1C 217786934 SFXNMPCSTHFSBI-VWLOTQADSA-N 373.496 5.069 70 40 FKIB CC(C)c1ccc(CCCNC(=O)[C@@H](C)SCc2ccccc2)cc1 218075823 ISXUTIMDZLXBJW-GOSISDBHSA-N 355.547 5.181 70 40 FKIB Cc1cc(C(=O)N2CCS[C@@H]2c2ccc(Cl)c(Cl)c2)c(C)o1 217641054 MHTWXYAFDOTODY-MRXNPFEDSA-N 356.274 5.091 70 40 FKIB FC(F)(F)c1ccc(-n2ccc([C@@H]3OCCN3Cc3ccccc3)c2)cc1 216735995 BIJDBDWKDYHFEE-FQEVSTJZSA-N 372.390 5.027 70 40 FKIB Cc1ccc([C@@H](C)N(C)C(=O)OC(C)(C)C)cc1NC(=O)OC(C)(C)C 218283906 OMYGDBFTFHTQLE-CQSZACIVSA-N 364.486 5.270 70 40 FKIB O=C(CCCOc1ccc(Cl)cc1)Nc1ccc(OC2CCCC2)cc1 218736053 AXGLQRIIXRKSPY-UHFFFAOYSA-N 373.880 5.459 70 40 FKIB CC[C@@H](NC(=O)[C@@H](C)Sc1ccc(Cl)cc1)c1ccc(C)c(C)c1 217992495 FTQRGKUXFIONCX-DNVCBOLYSA-N 361.938 5.705 70 40 FKIB Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)/C=C/c1ccc(Cl)cc1 217960231 MXWCAVJJBUCIJN-DBEXCURXSA-N 355.865 5.080 70 40 FKIB CCCOc1ccccc1CCCNC(=O)c1ccc(Cl)cc1Cl 217855049 GIZIZOIZZXIRCV-UHFFFAOYSA-N 366.288 5.145 70 40 FKIB CC[C@@H](NC(=O)/C=C/c1ccc(Cl)cc1Cl)c1ccc(C)cc1C 217908236 RNYRWWCLYJVSHZ-QPGLYAHGSA-N 362.300 5.891 70 40 FKIB Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)c1ccc(C(C)(C)C)cc1 217859131 CMOOJSOMHQORIO-LJQANCHMSA-N 351.490 5.325 70 40 FKIB Cc1ccc(S[C@@H](C)C(=O)N[C@@H]2CC(C)(C)Oc3cc(C)ccc32)cc1 218140446 UJSWTLLKTKAJSD-QFBILLFUSA-N 369.530 5.203 70 40 FKIB FC(F)(F)c1ccc(-n2ccc([C@@H]3OCCN3c3ccccc3)c2)cc1 216711562 NQDKKBYAYVYACN-IBGZPJMESA-N 358.363 5.032 70 40 FKIB Cc1ccccc1CSCC(=O)NCCCc1ccc(C(C)C)cc1 218020027 GTUGRPBOFJBLBB-UHFFFAOYSA-N 355.547 5.101 70 40 FKIB Cc1ccc(S[C@H](C)C(=O)NCCCc2cccc(OC(C)C)c2)cc1 218137579 VXIXLVNMMKPLHQ-GOSISDBHSA-N 371.546 5.012 70 40 FKIB COc1cccc2cc(C(=O)Nc3ccc(OC4CCCC4)cc3)oc12 218615675 HVFXSTIZSBQVJV-UHFFFAOYSA-N 351.402 5.015 70 40 FKIB C[Si](Cl)(Cl)C[Si](Cl)(Cl)C[Si](C)(Cl)Cl 196933774 DMBOORLKGDADEQ-UHFFFAOYSA-N 355.100 5.084 70 40 FKIB CC(C)c1ccc(CCCNC(=O)/C(=C/c2ccco2)c2ccccc2)cc1 218108641 YSWOVDSKBBYDNG-HKOYGPOVSA-N 373.496 5.693 70 40 FKIB CC[C@@H](NC(=O)CCSc1ccc(Cl)cc1)c1ccc(C)c(C)c1 218089795 OYILISWADRPZRJ-LJQANCHMSA-N 361.938 5.707 70 40 FKIB Cc1cccc(N2CCO[C@H]2c2ccn(-c3ccc(C(F)(F)F)cc3)c2)c1 216717079 XFOYUDLHMCPKLP-FQEVSTJZSA-N 372.390 5.340 70 40 FKIB CC(=O)c1ccc(C(=O)Nc2cccc(-c3nc4ccccc4s3)c2)cc1 217461879 CEXGEZZILGRLKS-UHFFFAOYSA-N 372.449 5.418 70 40 FKIB C[C@@H](SCc1ccccc1)C(=O)Nc1ccc(OC2CCCC2)cc1 218067910 SGTWYBHPMWBXMB-MRXNPFEDSA-N 355.503 5.268 70 40 FKIB CC(C)(C)c1ccc(/C=C/C(=O)NCCCc2ccc(Cl)cc2)cc1 217950578 OLSIPEYEVATDIK-XNTDXEJSSA-N 355.909 5.400 70 40 FKIB CC1(C)C[C@@H](NC(=O)c2cc3c(ccc4ccccc43)o2)c2ccccc2O1 218497815 RBFBJPQIAPLNIA-LJQANCHMSA-N 371.436 5.618 70 40 FKIB FC(F)(F)c1ccccc1-n1ccc([C@H]2OCCN2Cc2ccccc2)c1 216735924 OBJXMUCXLBLBED-HXUWFJFHSA-N 372.390 