Compounds (3260 results)

All Green Yellow Leads
Rank ID Structure Score 1664 Sim Traffic BBB Vina 3D PSA MDCK TPSA MW HBD SlogP SA
2201 BBP-24747 BBP-24747 0.437 0.419 Yellow 0.72 - - - 83 397 2 3.9 3.5
2202 BBP-19285 BBP-19285 0.437 0.322 Yellow 0.66 -6.3 - - 83 408 2 4.2 3.0
2203 BBP-19456 BBP-19456 0.437 0.319 Yellow 0.47 -7.1 - - 87 416 2 3.8 2.6
2204 BBP-20534 BBP-20534 0.437 0.357 Yellow 0.49 -7.2 - - 83 363 2 4.4 2.9
2205 BBP-21089 BBP-21089 0.437 0.373 Yellow 0.44 -6.7 - - 83 357 2 3.6 3.1
2206 BBP-28648 BBP-28648 0.437 0.459 Yellow 0.70 - - - 82 429 2 3.7 3.5
2207 BBP-18284 BBP-18284 0.437 0.270 Yellow 0.60 -6.2 - - 83 370 2 3.8 3.0
2208 BBP-20904 BBP-20904 0.437 0.456 Yellow 0.49 -7.2 - - 82 403 3 3.5 3.6
2209 BBP-21460 BBP-21460 0.437 0.293 Yellow 0.55 -6.3 - - 87 382 2 3.6 2.9
2210 BBP-23142 BBP-23142 0.437 0.386 Yellow 0.71 - - - 83 381 2 3.8 2.9
2211 BBP-21889 BBP-21889 0.437 0.377 Yellow 0.42 -6.6 - - 83 371 2 3.4 3.1
2212 BBP-10102 BBP-10102 0.437 0.435 Yellow 0.58 -6.6 - - 82 447 2 3.8 4.0
2213 BBP-25354 BBP-25354 0.437 0.494 Yellow 0.70 - - - 83 379 2 4.3 3.2
2214 BBP-19196 BBP-19196 0.437 0.315 Red 0.77 -7.8 - - 70 398 2 4.2 2.6
2215 BBP-20548 BBP-20548 0.437 0.271 Yellow 0.71 -6.6 - - 83 424 2 4.4 2.9
2216 BBP-18272 BBP-18272 0.437 0.326 Yellow 0.47 -6.9 - - 83 356 2 3.9 2.9
2217 BBP-19203 BBP-19203 0.437 0.326 Yellow 0.60 -7.0 - - 83 410 2 4.4 3.5
2218 BBP-19403 BBP-19403 0.437 0.297 Red 0.85 -7.1 - - 62 386 2 3.9 2.8
2219 BBP-15518 BBP-15518 0.437 0.562 Yellow 0.55 -7.4 - - 88 422 2 4.3 3.5
2220 BBP-19258 BBP-19258 0.437 0.319 Yellow 0.65 -6.8 - - 86 427 2 4.1 3.5
2221 BBP-19867 BBP-19867 0.437 0.275 Yellow 0.68 -5.8 - - 83 370 2 3.4 2.9
2222 BBP-26394 BBP-26394 0.436 0.442 Yellow 0.56 - - - 86 429 2 4.3 3.3
2223 BBP-20443 BBP-20443 0.436 0.300 Yellow 0.63 -6.6 - - 87 379 3 4.0 3.7
2224 BBP-20542 BBP-20542 0.436 0.286 Yellow 0.67 -6.4 - - 83 404 2 4.0 2.9
2225 BBP-22369 BBP-22369 0.436 0.352 Yellow 0.74 - - - 83 384 2 4.0 3.0
2226 BBP-21381 BBP-21381 0.436 0.301 Yellow 0.64 -7.3 - - 82 417 3 4.1 3.5
2227 BBP-26994 BBP-26994 0.436 0.518 Yellow 0.77 - - - 82 456 2 4.4 3.1
2228 BBP-06947 BBP-06947 0.436 0.427 Yellow 0.57 -6.6 - - 89 458 2 3.5 3.1
2229 BBP-27277 BBP-27277 0.436 0.483 Yellow 0.81 - - - 86 466 2 4.3 5.3
2230 BBP-20264 BBP-20264 0.436 0.319 Red 0.81 -7.5 - - 70 380 2 4.1 2.8
2231 BBP-21629 BBP-21629 0.436 0.322 Yellow 0.64 -6.3 - - 86 396 2 3.6 2.8
2232 BBP-18548 BBP-18548 0.435 0.253 Yellow 0.66 -6.9 - - 85 413 3 3.7 2.6
2233 BBP-19701 BBP-19701 0.435 0.341 Yellow 0.42 -7.7 - - 87 434 2 3.9 2.8
2234 BBP-21175 BBP-21175 0.435 0.352 Yellow 0.59 -6.7 - - 86 417 2 3.5 3.5
2235 BBP-22392 BBP-22392 0.435 0.377 Yellow 0.73 - - - 83 395 2 3.8 2.9
2236 BBP-25860 BBP-25860 0.435 0.458 Yellow 0.82 - - - 83 422 2 4.4 3.1
2237 BBP-21532 BBP-21532 0.435 0.280 Yellow 0.62 -6.5 - - 88 415 2 3.4 3.1
2238 BBP-26732 BBP-26732 0.435 0.415 Yellow 0.59 - - - 83 367 2 4.1 4.6
2239 BBP-21347 BBP-21347 0.435 0.326 Red 0.86 -7.3 - - 73 422 2 3.8 3.6
2240 BBP-20619 BBP-20619 0.435 0.277 Red 0.85 -7.2 - - 75 420 2 4.3 2.7
2241 BBP-27292 BBP-27292 0.435 0.437 Yellow 0.79 - - - 86 423 2 3.9 3.7
2242 BBP-20438 BBP-20438 0.435 0.295 Yellow 0.67 -6.4 - - 83 398 2 4.3 2.9
2243 BBP-20572 BBP-20572 0.435 0.311 Red 0.82 -7.5 - - 57 365 2 4.3 3.0
2244 BBP-22249 BBP-22249 0.435 0.352 Yellow 0.72 - - - 83 395 2 3.8 3.0
2245 BBP-23106 BBP-23106 0.435 0.402 Yellow 0.69 - - - 83 381 2 3.8 2.9
2246 BBP-24842 BBP-24842 0.435 0.443 Yellow 0.65 - - - 83 371 2 3.9 3.2
2247 BBP-25653 BBP-25653 0.435 0.371 Yellow 0.71 - - - 88 405 2 3.8 3.9
2248 BBP-20373 BBP-20373 0.434 0.322 Yellow 0.48 -7.1 - - 87 416 2 3.8 2.7
2249 BBP-20567 BBP-20567 0.434 0.315 Yellow 0.56 -7.1 - - 83 403 2 4.0 3.3
2250 BBP-20695 BBP-20695 0.434 0.271 Yellow 0.68 -6.5 - - 90 393 3 3.4 2.8