smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features Oc1ccc2ccccc2c1[C@@H]1Nc2cccc3cccc1c23 2479679 XCHQLCVUZHVIJV-OAQYLSRUSA-N 297.357 5.214 10 1 CKCF Clc1cc(N=Nc2ccccc2)c2cccccc1-2 2356873689 YHULWJAIJGGMEE-UHFFFAOYSA-N 266.731 5.860 10 1 CKCF c1ccc(/N=N/c2ccc(/N=N/c3ccccn3)cc2)nc1 1772619446 OUWZRCLMXDTPDV-FLFKKZLDSA-N 288.314 5.307 10 1 CKCF C[C@@H](/N=N/c1ccc([N+](=O)[O-])cc1)c1cc2ccccc2o1 169692281 WZKUBHVFCARLFV-IEBXDZTQSA-N 295.298 5.186 10 1 CKCF CC(C)c1cc2c(c(O)c1O)[C@H]1CCCC(C)(C)[C@H]1CC2 2356341242 JVRVYDCPTHHIGR-ZFWWWQNUSA-N 288.431 5.077 10 1 CKCF C[C@H](/N=N/c1nc2ccccc2[nH]1)c1cc2ccccc2o1 169693943 POWRGERIAHFPTB-BMQZVHBQSA-N 290.326 5.154 10 1 CKCF Cc1ccccc1C/N=N/c1ccnc2cc(Cl)ccc12 169688557 ZTSGVRZWCHQPAS-QZQOTICOSA-N 295.773 5.481 10 1 CKCF C[C@H](/N=N/c1nc(-c2ccccc2)cs1)c1cccs1 169690010 HTGASCCYGDZTAF-SHYALIGYSA-N 299.424 5.717 10 1 CKCF Oc1c(/N=N\c2ccc(F)cc2)ccc2ccccc12 13110455 MASXPDHDCTUJJH-HNENSFHCSA-N 266.275 5.100 10 1 CKCF Clc1ccc(/N=N\C2=C3CCCN3CCC2)cc1Cl 40404908 YAFQHNJSFXNIGF-ZCXUNETKSA-N 296.201 5.178 10 1 CKCF Oc1ccc2ccccc2c1N=Nc1ccc(F)cc1 253947043 IVVQQRFRRJBPRA-UHFFFAOYSA-N 266.275 5.100 10 1 CKCF Cc1cccc2c(NCc3ccccc3)c3ccccc3nc12 96915355 AQFUXGSYNBXYBY-UHFFFAOYSA-N 298.389 5.309 10 1 CKCF Cc1ccc(C)n1-c1ccc(-c2cccc(F)c2)c(F)c1 587944332 CWBOBOMFSRXFJF-UHFFFAOYSA-N 283.321 5.039 10 1 CKCF Fc1ccccc1Nc1c2ccccc2nc2ccccc12 5422267 QXIIACIFKMJPDO-UHFFFAOYSA-N 288.325 5.271 10 1 CKCF CC(C)=CCC[C@H](C)[C@H]1CC[C@@H](C)c2c1ccc(O)c2O 2356804504 ZDQJRSMDGMFMFR-RRFJBIMHSA-N 288.431 5.461 10 1 CKCF Oc1c(N=Nc2ccccc2)sc2ccccc12 261142771 NINPOLKSNFCLDI-UHFFFAOYSA-N 254.314 5.022 10 1 CKCF Cc1cc(Nc2c3ccccc3nc3ccccc23)ccc1N 26841287 XGFSIWJJHYYEPO-UHFFFAOYSA-N 299.377 5.022 10 1 CKCF CCOc1ccc(/N=N\c2cc(C(C)C)ccc2O)cc1 13122336 RRJIYLPMVLTWJJ-HNENSFHCSA-N 284.359 5.330 10 1 CKCF Oc1cc(F)ccc1CNc1ccc(C2CCCCC2)cc1 473085572 YAZPNKURSGDXHE-UHFFFAOYSA-N 299.389 5.191 10 1 CKCF C(=C/N=N/c1nc2ccccc2s1)\Cc1ccccc1 169700558 RXKPCZQBQRSUIE-WYIFRLEHSA-N 279.368 5.136 10 1 CKCF Cc1ccc(C)n1-c1cc(OC(C)C)c(Cl)cc1Cl 587943039 JPVVDMMRPBAAAK-UHFFFAOYSA-N 298.213 