5.027 70 40 FKIB CC[C@H](NC(=O)COc1ccc(Cl)cc1Cl)c1ccc(C)c(C)c1 217837580 CTIIPAQBYIQTIK-KRWDZBQOSA-N 366.288 5.257 70 40 FKIB Cc1ccc(SCCC(=O)N[C@@H]2CC(C)(C)Oc3ccc(C)cc32)cc1 218149251 ZPFKSHOFTOMKIB-LJQANCHMSA-N 369.530 5.204 70 40 FKIB O=S(=O)(Cl)c1c(Cl)cc(S(F)(F)(F)(F)F)cc1Cl 103625308 SFTJTROOMWPJHR-UHFFFAOYSA-N 371.563 5.578 70 40 FKIB C[C@H](Sc1ccc(Cl)cc1)C(=O)NCCCc1ccccc1Cl 217986170 RGNVAVZLKNKPLO-ZDUSSCGKSA-N 368.329 5.223 70 40 FKIB Cc1ccc(S[C@H](C)C(=O)N[C@H]2CC(C)(C)Oc3ccc(C)cc32)cc1 218140324 XGFCGHHBDPFVGM-APWZRJJASA-N 369.530 5.203 70 40 FKIB CC[C@@H](NC(=O)[C@H](C)Oc1cc(C)c(Cl)c(C)c1)c1ccc(C)c(C)c1 218715441 IGBNMVNLWUGVQK-FXAWDEMLSA-N 373.924 5.608 70 40 FKIB FC(F)(F)c1ccc(-n2ccc([C@H]3OCCN3c3ccccc3)c2)cc1 216711606 NQDKKBYAYVYACN-LJQANCHMSA-N 358.363 5.032 70 40 FKIB CC1(C)C[C@H](NC(=O)/C=C/c2ccc(C(C)(C)C)cc2)c2ccccc2O1 217952067 NGJSBGAHEJUKER-IURSYISVSA-N 363.501 5.416 70 40 FKIB Cc1ccc(S[C@@H](C)C(=O)NCCCc2cccc(OC(C)C)c2)cc1 218137512 VXIXLVNMMKPLHQ-SFHVURJKSA-N 371.546 5.012 70 40 FKIB C[C@@H](Sc1ccc(Cl)cc1)C(=O)NCCCc1ccccc1Cl 217986068 RGNVAVZLKNKPLO-CYBMUJFWSA-N 368.329 5.223 70 40 FKIB C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCCCc1ccccc1Cl 218662710 AKEYANBRWNEAOI-MRXNPFEDSA-N 373.924 5.154 70 40 FKIB CC[C@@H](NC(=O)CCc1ccc(C(C)(C)C)cc1)c1ccc(C)c(C)c1 218541779 VTCZZDBGPQYWRK-JOCHJYFZSA-N 351.534 5.801 70 40 FKIB CC[C@@H](NC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(C)c(C)c1 218668648 SHZFTAXSFSLOQF-XMSQKQJNSA-N 367.533 5.636 70 40 FKIB CCOc1ccc(CCCNC(=O)c2cc3c(ccc4ccccc43)o2)cc1 218498013 PZTQBDCDPQNWBT-UHFFFAOYSA-N 373.452 5.347 70 40 FKIB COc1ccc(CC(=O)N[C@H](c2ccccc2)c2ccc(C)cc2C)cc1C 217786853 SFXNMPCSTHFSBI-RUZDIDTESA-N 373.496 5.069 70 40 FKIB CC[C@@H](NC(=O)[C@H](C)Sc1ccc(Cl)cc1)c1ccc(C)cc1C 217992986 MONXIFPWKRKZMG-HNAYVOBHSA-N 361.938 5.705 70 40 FKIB Cc1ccc2c(c1)[C@H](NC(=O)/C=C/c1ccccc1Cl)CC(C)(C)O2 217901829 YXGCXBXFMOZYEM-SXAWMYDMSA-N 355.865 5.080 70 40 FKIB O=S(=O)(Oc1cc(C2CCCCC2)c2ccccc2c1)C(F)(F)F 1772490925 IHXBURFUZSCXMC-UHFFFAOYSA-N 358.381 5.116 70 40 FKIB FC(F)(F)c1ccc(-n2ccc([C@H]3OCCN3Cc3ccccc3)c2)cc1 216736048 BIJDBDWKDYHFEE-HXUWFJFHSA-N 372.390 5.027 70 40 FKIB O=C(CSc1ccc(Cl)cc1)Nc1ccc(OC2CCCC2)cc1 217981106 DCEDUGTXZJSOIX-UHFFFAOYSA-N 361.894 5.392 70 40 FKIB CCN(C(=O)OC(C)(C)C)[C@H](C)c1ccc(C)c(NCc2ccccc2)c1 218284656 OHUOWSACRYSRPV-GOSISDBHSA-N 368.521 5.925 70 40 FKIB COc1ccc2c(c1)[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)CC(C)(C)O2 217859252 IYAFGLOXTIEUQL-IBGZPJMESA-N 367.489 5.025 70 40 FKIB C[C@H](Sc1ccc(Cl)cc1)C(=O)NCCCc1ccc(Cl)cc1 217986351 ZBRBSUYMPSELMF-ZDUSSCGKSA-N 368.329 5.223 70 40 FKIB O=C(CCSc1ccc(Cl)cc1)NCCCc1ccc(Cl)cc1 218086490 JGERBILFLILJSO-UHFFFAOYSA-N 368.329 