smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features Oc1ccccc1CN1CCC[C@@H]2CCCC[C@@H]21 23282027 JBOWCOWLFHTNNS-ZFWWWQNUSA-N 245.366 3.547 10 50 BHCA CN(C)c1ccc(-c2nc3ccccc3o2)cc1 236144 NLWWHMRHFRTAII-UHFFFAOYSA-N 238.290 3.561 10 50 BHCA Nc1ccc(OC23CC4CC(CC(C4)C2)C3)cc1 4575173 HHAMGUKELAASPP-UHFFFAOYSA-N 243.350 3.616 10 50 BHCA c1ccc2c(-n3ccnc3)c3ccccc3nc2c1 4725920 WMLCJNVGEDCRLQ-UHFFFAOYSA-N 245.285 3.574 10 50 BHCA CC1(C)C(=O)c2ccc3c(c2C1=O)-c1ccccc1-3 400281 PWMNUGMXEIYXCW-UHFFFAOYSA-N 248.281 3.739 10 50 BHCA COc1ccc(/N=N/Nc2ccc(F)cc2)cc1 5006033 RSFICDVOWWXLOT-UHFFFAOYSA-N 245.257 3.945 10 50 BHCA Nc1ccc(Oc2ccc(Cl)cc2)cc1 14479 YTISFYMPVILQRL-UHFFFAOYSA-N 219.671 3.715 10 50 BHCA COc1ccc(CCNc2ccc(C)cc2)cc1 54650 ZRRBAZPTYVNIAS-UHFFFAOYSA-N 241.334 3.658 10 50 BHCA biogenic C[C@H](Nc1ccccc1)c1ccccc1O 454066 DBHJSOJEDRTHEP-NSHDSACASA-N 213.280 3.565 10 50 BHCA Oc1ccc(NCc2ccc(Cl)cc2)cc1 349067 BTIDVIGLMGSCNH-UHFFFAOYSA-N 233.698 3.658 10 50 BHCA Oc1ccccc1CN1CCC[C@H]2CCCC[C@@H]21 23282029 JBOWCOWLFHTNNS-HIFRSBDPSA-N 245.366 3.547 10 50 BHCA Oc1ccccc1CN1CCC[C@H]2CCCC[C@H]21 179576894 JBOWCOWLFHTNNS-UKRRQHHQSA-N 245.366 3.547 10 50 BHCA COc1ccc(CN[C@@H]2CCCC[C@@H]2C)cc1C 4011259 ICPNPQVKYJJHJP-SWLSCSKDSA-N 247.382 3.672 10 50 BHCA CCOc1ccc(N2Cc3ccccc3C2)cc1 439486 ZEASNDNRJFOYFA-UHFFFAOYSA-N 239.318 3.606 10 50 BHCA Cc1cc(Cl)ccc1-n1c(C)cc(C=O)c1C 615726 GZAXFHWQRJIMGV-UHFFFAOYSA-N 247.725 3.868 10 50 BHCA Cc1ccc(O)c(/N=N/c2ccc(N)cc2)c1 100132170 ZYDVITSLUNFSSH-FOCLMDBBSA-N 227.267 3.698 10 50 BHCA CCN1c2ccccc2Oc2ccccc21 400070 OLAQMPNUMMADRD-UHFFFAOYSA-N 211.264 3.950 10 50 BHCA Cn1c(/N=N/c2ccccc2)nc2ccccc21 100536077 INKMRFJWZYZHIL-WUKNDPDISA-N 236.278 3.989 10 50 BHCA Cc1ccc(C)n1-c1ccc2cc[nH]c2c1 215980929 ZICYXHGTWSBXCC-UHFFFAOYSA-N 210.280 3.575 10 50 BHCA Cc1ccc(C)n1-c1cccc2cccnc12 295142 JPFAPVLEUPXWEO-UHFFFAOYSA-N 222.291 3.642 10 50 BHCA