Compounds (3260 results)

All Green Yellow Leads
Scaffolds SAR Heatmap Matched Pairs
CSV SDF
Rank ID Structure Score 1664 Sim Traffic BBB Vina 3D PSA MDCK TPSA MW HBD SlogP SA
1901 BBP-20907 BBP-20907 0.454 0.429 Yellow 0.65 -6.5 47 -4.7 86 414 2 3.5 3.1
1902 BBP-21898 BBP-21898 0.454 0.462 Yellow 0.46 -7.1 43 -4.7 83 357 2 3.6 3.2
1903 BBP-03229 BBP-03229 0.454 0.474 Yellow 0.54 -6.7 37 -4.7 83 397 2 4.4 3.1
1904 BBP-08974 BBP-08974 0.454 0.512 Yellow 0.64 -6.7 48 -4.8 82 459 2 4.2 3.2
1905 BBP-20578 BBP-20578 0.454 0.315 Yellow 0.62 -6.7 88 -4.7 88 378 2 3.2 3.5
1906 BBP-18460 BBP-18460 0.454 0.280 Yellow 0.74 -6.9 58 -4.8 86 435 2 3.9 2.6
1907 BBP-21522 BBP-21522 0.454 0.302 Green 0.59 -7.7 86 -4.7 86 412 3 3.5 3.3
1908 BBP-19275 BBP-19275 0.453 0.330 Yellow 0.58 -6.5 71 -4.7 83 367 2 3.5 2.8
1909 BBP-21538 BBP-21538 0.453 0.306 Yellow 0.64 -7.1 53 -4.7 85 418 3 3.2 2.8
1910 BBP-22682 BBP-22682 0.453 0.434 Green 0.54 - 49 -4.7 79 400 2 4.1 3.6
1911 BBP-15343 BBP-15343 0.453 0.383 Yellow 0.59 -6.8 49 -4.7 83 385 2 4.2 3.1
1912 BBP-20309 BBP-20309 0.453 0.352 Yellow 0.68 -6.9 78 -4.7 83 398 2 4.3 3.0
1913 BBP-21142 BBP-21142 0.453 0.355 Yellow 0.63 -7.0 58 -4.7 86 428 2 3.4 3.6
1914 BBP-21231 BBP-21231 0.453 0.372 Yellow 0.64 -7.4 43 -4.8 86 443 2 4.0 3.1
1915 BBP-21119 BBP-21119 0.453 0.348 Green 0.58 -7.6 78 -4.7 83 441 2 4.5 2.7
1916 BBP-21927 BBP-21927 0.453 0.419 Yellow 0.68 -6.9 53 -4.8 86 431 2 4.0 3.1
1917 BBP-27127 BBP-27127 0.453 0.454 Green 0.69 - 89 -4.8 82 468 2 4.0 3.4
1918 BBP-21334 BBP-21334 0.453 0.318 Yellow 0.65 -7.1 45 -4.7 83 395 2 4.1 3.4
1919 BBP-17281 BBP-17281 0.453 0.287 Yellow 0.74 -6.6 52 -4.8 86 435 2 3.9 3.0
1920 BBP-21123 BBP-21123 0.453 0.395 Yellow 0.66 -7.0 56 -4.7 83 413 2 4.2 3.1
1921 BBP-24847 BBP-24847 0.453 0.371 Green 0.64 - 44 -4.7 83 379 2 4.1 3.9
1922 BBP-19674 BBP-19674 0.453 0.305 Yellow 0.58 -7.3 97 -4.7 87 394 2 3.7 3.2
1923 BBP-26033 BBP-26033 0.453 0.451 Green 0.50 - 45 -4.7 79 400 2 4.5 3.6
1924 BBP-19182 BBP-19182 0.453 0.326 Yellow 0.58 -7.4 66 -4.7 83 424 2 4.1 3.1
1925 BBP-23393 BBP-23393 0.453 0.370 Green 0.48 - 29 -4.7 70 374 2 4.3 3.3
1926 BBP-19352 BBP-19352 0.453 0.315 Yellow 0.44 -7.3 40 -4.7 83 367 2 3.6 3.0
1927 BBP-19773 BBP-19773 0.453 0.284 Yellow 0.68 -6.9 60 -4.7 83 398 2 3.7 3.3
1928 BBP-20472 BBP-20472 0.453 0.352 Yellow 0.43 -6.8 72 -5.3 88 354 2 2.5 3.3
1929 BBP-16228 BBP-16228 0.453 0.395 Green 0.47 -7.6 28 -4.7 70 374 2 4.3 3.4
1930 BBP-20569 BBP-20569 0.453 0.286 Yellow 0.60 -6.5 66 -5.3 86 388 2 2.5 2.7
1931 BBP-24641 BBP-24641 0.453 0.333 Green 0.47 - 34 -4.7 70 374 2 4.4 3.3
1932 BBP-22696 BBP-22696 0.453 0.444 Green 0.55 - 61 -4.7 79 414 2 4.5 3.1
1933 BBP-26755 BBP-26755 0.453 0.439 Green 0.71 - 53 -4.7 83 361 2 3.7 2.8
1934 BBP-20781 BBP-20781 0.452 0.292 Yellow 0.55 -7.0 73 -4.7 88 366 2 2.9 3.3
1935 BBP-26612 BBP-26612 0.452 0.384 Green 0.47 - 29 -4.7 75 397 2 4.4 3.1
1936 BBP-19239 BBP-19239 0.452 0.319 Yellow 0.71 -6.6 66 -4.7 83 416 2 4.1 2.9
1937 BBP-21043 BBP-21043 0.452 0.348 Yellow 0.56 -6.9 61 -4.7 86 400 2 3.0 3.5
1938 BBP-20506 BBP-20506 0.452 0.345 Yellow 0.60 -7.1 71 -4.7 83 379 2 4.3 3.2
1939 BBP-20522 BBP-20522 0.452 0.283 Yellow 0.69 -6.7 74 -4.8 88 415 2 3.6 2.9
1940 BBP-26656 BBP-26656 0.452 0.412 Green 0.63 - 59 -4.7 83 365 2 3.5 2.9
1941 BBP-19360 BBP-19360 0.452 0.312 Yellow 0.60 -7.2 86 -4.7 87 412 2 3.9 3.1
1942 BBP-27430 BBP-27430 0.452 0.429 Green 0.73 - 57 -4.7 83 379 2 3.9 2.8
1943 BBP-17639 BBP-17639 0.452 0.311 Green 0.60 -7.6 103 -4.7 87 380 2 3.4 3.6
1944 BBP-22961 BBP-22961 0.452 0.366 Green 0.43 - 49 -4.7 70 356 2 4.2 3.0
1945 BBP-25668 BBP-25668 0.452 0.402 Green 0.75 - 53 -4.8 83 382 2 4.1 3.0
1946 BBP-21853 BBP-21853 0.452 0.439 Yellow 0.52 -6.9 40 -4.7 83 367 2 4.0 3.1
1947 BBP-22073 BBP-22073 0.452 0.349 Yellow 0.60 -6.8 60 -4.7 83 403 2 3.5 3.1
1948 BBP-15415 BBP-15415 0.452 0.438 Yellow 0.36 -7.3 35 -4.7 86 378 2 2.9 3.0
1949 BBP-21489 BBP-21489 0.452 0.315 Yellow 0.64 -7.2 54 -4.7 82 403 3 3.8 3.1
1950 BBP-19150 BBP-19150 0.452 0.371 Yellow 0.61 -6.6 52 -4.7 86 396 2 3.2 3.4