5.225 70 40 FKIB CC[C@H](NC(=O)[C@H](C)Sc1ccc(Cl)cc1)c1ccc(C)c(C)c1 217992719 FTQRGKUXFIONCX-KXBFYZLASA-N 361.938 5.705 70 40 FKIB CC[C@@H](NC(=O)COc1ccc(Cl)cc1Cl)c1ccc(C)cc1C 217837686 RNDHIQIBLDJFDL-QGZVFWFLSA-N 366.288 5.257 70 40 FKIB CC(C)c1ccc(CCCNC(=O)/C=C/c2ccc(C(C)(C)C)cc2)cc1 217956479 NYKBDLHVFKAXBF-SFQUDFHCSA-N 363.545 5.870 70 40 FKIB CC[C@@H](NC(=O)CSCc1ccc(Cl)cc1)c1ccc(C)cc1C 218044829 ZZPBTTYKAZSZPP-LJQANCHMSA-N 361.938 5.458 70 40 FKIB O=C(NCCCc1ccccc1Cl)c1cc2c(ccc3ccccc32)o1 218496322 GACYFVWIKCZQOB-UHFFFAOYSA-N 363.844 5.602 70 40 FKIB Cc1ccccc1OC[C@@H](C)NC(=O)c1cc2c(ccc3ccccc32)o1 218498330 JISVMYRBUNNYCY-MRXNPFEDSA-N 359.425 5.092 70 40 FKIB O=C(NCCCc1ccc(Cl)cc1)/C(=C/c1ccco1)c1ccccc1 218102183 LNXAWVAXIDWLFH-LTGZKZEYSA-N 365.860 5.223 70 40 FKIB FC(F)(F)c1cccc(-n2ccc([C@H]3OCCN3Cc3ccccc3)c2)c1 216735200 FKMFFABXBCEBQR-HXUWFJFHSA-N 372.390 5.027 70 40 FKIB CC(C)(C)c1ccc2c(c1)-c1cc(C(C)(C)C)ccc1C2[Si](C)(C)Cl 195756875 JYVPXZASPWCOSW-UHFFFAOYSA-N 371.040 7.377 70 40 FKIB C[C@H](SCc1ccccc1)C(=O)Nc1ccc(OC2CCCC2)cc1 218067970 SGTWYBHPMWBXMB-INIZCTEOSA-N 355.503 5.268 70 40 FKIB O=C(CCSc1ccccc1)Nc1ccccc1C(=O)c1ccccc1 218080305 KYLDIAOFMMQBJM-UHFFFAOYSA-N 361.466 5.039 70 40 FKIB Cc1ccc(N2CCO[C@H]2c2ccn(-c3ccccc3C(F)(F)F)c2)cc1 216719703 CNCZVDHRXYDIME-FQEVSTJZSA-N 372.390 5.340 70 40 FKIB CC[C@@H](NC(=O)/C(=C/c1ccco1)c1ccccc1)c1ccc(C)c(C)c1 218105844 YHPZCZNKJOTGEX-PLJYQOKSSA-N 359.469 5.705 70 40 FKIB Cc1ccc(S[C@@H](C)C(=O)NCCCc2ccc(C(C)C)cc2)cc1 218146129 KPFFOFVHRHCCPJ-SFHVURJKSA-N 355.547 5.348 70 40 FKIB CC[C@@H](NC(=O)CSCc1ccc(Cl)cc1)c1ccc(C)c(C)c1 218044662 XWLVEOOWUHBDMR-LJQANCHMSA-N 361.938 5.458 70 40 FKIB Cc1cccc(CSCCNC(=O)/C=C/c2ccc(C(C)(C)C)cc2)c1 217949288 FUHCSLXZFOCILJ-JLHYYAGUSA-N 367.558 5.355 70 40 FKIB Cc1ccccc1OC[C@H](C)NC(=O)c1cc2c(ccc3ccccc32)o1 218498393 JISVMYRBUNNYCY-INIZCTEOSA-N 359.425 5.092 70 40 FKIB CC(C)(C)c1ccc(/C=C/C(=O)Nc2ccc(OC3CCCC3)cc2)cc1 217951868 CLVHVXJKQQGKBU-LICLKQGHSA-N 363.501 5.957 70 40 FKIB CCCOc1cccc(CNc2ccc(Br)c(Cl)c2)c1 218015862 NYALKLPGVCZYSM-UHFFFAOYSA-N 354.675 5.503 70 40 FKIB O=C(Nc1cccs1)N1CCS[C@@H]1c1ccc(C(F)(F)F)cc1 217633081 XSKNLTYIBSXTEV-CYBMUJFWSA-N 358.410 5.046 70 40 FKIB CC(C)c1ccc(CCCNC(=O)CCc2ccc(C(C)(C)C)cc2)cc1 218544288 GCVVYZWBEBWOQU-UHFFFAOYSA-N 365.561 5.789 70 40 FKIB CC[C@H](NC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(C)cc1C 218669039 WWFAEEWIGRWPCP-GCJKJVERSA-N 367.533 5.636 70 40 FKIB O=S(=O)(Cl)c1nc(-c2ccc(Cl)cc2)sc1-c1ccccc1 100103146 HVGGYEOWDFFIHH-UHFFFAOYSA-N 370.282 5.058 70 40 FKIB Cc1ccc(N2CCO[C@@H]2c2ccn(-c3ccc(C(F)(F)F)cc3)c2)cc1 216719768 DQXGRWRRSKTJPK-HXUWFJFHSA-N 372.390 5.340 70 40 FKIB Cc1ccc(S[C@H](C)C(=O)Nc2ccc(OC3CCCC3)cc2)cc1 218137937 HHJDWDQSACWOMI-MRXNPFEDSA-N 