5.188 10 1 CKCF Cc1ccc(/N=N/C=C2\CCCN2Cc2ccccc2)cc1 40917721 ZWHGYYXGUMXLEF-ZXNVHBCMSA-N 291.398 5.216 10 1 CKCF Cc1cc(N)ccc1Nc1c2ccccc2nc2ccccc12 26843236 GDTNZUCSSGUBNE-UHFFFAOYSA-N 299.377 5.022 10 1 CKCF CC(=O)c1cccc(/N=N\c2c(C)[nH]c3ccccc23)c1 102787267 ZWNWPKLMFFQGHG-VXPUYCOJSA-N 277.327 5.094 10 1 CKCF c1ccc(-c2csc(/N=N/Cc3cccs3)n2)cc1 169688437 QCWRQGJLTKCXFP-BMRADRMJSA-N 285.397 5.156 10 1 CKCF CC(C)c1cc2c(c(O)c1O)[C@@H]1CCCC(C)(C)[C@H]1CC2 2356341241 JVRVYDCPTHHIGR-HIFRSBDPSA-N 288.431 5.077 10 1 CKCF c1ccc2c(/N=N/C3=C4CCCN4CCC3)cccc2c1 102133871 PAQKOPZJPIUXOL-FMQUCBEESA-N 277.371 5.025 10 1 CKCF CC(C)(C)c1ccc2nc(CCCCCCN=[N+]=[N-])[nH]c2c1 587259943 JOQFCJBSFFUVJK-UHFFFAOYSA-N 299.422 5.274 10 1 CKCF Clc1ccc(-c2[nH]ncc2N=Nc2ccccc2)cc1 253978774 FEYKZYKEKLVSGU-UHFFFAOYSA-N 282.734 5.146 10 1 CKCF CC(C)(C)C(=O)Nc1ccc(/N=N\c2ccccc2)cc1 102449439 UAERVFGYVTYUNF-VXPUYCOJSA-N 281.359 5.087 10 1 CKCF CC(C)(C)c1cccc(/N=N/c2ccc(C(=O)O)cc2)c1 34110918 FJFUGBCRLUSPME-VHEBQXMUSA-N 282.343 5.098 10 1 CKCF Oc1c(/N=N/c2ccccc2)sc2ccccc12 101604423 NINPOLKSNFCLDI-FOCLMDBBSA-N 254.314 5.022 10 1 CKCF Cc1cccc2c(Nc3ccc(N)cc3)c3ccccc3nc12 26841666 DZUNTAWIHWKACZ-UHFFFAOYSA-N 299.377 5.022 10 1 CKCF Oc1ccc2ccccc2c1N=Nc1ccccc1F 253994781 BXEHJGARPVEOGU-UHFFFAOYSA-N 266.275 5.100 10 1 CKCF CN(Cc1ccccc1O)c1ccc(C2CCCCC2)cc1 473085545 XSOFHGVSJLXANP-UHFFFAOYSA-N 295.426 5.076 10 1 CKCF CCC[C@H](C)/N=N/c1nc(-c2cccc(OC)c2)cs1 169723881 VFEFBYHVWIMCDX-SHYALIGYSA-N 289.404 5.091 10 1 CKCF Clc1ccccc1-n1c(-c2ccccc2)cc2c1CCC2 1772649867 CDNWRMUPFJLIFI-UHFFFAOYSA-N 293.797 5.286 10 1 CKCF CN(C)c1ccc(/C=C/c2cc3cc(Cl)ccc3o2)cc1 40834790 DRUGFGZUILKKKR-WEVVVXLNSA-N 297.785 5.323 10 1 CKCF Cc1ccc(N)cc1Nc1c2ccccc2nc2ccccc12 26841805 QEHKQTNULLTLJL-UHFFFAOYSA-N 299.377 5.022 10 1 CKCF FC(F)(F)Oc1ccc(/N=N\c2ccccc2)cc1 1857747872 IAMZDPGCACQJGF-ZCXUNETKSA-N 266.222 5.001 10 1 CKCF Cc1ccc(C/N=N/c2ncc(Cl)cc2Cl)s1 169690191 RFVTUUGVWGOFSY-FOCLMDBBSA-N 286.187 5.042 10 1 CKCF C[C@@H](Nc1ccc(C2CCCCC2)cc1)c1ccccc1O 473084539 RJBAXCULUJDLDK-OAHLLOKOSA-N 295.426 5.613 10 1 CKCF Cc1ccc(C(C)C)n1-c1ccc(O)c(-c2ccccc2)c1 