CCOc1ccc2c(c1)C(C)=CC(C)(C)[N+]2(C)C 55070 REFRCEMASWBBFI-UHFFFAOYSA-N 246.374 3.848 10 50 BHCA Cc1cc(C)cc(Oc2ccc(N)cc2)c1 465542 KUIQDVYCIYFSQV-UHFFFAOYSA-N 213.280 3.678 10 50 BHCA biogenic,in-vitro Cc1ccc(O)c(/N=N/c2ccccc2)n1 100001934 LOCPVWIREQIGNQ-CCEZHUSRSA-N 213.240 3.511 10 50 BHCA in-vivo O=C(O)c1ccccc1N=Nc1ccc(O)cc1 253982848 DWQOTEPNRWVUDA-UHFFFAOYSA-N 242.234 3.506 10 50 BHCA CN(C)c1ccc(/C=C/c2ccccc2)cc1 1000224 XGHHHPDRXLIMPM-CMDGGOBGSA-N 223.319 3.923 10 50 BHCA in-vitro CCCc1ccc(-c2nc(N)sc2C)cc1 373505 FARHNGNYUDSWBE-UHFFFAOYSA-N 232.352 3.653 10 50 BHCA Cc1ccc(NCc2ccc(N(C)C)cc2)cc1 409913 MPIIVCDMKHOLLQ-UHFFFAOYSA-N 240.350 3.673 10 50 BHCA Cc1ccc(-n2c(C)cc(C=O)c2C)cc1C 446928 MYMVAFRDSAPHOZ-UHFFFAOYSA-N 227.307 3.523 10 50 BHCA in-vitro Cc1c(Cl)cccc1-n1c(C)cc(CO)c1C 470638 PFCLSIPJDQMSLW-UHFFFAOYSA-N 249.741 3.548 10 50 BHCA O=C(O)c1cc(/N=N/c2ccccc2)ccc1O 16982974 JHDYSXXPQIFFJZ-CCEZHUSRSA-N 242.234 3.506 10 50 BHCA in-vitro Cc1ccc(C)n1-c1ccc(Cl)cc1 2122134 NNKFIFOSLJJRES-UHFFFAOYSA-N 205.688 3.748 10 50 BHCA in-vitro CC(C)(C)CC(C)(C)c1ccc(O)c(O)c1 394017 BOTKTAZUSYVSFF-UHFFFAOYSA-N 222.328 3.812 10 50 BHCA in-vitro Cc1cc(C=O)c(C)n1-c1cccc(Cl)c1 454147 OHUJFCXYVKQJKN-UHFFFAOYSA-N 233.698 3.560 10 50 BHCA CN(C)c1ccc(/N=N/c2ccc(N)cc2)cc1 3861607 BVRIUXYMUSKBHG-WUKNDPDISA-N 240.310 3.750 10 50 BHCA Cc1ccc(Cl)cc1NCc1ccccc1O 409972 GJHFHJZYPLMEKR-UHFFFAOYSA-N 247.725 3.966 10 50 BHCA COc1cc(/N=N/c2ccccc2)ccc1N 18115581 BQDAFHDHPLPCLC-FOCLMDBBSA-N 227.267 3.693 10 50 BHCA Nc1ccc(/N=N/c2ccc(Cl)cc2)c(N)c1 63772503 KWDDCOKSYXDDKJ-WUKNDPDISA-N 246.701 3.920 10 50 BHCA CCN(CC)c1ccc(-n2c(C)ccc2C)cc1 4620710 AOGHODQMWLAKSD-UHFFFAOYSA-N 242.366 3.940 10 50 BHCA Oc1cc2nc3ccccc3nc2c2ccccc12 6475078 WZBDRAAGHRCRKM-UHFFFAOYSA-N 246.269 3.642 10 50 BHCA CN(C)c1ccc(N=Nc2ccc(O)cc2)cc1 263594628 CQKQINNUKSBEQR-UHFFFAOYSA-N 241.294 3.874 10 50 BHCA CC(C)c1cc(C(C)(C)C)cc(O)c1O 39096735 