smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features O=C(/N=N/c1ccccc1)/N=N/c1ccccc1 32224519 GOTKJFIJTINXRP-YXLFCKQPSA-N 238.250 4.674 10 30 BJCC Cc1ccc(C)c(/N=N/c2ccc(N)c(C)c2)c1 44709743 MZVVWYZHNTVDHX-ISLYRVAYSA-N 239.322 4.609 10 30 BJCC CC(C)(C)C(=S)CCC(=S)C(C)(C)C 33637850 ANUNCVWREULBJL-UHFFFAOYSA-N 230.442 4.599 10 30 BJCC Cc1ccc(/N=N/c2ccc(N)c(C)c2)c(C)c1 5160477 FBVBEKWBELWCNW-ISLYRVAYSA-N 239.322 4.609 10 30 BJCC Cc1c([C@@H](C)N=[N+]=[N-])sc2ccccc12 95829565 BLHFQMXLFIUHLT-MRVPVSSYSA-N 217.297 4.581 10 30 BJCC in-vitro CCN(C)c1ccc(/N=N/c2ccccc2)cc1 4772951 CQRMBHOJIAXBTN-WUKNDPDISA-N 239.322 4.558 10 30 BJCC Cc1ccc(/N=N/c2ccccc2C)cc1 5781314 YLQIORSMSAEKCG-FOCLMDBBSA-N 210.280 4.719 10 30 BJCC [N-]=[N+]=NCc1c2ccccc2cc2ccccc12 4829176 WZYKQNHXNDMRPW-UHFFFAOYSA-N 233.274 4.803 10 30 BJCC Oc1c(/N=N/c2ccccc2)ccc2ccccc12 39240777 QKRNIXMMAZQIAG-ISLYRVAYSA-N 248.285 4.961 10 30 BJCC C=Cc1ccc(N(CCCC)CCCC)cc1 34742749 KAVBRFJCUBOPFC-UHFFFAOYSA-N 231.383 4.736 10 30 BJCC