587924984 CXKINWUITCXQSS-UHFFFAOYSA-N 291.394 5.282 10 1 CKCF Cc1ccsc1C/N=N/c1ncc(Cl)cc1Cl 169690192 WSCWHCQIYYAFIT-FOCLMDBBSA-N 286.187 5.042 10 1 CKCF c1ccc(/N=N/c2cccc(/N=N/c3ccccn3)c2)nc1 1772605508 KGYAALZMFFLBRZ-FLFKKZLDSA-N 288.314 5.307 10 1 CKCF [N-]=[N+]=NCCCCCCc1nc2cc3ccccc3cc2[nH]1 587260616 WEGPTZYEGVYTFO-UHFFFAOYSA-N 293.374 5.129 10 1 CKCF Cc1[nH]c2ccccc2c1N=Nc1ccc(F)cc1 253989182 ZHCNMEQEIOIASE-UHFFFAOYSA-N 253.280 5.031 10 1 CKCF C[C@H](Nc1ccc(C2CCCCC2)cc1)c1ccccc1O 473084538 RJBAXCULUJDLDK-HNNXBMFYSA-N 295.426 5.613 10 1 CKCF CCC[C@H](CC)c1cc(O)c(O)cc1[C@H](CC)CCC 17249063 XKXVDDMUFQIEFJ-OKILXGFUSA-N 278.436 5.685 10 1 CKCF CC(=O)c1cccc(N=Nc2c(C)[nH]c3ccccc23)c1 252643784 ZWNWPKLMFFQGHG-UHFFFAOYSA-N 277.327 5.094 10 1 CKCF CCC(CC)/N=N/c1nc(-c2cccc(OC)c2)cs1 169723879 MWQAOKUXTNMPHT-ISLYRVAYSA-N 289.404 5.091 10 1 CKCF CC(C)=CCC1(CC=C(C)C)CC(=O)c2ccccc2C1=O 13460490 QKLWDNYMOAFRTG-UHFFFAOYSA-N 296.410 5.155 10 1 CKCF Cc1[nH]c2ccccc2c1/N=N\c1ccc(F)cc1 12625504 ZHCNMEQEIOIASE-HNENSFHCSA-N 253.280 5.031 10 1 CKCF C[C@@H](/N=N/c1nc2ccc(Cl)cc2o1)c1ccccc1 169689589 IVVJRUXMBNTUAF-XZDDXTHTSA-N 285.734 5.326 10 1 CKCF C[C@@H](/N=N/c1ccc(F)cc1)c1ccc(Cl)s1 169691598 WBCXPYXKDDHNRP-AOHYOPMHSA-N 268.744 5.386 10 1 CKCF Cc1[nH]c2ccccc2c1/N=N/c1ccc(F)cc1 101478489 ZHCNMEQEIOIASE-VHEBQXMUSA-N 253.280 5.031 10 1 CKCF C[C@H](/N=N/c1nc2ccccc2s1)c1cccs1 169693947 ONVDGJXRMVWIJE-FZQCLQRZSA-N 273.386 5.203 10 1 CKCF CCn1nc(-c2ccccc2)c2cccc-2c1-c1ccccc1 5318762 MVLJPFZVDVZRLE-UHFFFAOYSA-N 298.389 5.342 10 1 CKCF biogenic Oc1ccc2ccccc2c1/N=N/c1ccsc1 17195847 OXSLWSAORQFBOQ-FOCLMDBBSA-N 254.314 5.022 10 1 CKCF Cc1ccc(Cl)c2c(N=Nc3ccccc3)c(O)[nH]c12 253928448 IBLQIPCGFAQYMJ-UHFFFAOYSA-N 285.734 5.251 10 1 CKCF Clc1ccc(-c2[nH]ncc2/N=N/c2ccccc2)cc1 101877804 FEYKZYKEKLVSGU-VHEBQXMUSA-N 282.734 5.146 10 1 CKCF Cc1ccc(Cl)c2c(/N=N/c3ccccc3)c(O)[nH]c12 17917992 IBLQIPCGFAQYMJ-VHEBQXMUSA-N 285.734 5.251 10 1 CKCF Cc1[nH]c2ccccc2c1/N=N\c1ccccc1F 102677534 DJJDXAQPIKUIFC-HNENSFHCSA-N 253.280 5.031 10 1 CKCF CC(C)Cc1ccc(/C=C2\Oc3ccccc3C2=S)cc1 1772586846 UYTCCDQJDZNWRG-PDGQHHTCSA-N 294.419 5.037 