KOZBQTMIPJSXCY-UHFFFAOYSA-N 208.301 3.519 10 50 BHCA Cc1cccc(C)c1-n1c(C)cc(C=O)c1C 450364 FMILNKQDHUCVJA-UHFFFAOYSA-N 227.307 3.523 10 50 BHCA Nc1ccc(OCc2ccccc2Cl)cc1 143707 JBTSPGBABBKQJZ-UHFFFAOYSA-N 233.698 3.501 10 50 BHCA in-vitro Cc1ccccc1NCc1ccc(N(C)C)cc1 409931 HROOVAVLWVCUHO-UHFFFAOYSA-N 240.350 3.673 10 50 BHCA Nc1ccc(CCc2ccc(Cl)cc2)cc1 19735540 UYYBSDJRXMMCAA-UHFFFAOYSA-N 231.726 3.707 10 50 BHCA Cc1ccc(-n2c(C)cc(C=O)c2C)cc1Cl 615720 AFKUUBLZHRTPBM-UHFFFAOYSA-N 247.725 3.868 10 50 BHCA CCc1ccc(NCc2ccccc2O)cc1 395186 RFGRIRIWUJHVMN-UHFFFAOYSA-N 227.307 3.567 10 50 BHCA Nc1ccc(/N=N/c2ccc([N+](=O)[O-])cc2)cc1 3861520 UNBOSJFEZZJZLR-CCEZHUSRSA-N 242.238 3.592 10 50 BHCA in-vitro c1cncc(C2Nc3cccc4cccc(c34)N2)c1 28671 ZUOLBTXPELTJQQ-UHFFFAOYSA-N 247.301 3.771 10 50 BHCA Cc1ccc(O)c(/N=N/c2nccs2)c1 100291422 MZRKINSTWYZJLV-OUKQBFOZSA-N 219.269 3.573 10 50 BHCA Oc1ccccc1CNc1ccc(Cl)cc1 409953 SJLCTRSOOSLQST-UHFFFAOYSA-N 233.698 3.658 10 50 BHCA in-vitro COc1ccc(CN[C@@H]2CCCC[C@H]2C)cc1C 4011261 ICPNPQVKYJJHJP-IUODEOHRSA-N 247.382 3.672 10 50 BHCA O=[N+]([O-])c1ccc(N=Nc2ccc(O)cc2)cc1 254392989 NRJPVIOTANUINF-UHFFFAOYSA-N 243.222 3.716 10 50 BHCA Oc1ccccc1CNc1cccc(Cl)c1 409924 GLNKHORJYRGXQS-UHFFFAOYSA-N 233.698 3.658 10 50 BHCA Oc1ccc2ccccc2c1CN1CCCCC1 129274 WFZSFSMELSBBJO-UHFFFAOYSA-N 241.334 3.531 10 50 BHCA in-vitro c1ccc([C@H]2CCNc3ccccc3N2)cc1 6732101 HGJZFDLYTIVNHC-CYBMUJFWSA-N 224.307 3.655 10 50 BHCA N=NN(Cc1ccccc1)c1ccccc1 1534067563 IUUKDEFWMDCNFQ-UHFFFAOYSA-N 211.268 3.639 10 50 BHCA CN(C)c1ccc(CNc2ccc(F)cc2)cc1 409928 FVVRSFMHMBKUOM-UHFFFAOYSA-N 244.313 3.504 10 50 BHCA Cc1ccc(N/N=N\Cc2ccccc2)cc1 5781457 IWCGEJKKDAJKJE-UHFFFAOYSA-N 225.295 3.974 10 50 BHCA in-vitro CC(C)(C)c1ccc(O)c(CN2CCCCC2)c1 2477769 IQQZIMMIMWQUJT-UHFFFAOYSA-N 247.382 3.676 10 50 BHCA Cc1ccc(C)n1-c1ccc2ncccc2c1 295143 CRQCEAIAKMUZGJ-UHFFFAOYSA-N 222.291 3.642 10 50 BHCA Cc1ccc(C)n1-c1ccc2cnccc2c1 