Anchor Biased Library
Compounds (31,139,128)
Reaction Class | Tryptophan | Tyrosine | Phenylalanine | Leucine/Valine | Aspartic/Glutamic Acid |
BDAyl | 305,827 | 315,774 | 235,815 | 235,965 | |
beta-Lactam | 183,389 | 308,105 | 280,520 | 363,293 | 262,801 |
Castagnoli | 627,358 | 807,032 | 1,061,180 | 937,010 | 1,045,202 |
DihydroBDAcarboxamide | 335,966 | 338,126 | 250,793 | 250,732 | |
DKP | 351,893 | 354,685 | 237,132 | 240,475 | 253,420 |
Doebner | 48,185 | 42,888 | 72,291 | 16,770 | 69,778 |
Gewald | 71,973 | 13,183 | 28,982 | 27,763 | 2,283 |
Groebke | 118,257 | 73,200 | 162,103 | 122,529 | 155,677 |
Hydantoine | 254,888 | 252,205 | 250,594 | 254,725 | 250,348 |
Imidazole | 161,042 | 161,100 | 216,090 | 161,865 | 136,016 |
Orru | 610,388 | 369,778 | 530,751 | 429,718 | 403,107 |
Orru+Amidation | 300,206 | 399,364 | 399,863 | 400,502 | 332,004 |
OxoBDAcarboxamide | 249,725 | 249,357 | 188,105 | 188,318 | |
PZQ | 313,098 | 8,436 | 35,292 | 16,723 | 568,646 |
Reductive_Amination | 208,314 | 204,864 | 252,633 | 262,708 | 253,818 |
Schollkopf | 6,564 | 4,180 | 16,326 | 10,669 | 97,545 |
Schollkopf_amidation | 250,826 | 250,068 | 249,952 | 250,993 | 249,891 |
Sulfonamide | 101,137 | 100,340 | 150,595 | 153,101 | 187,730 |
Tetrazole | 226,459 | 230,945 | 224,584 | 235,957 | 229,171 |
TetrazolyldihidroBDA | 41,157 | 34,098 | 46,140 | 46,490 | |
Thiazole | 230,423 | 232,921 | 226,423 | 232,360 | 228,920 |
Thienodiazepine | 172,571 | 124,177 | 296,357 | 296,937 | 163,762 |
U4C5Cr | 251,138 | 241,488 | 216,856 | 231,575 | 382,299 |
UDC | 234,629 | 244,126 | 237,526 | 239,734 | 325,049 |
Ugi_4_component | 235,768 | 244,347 | 240,163 | 239,016 | 241,830 |
van_Leusen | 152,723 | 151,871 | 150,845 | 154,923 | 125,640 |
Zhu | 213,200 | 224,534 | 226,053 | 223,193 | 227,887 |
Total | 6,257,104 | 5,981,192 | 6,483,964 | 6,224,044 | 6,192,824 |
Conformations (2,002,551,771)
Reaction Class | Tryptophan | Tyrosine | Phenylalanine | Leucine/Valine | Aspartic/Glutamic Acid |
BDAyl | 26,214,285 | 23,721,397 | 17,449,841 | 23,282,581 | |
beta-Lactam | 16,654,349 | 27,554,720 | 25,160,362 | 30,272,319 | 7,688,672 |
Castagnoli | 47,641,881 | 64,482,880 | 71,761,218 | 54,318,549 | 38,777,939 |
DihydroBDAcarboxamide | 31,649,673 | 26,750,056 | 19,098,290 | 17,277,756 | |
DKP | 27,889,030 | 24,658,016 | 15,992,397 | 13,024,764 | 12,251,074 |
Doebner | 1,218,903 | 582,205 | 2,063,920 | 366,487 | 651,729 |
Gewald | 6,705,904 | 1,279,113 | 2,792,262 | 2,653,899 | 136,184 |
Groebke | 8,770,733 | 4,304,422 | 10,927,726 | 6,473,140 | 3,125,513 |
Hydantoine | 15,607,638 | 11,298,799 | 10,884,717 | 8,484,052 | 4,904,322 |
Imidazole | 15,170,144 | 13,642,570 | 18,150,394 | 11,828,840 | 7,276,646 |
Orru | 43,289,471 | 22,245,918 | 31,671,353 | 21,191,507 | 10,790,920 |
Orru+Amidation | 26,331,810 | 34,521,699 | 33,952,909 | 31,862,889 | 10,604,335 |
OxoBDAcarboxamide | 22,997,467 | 18,916,134 | 13,811,154 | 12,497,622 | |
PZQ | 16,230,946 | 540,635 | 2,488,086 | 845,018 | 21,016,240 |
Reductive_Amination | 18,049,235 | 18,169,471 | 22,359,635 | 15,738,414 | 10,408,466 |
Schollkopf | 393,207 | 179,652 | 764,278 | 329,848 | 2,643,426 |
Schollkopf_amidation | 23,730,787 | 22,370,629 | 22,268,938 | 19,160,702 | 11,253,523 |
Sulfonamide | 8,630,502 | 8,332,724 | 12,360,432 | 8,876,135 | 4,716,600 |
Tetrazole | 16,326,682 | 14,147,410 | 13,017,972 | 8,318,610 | 6,875,738 |
TetrazolyldihidroBDA | 3,834,826 | 2,605,432 | 2,708,941 | 2,471,100 | |
Thiazole | 14,564,942 | 14,961,312 | 13,900,890 | 11,056,227 | 7,755,826 |
Thienodiazepine | 16,473,867 | 11,030,690 | 25,710,822 | 22,613,495 | 9,488,611 |
U4C5Cr | 20,922,996 | 18,519,893 | 16,423,138 | 13,034,563 | 20,864,591 |
UDC | 17,319,088 | 16,689,772 | 16,043,570 | 11,487,821 | 6,352,245 |
Ugi_4_component | 11,270,074 | 11,032,815 | 10,547,199 | 7,303,688 | 4,871,934 |
van_Leusen | 12,577,734 | 10,217,211 | 11,395,471 | 9,181,151 | 2,701,253 |
Zhu | 20,716,048 | 21,433,598 | 21,065,155 | 17,580,732 | 15,721,610 |
Total | 491,182,222 | 444,189,173 | 464,771,070 | 381,531,909 | 220,877,397 |