10 1 CKCF Cc1cc(/N=N\c2ccc3ccccc3c2)ccc1O 102612599 LVDFXHJGWPGUGU-HNENSFHCSA-N 262.312 5.269 10 1 CKCF c1ccc2c(/N=N/C3=C4CCCCN4CCC3)cccc2c1 84466143 WFMWZTPOOPPMAY-QZQOTICOSA-N 291.398 5.415 10 1 CKCF CC(C)c1cc2c(c(O)c1O)C=C1C=CCC(C)(C)[C@@H]1CC2 14515117 ZYDGMYNBSSWCGE-QGZVFWFLSA-N 298.426 5.153 10 1 CKCF Cc1ccc(/N=N\c2ccc3ccccc3c2O)cc1 13110456 MKQFEBQHAPAJFM-HNENSFHCSA-N 262.312 5.269 10 1 CKCF CCC[C@@H](CC)c1cc(O)c(O)cc1[C@H](CC)CCC 1639115 XKXVDDMUFQIEFJ-ZIAGYGMSSA-N 278.436 5.685 10 1 CKCF Clc1ccc(-c2[nH]ncc2/N=N\c2ccccc2)cc1 5483272 FEYKZYKEKLVSGU-HNENSFHCSA-N 282.734 5.146 10 1 CKCF CNc1cccc(Nc2c3ccccc3nc3ccccc23)c1 5318889 AWRMWLGJVXWUIH-UHFFFAOYSA-N 299.377 5.173 10 1 CKCF CC(C)[C@@H](/N=N/c1ccccc1[N+](=O)[O-])c1ccccc1 169689515 PTSFEZIFDDCNEN-JHHGQVAESA-N 283.331 5.076 10 1 CKCF CC(C)(C)c1cccc2nc(CCCCCCN=[N+]=[N-])[nH]c12 587260651 XXAQLIQRKIAPLZ-UHFFFAOYSA-N 299.422 5.274 10 1 CKCF Cc1c2ccccc2c(C)c2c1ccc1c(O)c(O)ccc12 1841872 UOGIXWFTUIUULQ-UHFFFAOYSA-N 288.346 5.174 10 1 CKCF CC(C)=CCC[C@H](C)[C@H]1CC[C@H](C)c2c1ccc(O)c2O 2356804505 ZDQJRSMDGMFMFR-SOUVJXGZSA-N 288.431 5.461 10 1 CKCF Oc1ccc2ccccc2c1[C@H]1Nc2cccc3cccc1c23 2479681 XCHQLCVUZHVIJV-NRFANRHFSA-N 297.357 5.214 10 1 CKCF FC(F)(F)c1ccc(/N=N/c2ccccc2)cc1 36406245 PWESFWBCEFITQH-ISLYRVAYSA-N 250.223 5.121 10 1 CKCF Fc1ccc(Nc2c3ccccc3nc3ccccc23)cc1 5010639 WWNKWWZKEHPLLQ-UHFFFAOYSA-N 288.325 5.271 10 1 CKCF Cc1ccc2nc3ccccc3c(Nc3ccc(N)cc3)c2c1 26846964 LELOLDGNGDRXIA-UHFFFAOYSA-N 299.377 5.022 10 1 CKCF Oc1ccc2ccccc2c1/N=N/c1ccccc1F 101492297 BXEHJGARPVEOGU-VHEBQXMUSA-N 266.275 5.100 10 1 CKCF CN(C)c1ccc(/C=C/c2cc3ccc(Cl)cc3o2)cc1 40422451 VRBMLPZUJXRITR-BJMVGYQFSA-N 297.785 5.323 10 1 CKCF Cc1c(-c2ccc(N(C)C)cc2)[nH]c2c(C)cc(Cl)cc12 587624151 FCWQOQFSJASAEY-UHFFFAOYSA-N 298.817 5.171 10 1 CKCF Cc1[nH]c(N=Nc2ccccc2)nc1N=Nc1ccccc1 253986495 JLRWIRBFDUKCMN-UHFFFAOYSA-N 290.330 5.549 10 1 CKCF CC(C)c1cc2c(c(O)c1O)C=C1C=CCC(C)(C)[C@H]1CC2 14515120 ZYDGMYNBSSWCGE-KRWDZBQOSA-N 298.426 5.153 10 1 CKCF biogenic,in-vitro CCCCCCNc1c2ccccc2nc2ccccc12 5820290 PVGNKKWEHUZWDD-UHFFFAOYSA-N 278.399 5.380 10 1 CKCF