7099 -OEChem-10051719303D 27 29 0 0 0 0 0 0 0999 V2000 0.0000 1.1785 -0.0001 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8028 1.2790 0.0003 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8029 1.2788 0.0003 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2147 -0.8984 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2147 -0.8985 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1672 0.5058 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1671 0.5059 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -1.5916 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4500 -1.5694 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 -1.5694 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3732 1.2017 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3731 1.2018 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6026 0.5381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6025 0.5382 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6415 -0.8503 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6416 -0.8502 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.6809 -0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4898 -2.6565 0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4899 -2.6564 0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3552 2.2912 -0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 2.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5884 -1.3832 0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5885 -1.3830 0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7740 2.2898 -0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6934 0.7998 -0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7743 2.2897 -0.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6933 0.7993 -0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 2 0 0 0 0 1 7 1 0 0 0 0 2 13 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 14 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 6 1 0 0 0 0 4 8 2 0 0 0 0 4 9 1 0 0 0 0 5 7 2 0 0 0 0 5 8 1 0 0 0 0 5 10 1 0 0 0 0 6 11 1 0 0 0 0 7 12 1 0 0 0 0 8 17 1 0 0 0 0 9 15 2 0 0 0 0 9 18 1 0 0 0 0 10 16 2 0 0 0 0 10 19 1 0 0 0 0 11 13 2 0 0 0 0 11 20 1 0 0 0 0 12 14 2 0 0 0 0 12 21 1 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 15 22 1 0 0 0 0 16 23 1 0 0 0 0 M END > DB01123 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/WDVSHHCDHLJJJR-UHFFFAOYSA-N/SDF?record_type=3d > NC1=CC2=NC3=C(C=CC(N)=C3)C=C2C=C1 > InChI=1S/C13H11N3/c14-10-3-1-8-5-9-2-4-11(15)7-13(9)16-12(8)6-10/h1-7H,14-15H2 > WDVSHHCDHLJJJR-UHFFFAOYSA-N > C13H11N3 > 209.2465 > 209.095297367 > 3 > 27 > 0.9545243215380034 > 23.17377410285681 > 1 > 2 > 0 > 1 > acridine-3,6-diamine > 2.10 > 1.848375645666667 > -3.30 > 0 > 1 > 3 > 1 > 8.321880956254631 > 64.92999999999999 > 65.45830000000002 > 0 > 1 > 1.04e-01 g/l > tetrahydrofolic acid > 0 $$$$