451583 PBKHGMNKWPVYDV-UHFFFAOYSA-N 222.291 3.642 10 50 BHCA Cc1cc(C=O)c(C)n1-c1ccc(Cl)cc1 3885096 CEMZCIWXACIVOA-UHFFFAOYSA-N 233.698 3.560 10 50 BHCA c1cc2c3c(cccc3c1)NC(c1ccncc1)N2 55558 FEYLPNQLTHQWLH-UHFFFAOYSA-N 247.301 3.771 10 50 BHCA CSc1ccc(NCc2ccccc2O)cc1 409954 NTQFKRXJKOBKKE-UHFFFAOYSA-N 245.347 3.726 10 50 BHCA COc1ccc(CN[C@H]2CCCC[C@@H]2C)cc1C 4011260 ICPNPQVKYJJHJP-WFASDCNBSA-N 247.382 3.672 10 50 BHCA Oc1ccc(/N=N/c2cccnc2Cl)cc1 71782194 BRJIKWSCTODNFC-CCEZHUSRSA-N 233.658 3.856 10 50 BHCA Oc1ccc(N=Nc2ccc(O)cc2)cc1 254488515 WKODVHZBYIBMOC-UHFFFAOYSA-N 214.224 3.513 10 50 BHCA Cc1ccc(Cl)cc1-n1c(C)cc(C=O)c1C 453668 ADYDUYPSKQJMOW-UHFFFAOYSA-N 247.725 3.868 10 50 BHCA COC(=O)c1ccc(/N=N/c2ccccc2)cc1 18145517 SUFXZYCPKGRJIZ-FOCLMDBBSA-N 240.262 3.889 10 50 BHCA Nc1ccc(CSc2ccccc2)cc1 167873 BETHGEVRYKIURN-UHFFFAOYSA-N 215.321 3.561 10 50 BHCA Nc1ccc(Oc2ccccc2Cl)cc1 2002350 GKVDUWJVFNUYAR-UHFFFAOYSA-N 219.671 3.715 10 50 BHCA in-vitro Cc1c(Cl)cccc1-n1c(C)cc(C=O)c1C 4702163 GAARVPDOFYSWAV-UHFFFAOYSA-N 247.725 3.868 10 50 BHCA CC(C)(C)c1ccc(C(C)(C)C)c(O)c1O 4728852 WJSNKPPMBBTUKP-UHFFFAOYSA-N 222.328 3.693 10 50 BHCA in-vitro Oc1c(O)c(Cl)c(Cl)c(Cl)c1Cl 154748 RRBMVWQICIXSEO-UHFFFAOYSA-N 247.892 3.711 10 50 BHCA biogenic,in-vitro O=C(O)c1ccccc1/N=N/c1ccc(O)cc1 3861151 DWQOTEPNRWVUDA-CCEZHUSRSA-N 242.234 3.506 10 50 BHCA in-vivo COc1ccc(CNC2CCCCCC2)cc1C 4685494 BUHIVNDNOHICQI-UHFFFAOYSA-N 247.382 3.816 10 50 BHCA Cc1cccc(C)c1Oc1ccc(N)cc1 4227342 BPXYBTUWCJUAJH-UHFFFAOYSA-N 213.280 3.678 10 50 BHCA in-vitro Cc1sc(N)nc1-c1ccc(CC(C)C)cc1 373353 JAWTYNQXXKBFTF-UHFFFAOYSA-N 246.379 3.899 10 50 BHCA c1ccc2c(c1)ccc1nc3ccccc3nc12 4429035 SEXRCKWGFSXUOO-UHFFFAOYSA-N 230.270 3.936 10 50 BHCA Cc1ccc2cc3c(nc2c1)-c1ccccc1C3=O 487564 UKHKOHUEPNXICX-UHFFFAOYSA-N 245.281 3.755 10 50 BHCA biogenic,in-vitro COc1ccc(Cl)cc1-n1c(C)ccc1C 361443 MGTGJNRUDACWCK-UHFFFAOYSA-N 235.714 