C[C@@H](/N=N/c1nc2ccccc2s1)c1cccs1 169693946 ONVDGJXRMVWIJE-HOBGCTPMSA-N 273.386 5.203 10 1 CKCF CCC[C@@H](C)/N=N/c1nc(-c2cccc(OC)c2)cs1 169723880 VFEFBYHVWIMCDX-IEBXDZTQSA-N 289.404 5.091 10 1 CKCF O=C(/N=N/c1ccc(C(F)(F)F)cc1)Nc1ccccc1 103259002 CFBKVFNLPKOMBA-FMQUCBEESA-N 293.248 5.021 10 1 CKCF Cc1cc(C)c(C)c(/N=N\c2nc3ccccc3n2C)c1C 13155031 IIHHVYXVCPEGMQ-MRCUWXFGSA-N 292.386 5.222 10 1 CKCF Cc1ccc(C)n1-c1ccc(Oc2ccc(F)cc2)c(F)c1 587946511 YITKZYPNQIOJBD-UHFFFAOYSA-N 299.320 5.165 10 1 CKCF FC(F)(F)Oc1ccc(/N=N/c2ccccc2)cc1 1857632834 IAMZDPGCACQJGF-ISLYRVAYSA-N 266.222 5.001 10 1 CKCF Oc1ccc2ccccc2c1/N=N\c1ccccc1F 18101293 BXEHJGARPVEOGU-HNENSFHCSA-N 266.275 5.100 10 1 CKCF C[C@H](/N=N/c1ccc([N+](=O)[O-])cc1)c1cc2ccccc2o1 169692282 WZKUBHVFCARLFV-SHYALIGYSA-N 295.298 5.186 10 1 CKCF Cc1[nH]c2ccccc2c1N=Nc1ccccc1F 253994850 DJJDXAQPIKUIFC-UHFFFAOYSA-N 253.280 5.031 10 1 CKCF Cc1cccc(CNc2ccc(C3CCCCC3)cc2)c1O 473083195 NDIWSSSCLAIIAI-UHFFFAOYSA-N 295.426 5.360 10 1 CKCF Cc1ccc(CNc2ccc(C3CCCCC3)cc2)c(O)c1 473082624 JMMDCJAYAAFGRN-UHFFFAOYSA-N 295.426 5.360 10 1 CKCF C[C@@H](/N=N/c1nc(-c2ccccc2)cs1)c1cccs1 169690009 HTGASCCYGDZTAF-IEBXDZTQSA-N 299.424 5.717 10 1 CKCF C[C@H](/N=N/c1ccc(F)cc1)c1ccc(Cl)s1 169691599 WBCXPYXKDDHNRP-BNCXAUQFSA-N 268.744 5.386 10 1 CKCF Cc1cccc(C)c1/N=N\c1c(C)cc(O)cc1C 13118219 SWHNYDMLYMUMPA-ZCXUNETKSA-N 254.333 5.041 10 1 CKCF CC(C)[C@H](/N=N/c1ccccc1[N+](=O)[O-])c1ccccc1 169689517 PTSFEZIFDDCNEN-FWSRSQSESA-N 283.331 5.076 10 1 CKCF C[C@H](/N=N/c1nc2ccc(Cl)cc2o1)c1ccccc1 169689590 IVVJRUXMBNTUAF-LDIGWACQSA-N 285.734 5.326 10 1 CKCF CC(C)CN(C)c1ccc(/C=C2\C=Cc3ccccc32)cc1 36382760 PJQCJAYMLUWRGE-XMHGGMMESA-N 289.422 5.346 10 1 CKCF Cc1[nH]c2ccccc2c1/N=N/c1ccccc1F 101686105 DJJDXAQPIKUIFC-VHEBQXMUSA-N 253.280 5.031 10 1 CKCF CN(C)c1ccc(/C=C/c2c(Cl)cccc2Cl)cc1 144587204 QKJXAKYONKKNHQ-DHZHZOJOSA-N 292.209 5.230 10 1 CKCF CN1/C(=C\N=N\c2ccccc2)C(C)(C)c2ccccc21 33650246 QYQPYSMHVQAYIX-CAUPHXMNSA-N 277.371 5.039 10 1 CKCF Cc1ccc(O)c(CNc2ccc(C3CCCCC3)cc2)c1 473085574 YEBGXKXEYPZAQM-UHFFFAOYSA-N 295.426 5.360 10 1 CKCF Cc1ccc(Nc2c3ccccc3nc3ccc(C)cc23)cc1 4718279 