"83.64" . "ALOGPS" . "123.2" . "C[C@@H](N[C@H](CCC1=CC=CC=C1)C(=O)N[C@H](CCCNC(N)=[NH2+])C(=O)NC1=CC=CC=C1)C(O)=O" . "ChemAxon" . "-4.5" . "3.83" . "104.26" . "1" . "[(1r,2R,3R,4r,5S,6S)-2,3,5,6-tetrahydroxy-4-(phosphonooxy)cyclohexyl]oxyphosphonic acid" . "476.037974139" . "C17H14N6O" . "3.68" . "CO[C@H]1\\C=C\\O[C@@]2(C)OC3=C(C2=O)C2=C(C(O)=C3C)C(O)=C(NC(=O)\\C(C)=C/C=C/[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C)C(\\C=N\\N1CCN(CC1)C1CCCC1)=C2O" . "107.22" . "10.27" . "2.95" .