3.756 10 50 BHCA Oc1ccc(/N=N/c2ccccc2)c(O)c1 100048113 BPTKLSBRRJFNHJ-BUHFOSPRSA-N 214.224 3.513 10 50 BHCA in-vitro CC(C)(C)c1cnc(SCC(F)F)s1 170664061 HJBMHKCVQBCHOR-UHFFFAOYSA-N 237.340 3.798 10 50 BHCA Oc1ccccc1CN1CCC[C@@H]2CCCC[C@H]21 230136160 JBOWCOWLFHTNNS-DZGCQCFKSA-N 245.366 3.547 10 50 BHCA CN(C)c1ccc(CN(C)C2CCCCC2)cc1 4981079 WQPLWQPEWGWBEL-UHFFFAOYSA-N 246.398 3.517 10 50 BHCA CN(C)c1ccc(CNC2CCCCCC2)cc1 4865915 IOSGUSZOURMMID-UHFFFAOYSA-N 246.398 3.565 10 50 BHCA [N-]=[N+]=NCc1ncc(C(F)(F)F)cc1Cl 261494886 PVFQHENOTUVVSJ-UHFFFAOYSA-N 236.584 3.564 10 50 BHCA Nc1ccc(Nc2cncc3ccccc23)cc1 236379465 KCQDNDIDVOMLEP-UHFFFAOYSA-N 235.290 3.561 10 50 BHCA Cc1ccc(C)n1-c1ccc2[nH]ccc2c1 2576303 KEOULQHBHFWLGJ-UHFFFAOYSA-N 210.280 3.575 10 50 BHCA O=C(O)Cc1ccc(/N=N/c2ccccc2)cc1 4742446 RZOAXRWZKOEFOU-FOCLMDBBSA-N 240.262 3.729 10 50 BHCA Nc1ccc(Nc2ccc(Cl)cc2)cc1 8418869 NLGIEISQJFZTIS-UHFFFAOYSA-N 218.687 3.666 10 50 BHCA in-vitro S=C(C(=S)c1ccccc1)c1ccccc1 44075798 RGGQZDHISCPFHM-UHFFFAOYSA-N 242.368 3.823 10 50 BHCA in-vitro CCc1ccc(CNc2ccc(O)cc2)cc1 359727 DKKYUXYUADHFGE-UHFFFAOYSA-N 227.307 3.567 10 50 BHCA COc1ccc(CN[C@H]2CCCC[C@H]2C)cc1C 4011262 ICPNPQVKYJJHJP-DOMZBBRYSA-N 247.382 3.672 10 50 BHCA CN(C)c1ccc(/N=N/c2ccc(O)cc2)cc1 100013115 CQKQINNUKSBEQR-FOCLMDBBSA-N 241.294 3.874 10 50 BHCA N[C@@H](c1ccccc1)c1c(O)ccc2ccccc12 189322 PZMIGEOOGFFCNT-KRWDZBQOSA-N 249.313 3.594 10 50 BHCA Oc1ccc(Cl)cc1CNc1ccccc1 19879465 XVJFPGCDFSGVRA-UHFFFAOYSA-N 233.698 3.658 10 50 BHCA CC(C)(C)c1cc(O)c(O)c(C(C)(C)C)c1 57141 PJZLSMMERMMQBJ-UHFFFAOYSA-N 222.328 3.693 10 50 BHCA C[C@@H](Nc1ccccc1)c1ccccc1O 454067 DBHJSOJEDRTHEP-LLVKDONJSA-N 213.280 3.565 10 50 BHCA CCN(CC)c1ccc(CN2CCCCC2)cc1 4980704 FKUFCLGAIYQODW-UHFFFAOYSA-N 246.398 3.519 10 50 BHCA Nc1ccc(CSc2ccc(F)cc2)cc1 1401511 OOXNIELRPIXZES-UHFFFAOYSA-N 233.311 3.700 10 50 BHCA COc1ccc(-n2c(C)ccc2C)cc1Cl 361441 CZNUWOXQPFHZQZ-UHFFFAOYSA-N 