OSMBBSNRZYMDMF-UHFFFAOYSA-N 298.389 5.748 10 1 CKCF C(=C1c2ccccc2CCc2ccccc21)c1ccccc1 44052602 VANWUZCCKGBSMP-UHFFFAOYSA-N 282.386 5.374 10 1 CKCF Clc1ccc(-n2c(-c3ccccc3)cc3c2CCC3)cc1 1772641461 IEMHESZWPQUDRH-UHFFFAOYSA-N 293.797 5.286 10 1 CKCF C[C-](/N=N/c1ccc([N+](=O)[O-])cc1)c1cc2ccccc2o1 169693160 VCLJHDPQIVKNTG-ISLYRVAYSA-N 294.290 5.025 10 1 CKCF C[C@]12CC[C@H]3[C@@H](CC[C@H]4C=CCC[C@@]43C)[C@@H]1CCC2=S 84672214 FSTXFYAVOLEAKH-HKQXQEGQSA-N 288.500 5.565 10 1 CKCF c1ccc2c(/N=N\C3=C4CCCCN4CCC3)cccc2c1 40423224 WFMWZTPOOPPMAY-MRCUWXFGSA-N 291.398 5.415 10 1 CKCF C[C@@H](/N=N/c1nc2ccccc2[nH]1)c1cc2ccccc2o1 169693942 POWRGERIAHFPTB-PQOIGDABSA-N 290.326 5.154 10 1 CKCF CN(C)c1ccc(/C=C\c2ccc3ccccc3c2)cc1 28112474 RRDADBSXDJUDCW-FPLPWBNLSA-N 273.379 5.076 10 1 CKCF CC(C)c1cc2c(c(O)c1O)[C@H]1CCCC(C)(C)[C@@H]1CC2 2356341240 JVRVYDCPTHHIGR-DZGCQCFKSA-N 288.431 5.077 10 1 CKCF Cc1ccc(Cl)c2c(/N=N\c3ccccc3)c(O)[nH]c12 102449395 IBLQIPCGFAQYMJ-HNENSFHCSA-N 285.734 5.251 10 1 CKCF Oc1c(/N=N\c2ccccc2)sc2ccccc12 102289059 NINPOLKSNFCLDI-NXVVXOECSA-N 254.314 5.022 10 1 CKCF Clc1ccc(/N=N/C2=C3CCCN3CCC2)cc1Cl 102123679 YAFQHNJSFXNIGF-ISLYRVAYSA-N 296.201 5.178 10 1 CKCF CCC[C@H](CC)c1cc(O)c(O)cc1[C@@H](CC)CCC 1639114 XKXVDDMUFQIEFJ-KBPBESRZSA-N 278.436 5.685 10 1 CKCF Cc1cc(N(C)C)ccc1N=Nc1ccc2ncccc2c1 263591924 PYUGLZIVWJGWCX-UHFFFAOYSA-N 290.370 5.025 10 3 CKCF CC(C)c1cc2c(c(O)c1O)[C@@H]1CCCC(C)(C)[C@@H]1CC2 685935787 JVRVYDCPTHHIGR-UKRRQHHQSA-N 288.431 5.077 10 1 CKCF biogenic,in-vitro c1ccc2c(/N=N\C3=C4CCCN4CCC3)cccc2c1 40917348 PAQKOPZJPIUXOL-VXPUYCOJSA-N 277.371 5.025 10 1 CKCF Fc1ccc(-c2csc(/N=N/Cc3ccccc3)n2)cc1 169725928 QCPJTCPJPLJMQL-CZIZESTLSA-N 297.358 5.233 10 1 CKCF Cc1ccc(-c2ccc3c(c2)Sc2ccccc2O3)n1C 1661931 QARGRSMOYNKHCF-UHFFFAOYSA-N 293.391 5.257 10 1 CKCF Cc1c(CN=[N+]=[N-])c(C)c(CN=[N+]=[N-])c(C)c1CN=[N+]=[N-] 5541563 SUKCSQNSCGTSOU-UHFFFAOYSA-N 285.315 5.043 10 1 CKCF CC(C)=CCC[C@H](C)[C@@H]1CC[C@H](C)c2c1ccc(O)c2O 2356804503 ZDQJRSMDGMFMFR-KKUMJFAQSA-N 288.431 5.461 10 1 CKCF CC(C)=CCC[C@H](C)[C@@H]1CC[C@@H](C)c2c1ccc(O)c2O 2356804506 ZDQJRSMDGMFMFR-ZNMIVQPWSA-N 288.431 5.461 10 1 CKCF