smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features Cc1ccccc1/N=N\c1c(C)cccc1C 17288179 PQSHCMWEMCCYPL-MSUUIHNZSA-N 224.307 5.027 10 40 BKCB c1ccc(/N=N/c2cccc3ccccc23)cc1 4576711 FDWBUGCBGXWJLC-ISLYRVAYSA-N 232.286 5.255 10 40 BKCB [C-]#[N+]c1ccc(/N=N\c2ccccc2C)cc1C 104899504 VEKJVLXDRAFDSC-ZCXUNETKSA-N 235.290 5.270 10 40 BKCB CC(C)Cc1ccc(/N=N\c2ccccc2)cc1 104149043 SCAMTSOOGIYISY-ZCXUNETKSA-N 238.334 5.301 10 40 BKCB Cc1ccc(/N=N/c2c[nH]c3ccccc23)c(C)c1 18191568 LKHQLVOPQYCJEJ-VHEBQXMUSA-N 249.317 5.200 10 40 BKCB Cc1ccc(/N=N/c2ccc(C)cc2C)c(C)c1 5765295 CYYXARGGNXTAAM-ISLYRVAYSA-N 238.334 5.336 10 40 BKCB Cc1ccccc1/N=N/c1c(C)cccc1C 100336828 PQSHCMWEMCCYPL-WUKNDPDISA-N 224.307 5.027 10 40 BKCB CCCCc1ccc(/N=N/c2ccccc2)cc1 18060757 ASRIDWLMXKVGIU-ISLYRVAYSA-N 238.334 5.445 10 40 BKCB Cc1ccc(C)c(/N=N\c2cc(C)ccc2C)c1 104363171 VQXWBCZVCAOSHC-ZCXUNETKSA-N 238.334 5.336 10 40 BKCB CC(C)Cc1ccc(/N=N/c2ccccc2)cc1 18060303 SCAMTSOOGIYISY-ISLYRVAYSA-N 238.334 5.301 10 40 BKCB c1ccc(/N=N\c2ccc3ccccc3c2)cc1 104343849 JRABDIJJEFFEHT-ZCXUNETKSA-N 232.286 5.255 10 40 BKCB c1ccc(/N=N/c2ccc3ccccc3c2)cc1 18007682 JRABDIJJEFFEHT-ISLYRVAYSA-N 232.286 5.255 10 40 BKCB CCCCc1ccc(/N=N\c2ccccc2)cc1 101378443 ASRIDWLMXKVGIU-ZCXUNETKSA-N 238.334 5.445 10 40 BKCB Cc1ccc(C)c(/N=N/c2cc(C)ccc2C)c1 17302155 VQXWBCZVCAOSHC-ISLYRVAYSA-N 238.334 5.336 10 40 BKCB c1ccc(/N=N\c2cccc3ccccc23)cc1 104213312 FDWBUGCBGXWJLC-ZCXUNETKSA-N 232.286 5.255 10 40 BKCB