235.714 3.756 10 50 BHCA Cc1ccc2n1CCn1cc(-c3ccccc3)cc1-2 257188 XFWGMTLKQVGHBM-UHFFFAOYSA-N 248.329 3.946 10 50 BHCA biogenic O=[N+]([O-])c1ccc(/N=N/c2ccc(O)cc2)cc1 100009140 NRJPVIOTANUINF-BUHFOSPRSA-N 243.222 3.716 10 50 BHCA Cc1cc(Oc2ccc(N)cn2)cc(C)c1Cl 166494 PALZTNXUZXQEFE-UHFFFAOYSA-N 248.713 3.726 10 50 BHCA Oc1ccc(/N=N/c2ccc(O)cc2)cc1 12428972 WKODVHZBYIBMOC-BUHFOSPRSA-N 214.224 3.513 10 50 BHCA in-vitro O=[N+]([O-])c1cccc(N/N=N/c2ccccc2)c1 17354830 MKDXOZANWLVESV-UHFFFAOYSA-N 242.238 3.706 10 50 BHCA Nc1ccc(OCCC2CCCCC2)cc1 8722909 KZIPKNLJWRDAKV-UHFFFAOYSA-N 219.328 3.618 10 50 BHCA Oc1c(CN2CCCCC2)ccc2ccccc12 158003 LYBPBRBKERCUNO-UHFFFAOYSA-N 241.334 3.531 10 50 BHCA O=C(O)c1ccc(/N=N/c2ccccc2)cc1 4403618 CSPTZWQFHBVOLO-CCEZHUSRSA-N 226.235 3.800 10 50 BHCA c1ccc([C@@H]2CCNc3ccccc3N2)cc1 6732100 HGJZFDLYTIVNHC-ZDUSSCGKSA-N 224.307 3.655 10 50 BHCA Oc1ccccc1N=Nc1ccccc1O 254838637 JFEVWPNAOCPRHQ-UHFFFAOYSA-N 214.224 3.513 10 50 BHCA Cc1cccc(Oc2ccc(N)cc2)c1C 4227344 INUXBJVAWDBGIB-UHFFFAOYSA-N 213.280 3.678 10 50 BHCA in-vitro N[C@H](c1ccccc1)c1c(O)ccc2ccccc12 189326 PZMIGEOOGFFCNT-QGZVFWFLSA-N 249.313 3.594 10 50 BHCA Cc1cccc(-n2c(C)cc(C=O)c2C)c1C 4701846 MWNHAMXKXHWMFI-UHFFFAOYSA-N 227.307 3.523 10 50 BHCA Cc1ccc(-n2c(C)cc(C=O)c2C)c(C)c1 453466 CPJASJOAHPXUCS-UHFFFAOYSA-N 227.307 3.523 10 50 BHCA [N-]=[N+]=NCCCCCCCCCC(=O)O 219887454 LKQUZMZZOUGGHF-UHFFFAOYSA-N 213.281 3.502 10 50 BHCA c1ccc(/N=N/c2ccc3c(c2)OCO3)cc1 4829921 UYHUHIONZCRBED-CCEZHUSRSA-N 226.235 3.831 10 50 BHCA CN(C)c1ccc(CN2CCCCCCC2)cc1 3684218 YBENRSTUBNBSKQ-UHFFFAOYSA-N 246.398 3.519 10 50 BHCA CC1(COc2ccc(N)cc2)CCCCC1 2540792 MHDJBUXPIIBKCE-UHFFFAOYSA-N 219.328 3.618 10 50 BHCA in-vitro Cc1ccc(NCc2ccccc2O)cc1Cl 409952 AREQQHVZFWNKCK-UHFFFAOYSA-N 247.725 3.966 10 50 BHCA COC(=O)CCCCCCCCCCN=[N+]=[N-] 202215834 YGCWMLUTPRODGD-UHFFFAOYSA-N 241.335 3.981 10 50 BHCA Clc1ccc(Sc2nccs2)cc1 