@MOLECULE (5-hydroxy-4-{[(7-hydroxy-6-oxo-2-phenyl-6,7-dihydro-2h-pyrazolo[3,4-b]pyridin-5-yl)amino]methyl}-6-methyl-3-pyridinyl)methyl dihydrogen phosphate 33 37 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C 6.5902 0.7417 0.5247 C.ar 1 UNL1 -0.1213 2 C 7.8046 0.3575 0.3755 C.ar 1 UNL1 -0.0622 3 C 0.6305 -0.0917 -0.4436 C.2 1 UNL1 0.4135 4 C -3.2053 -2.0556 0.4756 C.2 1 UNL1 0.6453 5 C 1.9462 0.1076 -0.0912 C.ar 1 UNL1 -0.5538 6 C -5.5070 -1.1794 0.1184 C.2 1 UNL1 0.2415 7 C -3.8751 0.3458 -0.1788 C.3 1 UNL1 -0.3699 8 C 3.0699 -0.7900 0.0771 C.ar 1 UNL1 0.4289 9 C -4.1690 -1.0530 0.1198 C.2 1 UNL1 -0.2092 10 C 8.1729 -0.8847 0.0354 C.ar 1 UNL1 -0.0376 11 C 7.1687 -1.6831 -0.1117 C.ar 1 UNL1 -0.0870 12 C 5.8412 -1.5082 -0.0088 C.ar 1 UNL1 -0.1398 13 C 5.5162 -0.1456 0.3407 C.ar 1 UNL1 -0.0163 14 C -4.9107 1.3444 0.1501 C.2 1 UNL1 0.5399 15 C -6.3078 0.8285 0.4237 C.2 1 UNL1 -0.5511 16 C 2.4037 1.4674 0.1646 C.ar 1 UNL1 -0.0516 17 C -0.2405 0.9734 -0.6479 C.2 1 UNL1 -0.2783 18 C 0.1955 2.3460 -0.4276 C.2 1 UNL1 0.4892 19 C -7.3036 1.6487 0.8044 C.2 1 UNL1 0.6369 20 C -2.6326 0.6815 -0.5678 C.3 1 UNL1 0.4062 21 N -6.5571 -0.5071 -0.0158 N.pl3 1 UNL1 -0.2047 22 N 3.7923 1.4435 0.4449 N.ar 1 UNL1 -0.1047 23 N 4.1749 0.2038 0.3369 N.ar 1 UNL1 -0.0005 24 N 1.6196 2.5442 0.0668 N.am 1 UNL1 0.2126 25 N -1.5535 0.8331 -1.0627 N.pl3 1 UNL1 -0.1651 26 O 0.4743 -1.4676 -0.6252 O.2 1 UNL1 -0.0607 27 O -1.9638 -1.6129 -0.1455 O.3 1 UNL1 -0.3275 28 O -0.4567 3.3380 -0.5545 O.2 1 UNL1 -0.3053 29 O -0.4492 -3.7976 -0.3317 O.2 1 UNL1 -0.0179 30 O -4.7017 2.5317 0.1954 O.2 1 UNL1 -0.4473 31 O 1.9584 3.6902 0.3384 O.2 1 UNL1 -0.2522 32 O -3.2260 -3.0657 1.0955 O.2 1 UNL1 -0.3273 33 P -0.6852 -2.4072 -0.3209 P.3 1 UNL1 0.6772 @BOND 1 25 17 1 2 25 20 1 3 17 3 2 4 17 18 1 5 26 3 1 6 26 33 1 7 20 7 1 8 28 18 2 9 3 5 1 10 18 24 am 11 29 33 2 12 33 27 1 13 7 9 1 14 7 14 1 15 27 4 1 16 11 12 ar 17 11 10 ar 18 5 8 ar 19 5 16 ar 20 21 6 1 21 21 15 1 22 12 13 ar 23 10 2 ar 24 24 16 1 25 24 31 2 26 8 23 ar 27 6 9 2 28 9 4 1 29 14 30 2 30 14 15 1 31 16 22 ar 32 23 13 1 33 23 22 ar 34 13 1 ar 35 2 1 ar 36 15 19 2 37 4 32 2