smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CCN(CC)c1ccc(N=N)c(C)c1 101013803 KTZVBDUWDXUASA-UHFFFAOYSA-N 191.278 3.504 10 50 AHCA [O-]/[N+](=N\c1ccccc1)c1ccccc1 18117704 GAUZCKBSTZFWCT-YPKPFQOOSA-N 198.225 3.612 10 50 AHCA in-vitro CC(C)(C)c1ccc(CN=[N+]=[N-])cc1 4293894 YVPUHRTVWANKKE-UHFFFAOYSA-N 189.262 3.794 10 50 AHCA Nc1ccc(/N=N/c2ccccc2)cc1 18060741 QPQKUYVSJWQSDY-CCEZHUSRSA-N 197.241 3.684 10 50 AHCA in-vitro Oc1ccc(/N=N/c2ccccc2)cc1 100010406 BEYOBVMPDRKTNR-BUHFOSPRSA-N 198.225 3.808 10 50 AHCA in-vitro