355.503 5.436 70 40 FKIB CC(C)c1ccc2oc(C3=CCN(Cc4cccc(F)c4)CC3)nc2c1 216785339 TTZJRRXSUQEWAS-UHFFFAOYSA-N 350.437 5.380 70 40 FKIB CC[C@@H](NC(=O)CCSc1ccc(Cl)cc1)c1ccc(C)cc1C 218089967 RIRMVHJLXFYBLJ-LJQANCHMSA-N 361.938 5.707 70 40 FKIB Cc1ccccc1CSCC(=O)Nc1ccc(OC2CCCC2)cc1 218015330 ZMYMWJRHADUYEB-UHFFFAOYSA-N 355.503 5.188 70 40 FKIB CC[C@H](NC(=O)[C@@H](C)Sc1ccc(Cl)cc1)c1ccc(C)c(C)c1 217992570 FTQRGKUXFIONCX-BEFAXECRSA-N 361.938 5.705 70 40 FKIB CC[C@H](NC(=O)[C@H](C)Oc1cc(C)c(Cl)c(C)c1)c1ccc(C)c(C)c1 218715524 IGBNMVNLWUGVQK-PXNSSMCTSA-N 373.924 5.608 70 40 FKIB CCc1ccc(N2CCO[C@@H]2c2ccn(-c3ccccc3Cl)c2)cc1 216729010 OLLPHIOZDZVVNH-OAQYLSRUSA-N 352.865 5.229 70 40 FKIB O=C(c1ccccc1F)N1CCS[C@H]1c1ccc(Cl)c(Cl)c1 217640956 DQJZDYVKNDJETD-INIZCTEOSA-N 356.249 5.020 70 40 FKIB CC(C)(C)c1ccc(CCC(=O)NCCCc2ccc(Cl)cc2)cc1 218538555 HENNGZUZEOANOD-UHFFFAOYSA-N 357.925 5.319 70 40 FKIB Cc1ccc(S[C@H](C)C(=O)N[C@@H]2CC(C)(C)Oc3cc(C)ccc32)cc1 218140526 UJSWTLLKTKAJSD-VQIMIIECSA-N 369.530 5.203 70 40 FKIB FC(F)(F)c1cccc(-n2ccc([C@@H]3OCCN3Cc3ccccc3)c2)c1 216735147 FKMFFABXBCEBQR-FQEVSTJZSA-N 372.390 5.027 70 40 FKIB Cc1ccc(S[C@@H](C)C(=O)Nc2ccc(OC3CCCC3)cc2)cc1 218137868 HHJDWDQSACWOMI-INIZCTEOSA-N 355.503 5.436 70 40 FKIB CC[C@@H](NC(=O)[C@@H](C)Sc1ccc(Cl)cc1)c1ccc(C)cc1C 217992822 MONXIFPWKRKZMG-DNVCBOLYSA-N 361.938 5.705 70 40 FKIB Cc1ccc([C@@H](C)N(C)Cc2ccccc2)cc1NC(=O)OC(C)(C)C 218320093 LRAKUXVJDOLQFR-QGZVFWFLSA-N 354.494 5.535 70 40 FKIB CCc1ccc(N2CCO[C@H]2c2ccn(-c3ccccc3Cl)c2)cc1 216729054 OLLPHIOZDZVVNH-NRFANRHFSA-N 352.865 5.229 70 40 FKIB Cc1cccc(N2CCO[C@H]2c2ccn(-c3cccc(C(F)(F)F)c3)c2)c1 216716296 ZTPAUOGEDKXCBY-FQEVSTJZSA-N 372.390 5.340 70 40 FKIB O=C(/C=C/c1ccc(Cl)cc1Cl)NCCCc1ccc(Cl)cc1 217904841 KQUKCOYHFQRYAM-UXBLZVDNSA-N 368.691 5.409 70 40 FKIB CC1=C[C@H](C)[C@@]2(COC(=O)c3ccccc3)CO[C@@H](c3ccco3)[C@@H]1[C@H]2C 217386218 YMIQZMUWJPTDGH-ILNIPMIGSA-N 366.457 5.043 70 40 FKIB CC[C@H](NC(=O)/C(=C/c1ccco1)c1ccccc1)c1ccc(C)cc1C 218106113 FBXWDEVXERRLGG-GTRUEHEQSA-N 359.469 5.705 70 40 FKIB COc1ccc2c(c1)[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)CC(C)(C)O2 217859311 IYAFGLOXTIEUQL-LJQANCHMSA-N 367.489 5.025 70 40 FKIB Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)/C=C/c1ccccc1Cl 217901924 VQWHSLDPNXHIQS-CKDFRHGISA-N 355.865 5.080 70 40 FKIB CC(C)Oc1cccc(CNC(=O)/C=C/c2ccc(Cl)cc2Cl)c1 217904287 YYVVOMURDHLYLC-VQHVLOKHSA-N 364.272 5.110 70 40 FKIB C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCCCc1ccc(Cl)cc1 218662892 RMWZEMAWNUXWDC-MRXNPFEDSA-N 373.924 5.154 70 40 FKIB Cc1ccc(CSCC(=O)NCCCc2ccc(C(C)C)cc2)cc1 218026953 ROLMFPXCUQOEGB-UHFFFAOYSA-N 355.547 5.101 70 40 FKIB O=C(Nc1ccccc1F)N1CCS[C@@H]1c1ccc(Cl)c(Cl)c1 217643056 XSPOVMWCBIZHSB-OAHLLOKOSA-N 