6038 -OEChem-02092015293D 18 19 0 0 0 0 0 0 0999 V2000 -3.3368 -0.7550 0.0003 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0632 -1.1195 -0.0003 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2483 -0.6110 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4491 0.7744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7146 1.6574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3345 -1.4880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7525 1.2795 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1880 -0.3177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9535 1.1522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6316 -0.9761 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8402 0.4037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1838 -2.1283 -0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5564 2.7304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1834 -2.5640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9351 2.3511 -0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8227 1.8002 0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4816 -1.6524 0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8524 0.7981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 2 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 6 2 0 0 0 0 4 5 1 0 0 0 0 4 7 2 0 0 0 0 5 9 2 0 0 0 0 5 13 1 0 0 0 0 6 10 1 0 0 0 0 6 14 1 0 0 0 0 7 11 1 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 9 16 1 0 0 0 0 10 11 2 0 0 0 0 10 17 1 0 0 0 0 11 18 1 0 0 0 0 M END > DB04745 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/LISFMEBWQUVKPJ-UHFFFAOYSA-N/SDF?record_type=3d > O=C1NC2=C(C=CC=C2)C=C1 > InChI=1S/C9H7NO/c11-9-6-5-7-3-1-2-4-8(7)10-9/h1-6H,(H,10,11) > LISFMEBWQUVKPJ-UHFFFAOYSA-N > C9H7NO > 145.158 > 145.052763851 > 1 > 18 > -1.1091895776753311e-07 > 14.820190177664184 > 1 > 1 > 0 > 0 > 1,2-dihydroquinolin-2-one > 1.51 > 1.5971423416666664 > -1.77 > 0 > 0 > 2 > 0 > 13.952454233112086 > -2.1866847715175437 > 29.1 > 45.279199999999996 > 0 > 1 > 2.45e+00 g/l > mozenavir > 1 $$$$