336812 QOTZXBVPRSJIAJ-UHFFFAOYSA-N 227.741 3.948 10 50 BHCA CC(C)(C)c1ccc(Oc2ccc(N)cn2)cc1 152719 WHIWGRCYMQLLAO-UHFFFAOYSA-N 242.322 3.754 10 50 BHCA in-vitro [N-]=[N+]=NCc1cccc(C(F)(F)F)c1 37206922 OTNOZELYEDJCQH-UHFFFAOYSA-N 201.151 3.516 10 50 BHCA O=Cc1cc(/N=N/c2ccccc2)ccc1O 3897160 XPVBLJIHHYLHOE-CCEZHUSRSA-N 226.235 3.620 10 50 BHCA Oc1c(-c2ccncc2)sc2ccccc12 96027613 VHVOISYLPDYJRB-UHFFFAOYSA-N 227.288 3.669 10 50 BHCA CNc1ccc(Cl)cc1C(=O)c1ccccc1 243148 WPNMLCMTDCANOZ-UHFFFAOYSA-N 245.709 3.613 10 50 BHCA in-vitro Nc1ccc(Oc2cccc(Cl)c2)cc1 859176 COOTUHZXYCEPGE-UHFFFAOYSA-N 219.671 3.715 10 50 BHCA in-vitro CCCCN(CCCC)Cc1ccc(N)cc1 2264744 ZGKOPGXHDDXHGM-UHFFFAOYSA-N 234.387 3.671 10 50 BHCA Oc1ccccc1/N=N/c1ccccc1O 100262563 JFEVWPNAOCPRHQ-BUHFOSPRSA-N 214.224 3.513 10 50 BHCA O=C1OC(c2ccccc2)=C/C1=C/c1ccccc1 110291 LISLDGCWYOIVSJ-PTNGSMBKSA-N 248.281 3.668 10 50 BHCA c1coc(C2Nc3cccc4cccc(c34)N2)c1 228761 ULYJQHBTOHTGKS-UHFFFAOYSA-N 236.274 3.969 10 50 BHCA CC(=O)Nc1c(Cl)cc(N=N)cc1Cl 101013788 WIKFILBOTZLJIZ-UHFFFAOYSA-N 232.070 3.614 10 50 BHCA Nc1ccc(/N=N/c2ccccc2)cc1[N+](=O)[O-] 17720761 CBULPXZYVCBKMF-CCEZHUSRSA-N 242.238 3.592 10 50 BHCA CCOc1ccc(/N=N/c2c(C)n[nH]c2C)cc1 102296575 OCICVMSIKCQSCE-WUKNDPDISA-N 244.298 3.841 10 50 BHCA CCCCN(C)Cc1c(O)ccc2ccccc12 2472032 GKCZVBZHDHBWJF-UHFFFAOYSA-N 243.350 3.777 10 50 BHCA Cc1cc(C=O)c(C)n1-c1ccccc1Cl 453495 RKUALNOCZYTDIV-UHFFFAOYSA-N 233.698 3.560 10 50 BHCA in-vitro O=C(O)c1ccc(/N=N/c2ccc(O)cc2)cc1 3896282 HLVCZTOFOWHIJZ-CCEZHUSRSA-N 242.234 3.506 10 50 BHCA in-vitro CN(C)/N=N/c1ccc(-c2ccccc2)cc1 16892272 WIPXHMSXTWJKCY-FOCLMDBBSA-N 225.295 3.914 10 50 BHCA Nc1ccc(OCc2ccc(Cl)cc2)cc1 144181 ISKGMPXNIRIOQC-UHFFFAOYSA-N 233.698 3.501 10 50 BHCA CN(C)c1ccc(/C=C/c2ccc(N)cc2)cc1 2522761 GCHSJPKVJSMRDX-ONEGZZNKSA-N 238.334 3.505 10 50 BHCA Cc1ccc(Oc2ccc(N)cc2)cc1C 4227345 UZSYASHQOZQTII-UHFFFAOYSA-N 213.280 3.678 10 50 BHCA