371.264 5.412 70 40 FKIB Cc1ccc(OC[C@@H](C)NC(=O)c2cc3c(ccc4ccccc43)o2)cc1 218498484 BCYQPFFXXLTDRQ-MRXNPFEDSA-N 359.425 5.092 70 40 FKIB CC[C@H](NC(=O)CCSc1ccc(Cl)cc1)c1ccc(C)c(C)c1 218089875 OYILISWADRPZRJ-IBGZPJMESA-N 361.938 5.707 70 40 FKIB CCOC(=O)c1c(C)n(Cc2ccccc2)c2ccc(OCC(C)C)cc12 217765783 NITLVVHTWCHXLG-UHFFFAOYSA-N 365.473 5.210 70 40 FKIB Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)/C=C/c1ccccc1Cl 217902001 VQWHSLDPNXHIQS-SXAWMYDMSA-N 355.865 5.080 70 40 FKIB C[C@@H](Sc1ccc(Cl)cc1)C(=O)NCCCc1ccc(Cl)cc1 217986275 ZBRBSUYMPSELMF-CYBMUJFWSA-N 368.329 5.223 70 40 FKIB Nc1cc(Nc2ccc(Oc3ccccc3)cc2)nc(-c2ccccc2F)n1 217756816 FBOURSODMBVQOB-UHFFFAOYSA-N 372.403 5.401 70 40 FKIB Cc1ccc(S[C@H](C)C(=O)N[C@@H]2CC(C)(C)Oc3ccc(C)cc32)cc1 218140190 XGFCGHHBDPFVGM-VQIMIIECSA-N 369.530 5.203 70 40 FKIB CC[C@@H](NC(=O)COc1ccc(Cl)cc1Cl)c1ccc(C)c(C)c1 217837500 CTIIPAQBYIQTIK-QGZVFWFLSA-N 366.288 5.257 70 40 FKIB CC[C@@H](NC(=O)c1cc2c(ccc3ccccc32)o1)c1ccc(C)c(C)c1 218499979 BWBJODLNHYVOBT-OAQYLSRUSA-N 357.453 6.084 70 40 FKIB O=C(NCc1ccc(Cl)cc1Cl)/C(=C/c1ccco1)c1ccccc1 218095688 IYSOZOMYQDUHLY-LDADJPATSA-N 372.251 5.443 70 40 FKIB CC[C@H](NC(=O)CSCc1ccc(Cl)cc1)c1ccc(C)cc1C 218044914 ZZPBTTYKAZSZPP-IBGZPJMESA-N 361.938 5.458 70 40 FKIB Cc1ccc(OCCCC(=O)Nc2ccccc2C(=O)c2ccccc2)cc1 218730160 MQRUMSKMUPWBIN-UHFFFAOYSA-N 373.452 5.024 70 40 FKIB CC[C@H](NC(=O)/C(=C/c1ccco1)c1ccccc1)c1ccc(C)c(C)c1 218105917 YHPZCZNKJOTGEX-GTRUEHEQSA-N 359.469 5.705 70 40 FKIB CCCCNc1cc([C@H](C)N(CCCC)Cc2ccccc2)ccc1C 218323795 SPTZFJXCPVMBHM-NRFANRHFSA-N 352.566 6.570 70 40 FKIB Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)[C@@H](C)SCc1ccccc1 218070431 OPYRTNJSLMKVQH-VQIMIIECSA-N 369.530 5.035 70 40 FKIB O=C(NCCSC1CCCCC1)/C(=C/c1ccco1)c1ccccc1 218099578 IOVGHTNQMRMZSZ-CAPFRKAQSA-N 355.503 5.002 70 40 FKIB CC[C@@H](NC(=O)CSCc1ccccc1Cl)c1ccc(C)cc1C 218031543 BNCUJXINAPBRNK-LJQANCHMSA-N 361.938 5.458 70 40 FKIB CCc1ccc(N2CCO[C@@H]2c2ccn(-c3ccc(Cl)cc3)c2)cc1 216729244 SMXXUUDSLHRWSM-OAQYLSRUSA-N 352.865 5.229 70 40 FKIB C[C@@H](Oc1ccc(Cl)cc1)C(=O)Nc1ccc(OC2CCCC2)cc1 218675235 ARWHYPJAPKXPFT-CQSZACIVSA-N 359.853 5.067 70 40 FKIB Cc1ccc(S[C@@H](C)C(=O)N[C@@H]2CC(C)(C)Oc3ccc(C)cc32)cc1 218140125 XGFCGHHBDPFVGM-QFBILLFUSA-N 369.530 5.203 70 40 FKIB CC[C@H](NC(=O)CCCOc1ccc(Cl)cc1)c1ccc(C)cc1C 218737933 VHOPQHYDHBIWIU-FQEVSTJZSA-N 359.897 5.383 70 40 FKIB Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)c1ccc(Cl)cc1Cl 217855884 AKFUUQXJTHLHAL-MRXNPFEDSA-N 364.272 5.334 70 40 FKIB Cc1ccc(SCCC(=O)NCCCc2ccc(OC(C)C)cc2)cc1 218147884 JHCIJLJFZKOGIT-UHFFFAOYSA-N 371.546 5.013 70 40 FKIB CCOc1ccc(CCCNC(=O)c2ccc(-c3ccccc3)cc2)cc1 218164272 AXMHPHGUHMPSAT-UHFFFAOYSA-N 359.469 5.115 70 40 FKIB