Compounds (3260 results)

All Green Yellow Leads
Rank ID Structure Score 1664 Sim Traffic BBB Vina 3D PSA MDCK TPSA MW HBD SlogP SA
2051 BBP-19571 BBP-19571 0.446 - Red 0.71 -7.3 57 -4.7 70 384 2 4.3 3.2
2052 BBP-20285 BBP-20285 0.446 - Yellow 0.66 -6.5 71 -4.7 83 402 2 3.8 2.9
2053 BBP-21908 BBP-21908 0.446 - Yellow 0.66 -6.6 45 -4.8 86 417 2 3.6 3.6
2054 BBP-17280 BBP-17280 0.446 - Yellow 0.60 -6.2 49 -4.7 86 378 2 2.9 3.0
2055 BBP-20520 BBP-20520 0.446 - Yellow 0.60 -7.2 59 -4.8 83 404 2 4.1 3.7
2056 BBP-21326 BBP-21326 0.446 - Yellow 0.68 -6.8 49 -4.7 82 399 3 4.1 2.8
2057 BBP-18502 BBP-18502 0.446 - Yellow 0.62 -6.3 63 -5.3 86 364 2 2.3 2.5
2058 BBP-21839 BBP-21839 0.446 - Yellow 0.52 -7.2 40 -4.7 83 388 2 4.4 3.2
2059 BBP-26534 BBP-26534 0.446 - Yellow 0.43 - 46 -4.7 70 392 2 4.5 3.2
2060 BBP-21841 BBP-21841 0.446 - Yellow 0.43 -7.2 60 -4.7 83 375 2 3.7 3.3
2061 BBP-26374 BBP-26374 0.446 - Yellow 0.68 - 47 -4.7 83 405 2 4.5 4.1
2062 BBP-10203 BBP-10203 0.446 - Yellow 0.52 -6.4 52 -4.7 86 404 2 3.2 3.9
2063 BBP-18321 BBP-18321 0.446 - Yellow 0.67 -7.1 56 -4.8 86 449 2 4.2 2.7
2064 BBP-20643 BBP-20643 0.446 - Yellow 0.72 -6.5 58 -4.7 83 398 2 4.0 2.9
2065 BBP-21717 BBP-21717 0.445 - Yellow 0.45 -7.1 91 -4.7 87 366 2 3.0 3.1
2066 BBP-02110 BBP-02110 0.445 - Yellow 0.49 -6.6 41 -4.8 86 400 2 3.6 3.1
2067 BBP-18279 BBP-18279 0.445 - Yellow 0.59 -7.3 56 -4.7 82 403 3 3.8 3.1
2068 BBP-19933 BBP-19933 0.445 - Yellow 0.58 -7.2 61 -4.7 87 390 2 3.9 3.2
2069 BBP-20440 BBP-20440 0.445 - Yellow 0.46 -7.8 79 -4.7 87 434 2 3.9 2.8
2070 BBP-25684 BBP-25684 0.445 - Yellow 0.62 - 61 -4.7 84 358 2 4.0 3.2
2071 BBP-19623 BBP-19623 0.445 - Yellow 0.60 -7.1 80 -4.7 87 411 2 4.3 3.3
2072 BBP-25050 BBP-25050 0.445 - Yellow 0.44 - 27 -4.7 73 411 2 4.4 3.9
2073 BBP-19101 BBP-19101 0.445 - Yellow 0.71 -6.5 50 -4.7 82 404 3 4.4 3.2
2074 BBP-21263 BBP-21263 0.445 - Yellow 0.56 -7.6 47 -4.7 82 402 3 3.9 3.5
2075 BBP-27279 BBP-27279 0.445 - Yellow 0.76 - 43 -4.8 82 468 2 4.4 4.1
2076 BBP-20627 BBP-20627 0.445 - Yellow 0.48 -7.0 98 -4.7 87 398 2 3.5 2.7
2077 BBP-21530 BBP-21530 0.445 - Yellow 0.66 -6.5 58 -4.7 86 413 2 3.5 2.9
2078 BBP-17353 BBP-17353 0.445 - Yellow 0.69 -6.7 45 -4.7 85 399 3 3.4 2.5
2079 BBP-20453 BBP-20453 0.445 - Yellow 0.64 -6.8 64 -4.8 83 398 2 4.4 2.9
2080 BBP-20615 BBP-20615 0.444 - Yellow 0.55 -7.1 67 -4.7 89 393 3 3.5 3.7
2081 BBP-27122 BBP-27122 0.444 - Yellow 0.70 - 79 -4.8 82 441 2 4.0 3.1
2082 BBP-18751 BBP-18751 0.444 - Yellow 0.69 -6.6 75 -4.7 86 415 2 3.5 2.6
2083 BBP-19663 BBP-19663 0.444 - Yellow 0.56 -7.0 111 -4.7 83 431 2 3.6 3.4
2084 BBP-19732 BBP-19732 0.444 - Yellow 0.65 -6.9 69 -4.7 83 392 2 4.3 3.3
2085 BBP-20233 BBP-20233 0.444 - Red 0.80 -7.7 53 -4.7 70 384 2 3.9 2.6
2086 BBP-22154 BBP-22154 0.444 - Yellow 0.75 - 84 -4.7 83 381 2 3.8 3.0
2087 BBP-19842 BBP-19842 0.444 - Yellow 0.52 -7.0 71 -4.7 83 393 2 3.4 3.0
2088 BBP-24343 BBP-24343 0.444 - Yellow 0.62 - 57 -4.8 82 456 2 4.4 3.1
2089 BBP-28428 BBP-28428 0.444 - Yellow 0.59 - 50 -4.8 83 370 2 3.8 3.0
2090 BBP-02035 BBP-02035 0.444 - Yellow 0.55 -6.6 56 -4.8 82 450 2 3.7 3.4
2091 BBP-22036 BBP-22036 0.444 - Yellow 0.56 -7.3 52 -4.7 83 413 2 4.2 3.5
2092 BBP-18395 BBP-18395 0.444 - Red 0.78 -7.5 29 -4.7 73 436 2 4.4 2.7
2093 BBP-22560 BBP-22560 0.443 - Yellow 0.52 - 31 -4.7 73 431 2 4.3 2.8
2094 BBP-26801 BBP-26801 0.443 - Yellow 0.46 - 34 -4.7 73 411 2 4.4 3.9
2095 BBP-18853 BBP-18853 0.443 - Yellow 0.62 -6.4 75 -5.3 86 350 2 2.1 2.5
2096 BBP-20675 BBP-20675 0.443 - Yellow 0.69 -6.4 63 -4.7 83 378 2 3.9 2.8
2097 BBP-19592 BBP-19592 0.443 - Yellow 0.54 -7.3 38 -4.7 83 395 2 4.2 3.2
2098 BBP-20032 BBP-20032 0.443 - Yellow 0.51 -6.7 63 -4.7 84 351 2 3.6 3.0
2099 BBP-22049 BBP-22049 0.443 - Yellow 0.53 -6.7 30 -4.8 83 370 2 4.5 3.1
2100 BBP-19480 BBP-19480 0.443 - Red 0.87 -7.2 56 -4.7 62 386 2 3.9 2.8