11001318 -OEChem-12231915583D 27 29 0 0 0 0 0 0 0999 V2000 -5.5248 -2.1540 -0.0005 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.4382 3.1325 -0.0016 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.1391 0.6962 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9808 2.0316 -0.0003 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1438 0.0788 -0.0007 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0663 -1.5609 0.0004 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3947 0.1594 0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2649 -1.2216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6757 -0.3958 0.0015 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 -0.1067 0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6054 0.8409 0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4239 -2.0111 -0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7517 0.0388 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6653 -1.3589 -0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5289 1.2181 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0155 -1.1483 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3818 -0.8675 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8952 1.4991 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8218 0.4562 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0615 0.6731 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6204 1.9237 0.0017 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3685 -3.0946 -0.0018 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5653 -1.9702 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8271 2.0495 0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6818 -2.1843 0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8874 0.6754 -0.0011 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8680 2.4500 -0.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 2 18 1 0 0 0 0 3 7 1 0 0 0 0 3 9 1 0 0 0 0 4 20 1 0 0 0 0 4 27 1 0 0 0 0 5 20 2 0 0 0 0 6 8 1 0 0 0 0 6 9 2 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 15 2 0 0 0 0 10 16 1 0 0 0 0 11 13 2 0 0 0 0 11 21 1 0 0 0 0 12 14 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 14 23 1 0 0 0 0 15 18 1 0 0 0 0 15 24 1 0 0 0 0 16 17 2 0 0 0 0 16 25 1 0 0 0 0 17 19 1 0 0 0 0 18 19 2 0 0 0 0 19 26 1 0 0 0 0 M END > DB11644 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/TXEIIPDJKFWEEC-UHFFFAOYSA-N/SDF?record_type=3d > OC(=O)C1=CC=C2N=C(OC2=C1)C1=CC(Cl)=CC(Cl)=C1 > InChI=1S/C14H7Cl2NO3/c15-9-3-8(4-10(16)6-9)13-17-11-2-1-7(14(18)19)5-12(11)20-13/h1-6H,(H,18,19) > TXEIIPDJKFWEEC-UHFFFAOYSA-N > C14H7Cl2NO3 > 308.116 > 306.980298509 > 3 > 27 > -0.999601256172643 > 29.741500360706745 > 1 > 1 > 0 > 1 > 2-(3,5-dichlorophenyl)-1,3-benzoxazole-6-carboxylic acid > 3.91 > 4.210307916666666 > -3.98 > 0 > -1 > 3 > -1 > 3.6008683518955453 > -0.4045142852966522 > 63.330000000000005 > 84.69049999999997 > 2 > 1 > 3.23e-02 g/l > darolutamide > 0 $$$$