CC[C@H](NC(=O)[C@H](C)Sc1ccc(Cl)cc1)c1ccc(C)cc1C 217993076 MONXIFPWKRKZMG-KXBFYZLASA-N 361.938 5.705 70 40 FKIB CC[C@H](NC(=O)CSCc1cccc(Cl)c1)c1ccc(C)c(C)c1 218038398 IJAFHOURVNAYCO-IBGZPJMESA-N 361.938 5.458 70 40 FKIB CC[C@H](NC(=O)CCCOc1ccc(Cl)cc1)c1ccc(C)c(C)c1 218737782 ZPONPASIHOQHDH-FQEVSTJZSA-N 359.897 5.383 70 40 FKIB CCN(Cc1ccccc1)[C@H](C)c1ccc(C)c(NCc2ccccc2)c1 218321280 ARRVJJIDIDVUOO-OAQYLSRUSA-N 358.529 6.190 70 40 FKIB CC(C)NC(=O)Nc1ccccc1-c1csc(-c2ccccc2F)n1 218675795 QHPRZQLYGXKBSS-UHFFFAOYSA-N 355.438 5.146 70 40 FKIB CC[C@@H](NC(=O)CCc1ccc(C(C)(C)C)cc1)c1ccc(C)cc1C 218541945 SVVKJUABAZMLAF-JOCHJYFZSA-N 351.534 5.801 70 40 FKIB CC(C)(C)c1ccc(CCC(=O)Nc2ccc(OC3CCCC3)cc2)cc1 218539655 UNPYSAQNKZACBV-UHFFFAOYSA-N 365.517 5.877 70 40 FKIB CCCOc1ccc2c(c1)c(C(=O)OCC)c(C)n2CCc1ccccc1 217761433 VTZOMMUOLJJOKN-UHFFFAOYSA-N 365.473 5.158 70 40 FKIB Cc1nc(-c2ccccc2NC(=O)c2ccc(C(C)(C)C)cc2)cs1 218591173 CKYSSRUHCCWJCU-UHFFFAOYSA-N 350.487 5.668 70 40 FKIB FC(F)(F)c1cccc(-n2ccc([C@H]3OCCN3c3ccccc3)c2)c1 216710796 AZXVQCIKSWZRPR-LJQANCHMSA-N 358.363 5.032 70 40 FKIB CC[C@H](NC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(C)c(C)c1 218668732 SHZFTAXSFSLOQF-GCJKJVERSA-N 367.533 5.636 70 40 FKIB Cc1ccc(OCCCC(=O)Nc2ccc(OC3CCCC3)cc2)cc1 218730460 YYOLRTCYGCRCFZ-UHFFFAOYSA-N 353.462 5.114 70 40 FKIB Cc1ccc2c(c1)[C@H](NC(=O)[C@H](C)SCc1ccccc1)CC(C)(C)O2 218070246 ZATIHWBOGSVNLA-QFBILLFUSA-N 369.530 5.035 70 40 FKIB CC[C@@H](NC(=O)/C(=C/c1ccco1)c1ccccc1)c1ccc(C)cc1C 218106029 FBXWDEVXERRLGG-PLJYQOKSSA-N 359.469 5.705 70 40 FKIB Cc1ccc(SCCC(=O)Nc2ccc(OC3CCCC3)cc2)cc1 218148044 LHDCNHSIBFLUPE-UHFFFAOYSA-N 355.503 5.437 70 40 FKIB CC[C@@H](NC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(C)c(C)c1 218668812 SHZFTAXSFSLOQF-PGRDOPGGSA-N 367.533 5.636 70 40 FKIB Cc1cccc(N2CCO[C@@H]2c2ccn(-c3ccccc3C(F)(F)F)c2)c1 216716927 ZOUUMYQVDNHVPE-HXUWFJFHSA-N 372.390 5.340 70 40 FKIB CCCn1c(C)c(C(=O)OCC)c2cc(OCc3ccccc3)ccc21 217766929 MYLGYVMXZYKMKV-UHFFFAOYSA-N 351.446 5.115 70 40 FKIB CC(C)c1ccc2oc(C3=CCN(Cc4ccccc4F)CC3)nc2c1 216784233 KSAHIQKRGSUJON-UHFFFAOYSA-N 350.437 5.380 70 40 FKIB COc1ccc(NC(=O)/C(=C/c2ccco2)c2ccccc2)cc1Cl 218097658 YSVVNXFFUBFZPK-GHRIWEEISA-N 353.805 5.121 70 40 FKIB CCOc1ccc(CCCNC(=O)CCc2ccc(C(C)(C)C)cc2)cc1 218539930 SHJVQAHWRMOMLD-UHFFFAOYSA-N 367.533 5.064 70 40 FKIB CC[C@H](NC(=O)CCc1ccc(C(C)(C)C)cc1)c1ccc(C)c(C)c1 218541845 VTCZZDBGPQYWRK-QFIPXVFZSA-N 351.534 5.801 70 40 FKIB Cc1ccc2c(c1)[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)CC(C)(C)O2 217858908 KATZTDUFJVLMPC-LJQANCHMSA-N 351.490 5.325 70 40 FKIB CC(C)c1ccc(CCCNC(=O)CCCOc2ccc(Cl)cc2)cc1 218739296 KFOFGCCBKAIAEH-UHFFFAOYSA-N 373.924 5.371 70 40 FKIB Cc1ccc2c(c1)[C@H](NC(=O)[C@@H](C)SCc1ccccc1)CC(C)(C)O2 