smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features [N-]=[N+]=NCCOCCOCCOCCOCCOc1cccc2c1C(=O)N([C@@H]1CCC(=O)NC1=O)C2=O 1857523827 UEXQGUAIPAANLE-QGZVFWFLSA-N 519.511 0.843 10 20 KCCD [N-]=[N+]=NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO 2048532605 QTOHMSLEMQLKDH-UHFFFAOYSA-N 615.718 0.488 10 20 KCCD [N-]=[N+]=NCCOCCOCCOCCOCCOCC(=O)Nc1cccc2c1C(=O)N([C@@H]1CCC(=O)NC1=O)C2=O 2332239870 VVYLIGMZWYRVAH-LJQANCHMSA-N 576.563 0.420 10 20 KCCD [N-]=[N+]=NCCOCCOCCOCCOCC(=O)Nc1cccc2c1C(=O)N([C@@H]1CCC(=O)NC1=O)C2=O 2332239830 FGEDVKSXXCVRFL-QGZVFWFLSA-N 532.510 0.403 10 20 KCCD [N-]=[N+]=NCCOCCOCCOCCOCCOCC(=O)Nc1cccc2c1C(=O)N([C@H]1CCC(=O)NC1=O)C2=O 2332239869 VVYLIGMZWYRVAH-IBGZPJMESA-N 576.563 0.420 10 20 KCCD [N-]=[N+]=NCCOCCOCCOCCN(CCOCCOCCOCCC(=O)O)C(=O)CCOCCOCCN 1857523817 FZLMDRGRFLPQRO-UHFFFAOYSA-N 581.664 0.082 10 20 KCCD CC(=O)OC[C@H]1O[C@@H](OCCOCCOCCOCCN=[N+]=[N-])[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O 1857791811 SBLCSGRZSLBMCF-CDJZJNNCSA-N 549.530 0.446 10 20 KCCD CC(C)[C@H](NC(=O)CCOCCOCCOCCOCCN=[N+]=[N-])C(=O)N(c1ccc(CO)cc1)[C@@H](CCCNC(N)=O)C(N)=O 1857792000 YKWCEPIPEDFAAV-AHWVRZQESA-N 652.750 0.722 10 20 KCCD CC(C)[C@H](NC(=O)CCOCCOCCOCCN=[N+]=[N-])C(=O)N(c1ccc(CO)cc1)[C@@H](CCCNC(N)=O)C(N)=O 1857791863 KATRZFUKLKUJLE-UPVQGACJSA-N 608.697 0.705 10 20 KCCD [N-]=[N+]=NCCOCCOCCOCCOCCOc1cccc2c1C(=O)N([C@H]1CCC(=O)NC1=O)C2=O 1857523826 UEXQGUAIPAANLE-KRWDZBQOSA-N 519.511 0.843 10 20 KCCD [N-]=[N+]=NCCOCCOCCOCCOCC(=O)Nc1cccc2c1C(=O)N([C@H]1CCC(=O)NC1=O)C2=O 2332239829 FGEDVKSXXCVRFL-KRWDZBQOSA-N 532.510 0.403 10 20 KCCD