218070069 ZATIHWBOGSVNLA-VQIMIIECSA-N 369.530 5.035 70 40 FKIB COc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)c1ccc(C(C)(C)C)cc1 217859518 OISOXJHNRJBWDF-LJQANCHMSA-N 367.489 5.025 70 40 FKIB O=C(Nc1ccc(OC2CCCC2)cc1)c1cc2c(ccc3ccccc32)o1 218497638 AAKVAFHZQBZTNK-UHFFFAOYSA-N 371.436 6.160 70 40 FKIB Cc1ccc2c(c1)[C@@H](NC(=O)/C=C/c1ccc(Cl)cc1)CC(C)(C)O2 217960070 LKGNHNXBNPWVBP-DBEXCURXSA-N 355.865 5.080 70 40 FKIB Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)c1ccc(C(C)(C)C)cc1 217859021 CMOOJSOMHQORIO-IBGZPJMESA-N 351.490 5.325 70 40 FKIB C[C@@H](Sc1ccccc1)C(=O)Nc1ccccc1C(=O)c1ccccc1 218056609 VOYOZRVFUAIROU-MRXNPFEDSA-N 361.466 5.037 70 40 FKIB Cc1ccc(SCCC(=O)NCCCc2ccc(C(C)C)cc2)cc1 218152426 YYUOLIFBRNKECH-UHFFFAOYSA-N 355.547 5.350 70 40 FKIB CC[C@H](NC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(C)c(C)c1 218668873 SHZFTAXSFSLOQF-AVRDEDQJSA-N 367.533 5.636 70 40 FKIB CC1(C)C[C@@H](NC(=O)/C=C/c2ccc(C(C)(C)C)cc2)c2ccccc2O1 217951992 NGJSBGAHEJUKER-IZLCOFNUSA-N 363.501 5.416 70 40 FKIB Cc1ccc(CSCC(=O)Nc2ccc(OC3CCCC3)cc2)cc1 218021958 QCMOZKKNHYOBOR-UHFFFAOYSA-N 355.503 5.188 70 40 FKIB CC1(C)C[C@H](NC(=O)CCc2ccc(C(C)(C)C)cc2)c2ccccc2O1 218539823 FXJYQPMYEYMZLL-FQEVSTJZSA-N 365.517 5.335 70 40 FKIB CCc1ccc(N2CCO[C@H]2c2ccn(-c3cccc(Cl)c3)c2)cc1 216729180 AZZJVOXSQZSCDA-NRFANRHFSA-N 352.865 5.229 70 40 FKIB Cc1ccc2c(c1)[C@@H](NC(=O)/C=C/c1ccccc1Cl)CC(C)(C)O2 217901749 YXGCXBXFMOZYEM-CKDFRHGISA-N 355.865 5.080 70 40 FKIB CC[C@H](NC(=O)CSCc1ccccc1Cl)c1ccc(C)cc1C 218031636 BNCUJXINAPBRNK-IBGZPJMESA-N 361.938 5.458 70 40 FKIB C[C@@H](CC[C@@H](CS(=O)(=O)Cl)[C@@H](C)CC(C)(C)C)CC(C)(C)C 104230794 BYXWNIKZQNBQEI-JYJNAYRXSA-N 353.012 6.096 70 40 FKIB CCOC(=O)c1cc(-c2ccc3c4c(cccc24)CC3)nc2ccccc12 216941884 DAYNSELMQHSJAI-UHFFFAOYSA-N 353.421 5.330 70 40 FKIB CC(C)c1ccc2oc(C3=CCN(Cc4ccc(F)cc4)CC3)nc2c1 216784854 QJSVTIDRCDYREG-UHFFFAOYSA-N 350.437 5.380 70 40 FKIB CC[C@H](NC(=O)[C@@H](C)Sc1ccc(Cl)cc1)c1ccc(C)cc1C 217992904 MONXIFPWKRKZMG-BEFAXECRSA-N 361.938 5.705 70 40 FKIB CC[C@@H](NC(=O)[C@@H](C)Oc1cc(C)c(Cl)c(C)c1)c1ccc(C)cc1C 218715616 UFGSLIXTVSHEQG-YLJYHZDGSA-N 373.924 5.608 70 40 FKIB CC[C@H](NC(=O)c1cc2c(ccc3ccccc32)o1)c1ccc(C)cc1C 218500252 MYMGNNGDJDHGLL-NRFANRHFSA-N 357.453 6.084 70 40 FKIB CC[C@@H](NC(=O)CCCOc1ccc(Cl)cc1)c1ccc(C)cc1C 218737866 VHOPQHYDHBIWIU-HXUWFJFHSA-N 359.897 5.383 70 40 FKIB CC[C@H](NC(=O)CSCc1ccccc1Cl)c1ccc(C)c(C)c1 218031440 RPDJZGOGBFSIQH-IBGZPJMESA-N 361.938 5.458 70 40 FKIB O=C(c1ccccc1F)N1CCS[C@@H]1c1ccc(Cl)c(Cl)c1 217640903 DQJZDYVKNDJETD-MRXNPFEDSA-N 356.249 5.020 70 40 FKIB Cc1ccc(OCCCC(=O)NCCCc2ccc(C(C)C)cc2)cc1 218734502 KDPIKZGQFNFLPK-UHFFFAOYSA-N 353.506 5.026 70 40 FKIB Cc1ccc(N2CCO[C@@H]2c2ccn(-c3ccccc3C(F)(F)F)c2)cc1 216719655 CNCZVDHRXYDIME-HXUWFJFHSA-N 372.390 5.340 70 40 FKIB CC1(C)C[C@@H](NC(=O)CCc2ccc(C(C)(C)C)cc2)c2ccccc2O1 218539755 FXJYQPMYEYMZLL-HXUWFJFHSA-N 365.517 5.335 70 40 FKIB CC[C@@H](NC(=O)CSCc1ccccc1Cl)c1ccc(C)c(C)c1 218031358 RPDJZGOGBFSIQH-LJQANCHMSA-N 361.938 5.458 70 40 FKIB Cc1ccc(S[C@H](C)C(=O)NCCCc2ccc(C(C)C)cc2)cc1 218146197 KPFFOFVHRHCCPJ-GOSISDBHSA-N 355.547 5.348 70 40 FKIB C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCCCc1ccccc1Cl 218662774 AKEYANBRWNEAOI-INIZCTEOSA-N 373.924 5.154 70 40 FKIB COc1ccc(Cl)cc1NC(=O)/C(=C/c1ccco1)c1ccccc1 218096671 FOKUOIDKSVJBTC-GHRIWEEISA-N 353.805 5.121 70 40 FKIB CCOC(=O)c1c(C)n(CC(C)C)c2ccc(OCc3ccccc3)cc12 217767141 CZMYOTVQMODCBW-UHFFFAOYSA-N 365.473 5.361 70 40 FKIB O=C(Nc1ccc(OC2CCCC2)cc1)/C(=C/c1ccco1)c1ccccc1 218103394 PQENAENFNPVSKT-HAVVHWLPSA-N 373.452 5.780 70 40 FKIB Cl[Si](Cl)(Cl)CCCCCCCCCCCBr 195996181 LLNQRNOPJAFMFQ-UHFFFAOYSA-N 368.646 6.548 70 40 FKIB Cc1nc(-c2ccccc2NC(=O)c2ccccc2C(F)(F)F)cs1 217650186 XCSPOTSWWJAAOI-UHFFFAOYSA-N 362.376 5.390 70 40 FKIB Cc1ccc2c(c1)[C@H](NC(=O)c1ccc(-c3ccccc3)cc1)CC(C)(C)O2 218165377 MJAZCROBUVBCGI-JOCHJYFZSA-N 371.480 5.694 70 40 FKIB CCCCNc1cc([C@H](C)N(CCCC)C(=O)OC(C)(C)C)ccc1C 218286112 HZUWPZCVGKLJIP-SFHVURJKSA-N 362.558 6.305 70 40 FKIB CCN(Cc1ccccc1)[C@H](C)c1ccc(C)c(NC(=O)OC(C)(C)C)c1 218321454 VKFFZZLGODHPPG-GOSISDBHSA-N 368.521 5.925 70 40 FKIB CC[C@H](NC(=O)c1cc2c(ccc3ccccc32)o1)c1ccc(C)c(C)c1 218500049 BWBJODLNHYVOBT-NRFANRHFSA-N 357.453 6.084 70 40 FKIB Cc1ccc([C@H](C)N(C)Cc2ccccc2)cc1NC(=O)OC(C)(C)C 218320162 LRAKUXVJDOLQFR-KRWDZBQOSA-N 354.494 5.535 70 40 FKIB CCN(Cc1ccccc1)[C@@H](C)c1ccc(C)c(NC(=O)OC(C)(C)C)c1 218321372 VKFFZZLGODHPPG-SFHVURJKSA-N 368.521 5.925 70 40 FKIB CC[C@@H](NC(=O)[C@H](C)Oc1cc(C)c(Cl)c(C)c1)c1ccc(C)cc1C 218715771 UFGSLIXTVSHEQG-FXAWDEMLSA-N 373.924 5.608 70 40 FKIB Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)c1ccc(Cl)cc1Cl 217855822 AKFUUQXJTHLHAL-INIZCTEOSA-N 364.272 5.334 70 40 FKIB CC1=C[C@@H](C)[C@@]2(COC(=O)c3ccccc3)CO[C@@H](c3ccco3)[C@@H]1[C@H]2C 217386298 YMIQZMUWJPTDGH-IHZIKPMLSA-N 366.457 5.043 70 40 FKIB CCc1ccc(N2CCO[C@@H]2c2ccn(-c3cccc(Cl)c3)c2)cc1 216729128 AZZJVOXSQZSCDA-OAQYLSRUSA-N 352.865 5.229 70 40 FKIB CC1(C)C[C@H](NC(=O)/C(=C/c2ccco2)c2ccccc2)c2ccccc2O1 218103692 HEVYEPFIZAQYPA-MEPUESOJSA-N 373.452 5.239 70 40 FKIB CC[C@H](NC(=O)[C@@H](C)Oc1cc(C)c(Cl)c(C)c1)c1ccc(C)c(C)c1 218715364 IGBNMVNLWUGVQK-XLIONFOSSA-N 373.924 5.608 70 40 FKIB Cc1ccc([C@H](C)N(C)C(=O)OC(C)(C)C)cc1NC(=O)OC(C)(C)C 218283945 OMYGDBFTFHTQLE-AWEZNQCLSA-N 364.486 5.270 70 40 FKIB Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)[C@@H](C)SCc1ccccc1 218070349 OPYRTNJSLMKVQH-APWZRJJASA-N 369.530 5.035 70 40 FKIB