Compounds (3260 results)

Rank ID Structure Score 1664 Sim Traffic BBB Vina 3D PSA MDCK TPSA MW HBD SlogP SA
1201 BBP-19495 BBP-19495 0.487 - Yellow 0.73 -7.0 50 -4.7 83 402 2 4.1 4.2
1202 BBP-19619 BBP-19619 0.487 - Yellow 0.74 -7.2 79 -4.7 83 414 2 4.4 4.2
1203 BBP-23037 BBP-23037 0.487 - Green 0.64 - 53 -4.7 70 366 2 4.1 2.6
1204 BBP-24927 BBP-24927 0.487 - Green 0.58 - 31 -4.7 74 371 1 3.6 3.2
1205 BBP-20281 BBP-20281 0.487 - Yellow 0.66 -7.3 64 -5.3 86 386 2 2.6 2.7
1206 BBP-20647 BBP-20647 0.487 - Yellow 0.72 -7.2 88 -5.3 89 424 2 2.1 2.9
1207 BBP-22494 BBP-22494 0.487 - Green 0.67 - 61 -4.7 70 352 2 3.7 3.1
1208 BBP-01959 BBP-01959 0.487 - Yellow 0.48 -6.7 26 -4.7 73 417 2 4.4 3.2
1209 BBP-22435 BBP-22435 0.487 - Green 0.62 - 56 -4.7 73 403 2 3.0 2.6
1210 BBP-22196 BBP-22196 0.487 - Green 0.67 - 39 -4.7 70 370 2 3.8 3.1
1211 BBP-25717 BBP-25717 0.487 - Green 0.75 - 57 -4.7 83 379 2 3.9 2.8
1212 BBP-19600 BBP-19600 0.487 - Yellow 0.56 -6.3 29 -4.7 70 366 2 4.2 2.7
1213 BBP-21032 BBP-21032 0.487 - Yellow 0.74 -6.9 58 -4.7 83 385 2 3.4 2.9
1214 BBP-27115 BBP-27115 0.487 - Yellow 0.77 -6.7 48 -4.8 82 454 2 4.0 4.2
1215 BBP-23380 BBP-23380 0.487 - Green 0.78 - 42 -4.7 73 422 2 4.5 3.5
1216 BBP-22890 BBP-22890 0.487 - Green 0.75 - 31 -4.8 76 443 2 3.7 3.0
1217 BBP-20634 BBP-20634 0.487 - Yellow 0.73 -7.1 78 -4.9 89 434 2 2.7 3.3
1218 BBP-23156 BBP-23156 0.487 - Green 0.52 - 33 -4.7 75 405 2 4.4 3.0
1219 BBP-19668 BBP-19668 0.487 - Yellow 0.51 -6.5 31 -4.7 70 358 2 4.0 3.0
1220 BBP-19749 BBP-19749 0.487 - Yellow 0.64 -6.8 50 -4.8 77 451 1 3.8 3.8
1221 BBP-21044 BBP-21044 0.487 - Yellow 0.62 -6.7 42 -4.7 83 379 2 4.3 3.3
1222 BBP-22670 BBP-22670 0.487 - Green 0.53 - 51 -4.7 75 359 2 3.5 3.4
1223 BBP-20816 BBP-20816 0.486 - Yellow 0.73 -6.4 64 -4.7 74 397 2 4.1 3.6
1224 BBP-22487 BBP-22487 0.486 - Green 0.62 - 57 -4.7 73 403 2 3.0 2.6
1225 BBP-22585 BBP-22585 0.486 - Green 0.54 - 39 -4.7 61 370 1 4.2 3.2
1226 BBP-23101 BBP-23101 0.486 - Green 0.52 - 50 -5.0 74 375 1 2.7 3.3
1227 BBP-24200 BBP-24200 0.486 - Yellow 0.41 -6.5 57 -4.7 79 465 2 4.2 3.3
1228 BBP-23293 BBP-23293 0.486 - Green 0.65 - 54 -4.7 74 385 1 3.1 3.9
1229 BBP-22957 BBP-22957 0.486 - Green 0.71 - 73 -4.7 77 440 2 4.2 2.9
1230 BBP-28732 BBP-28732 0.486 - Green 0.61 - 50 -4.7 73 415 2 4.2 3.0
1231 BBP-19161 BBP-19161 0.486 - Yellow 0.68 -7.4 66 -4.7 83 399 2 3.6 2.9
1232 BBP-22315 BBP-22315 0.486 - Green 0.75 - 69 -4.7 70 380 2 4.3 3.3
1233 BBP-22639 BBP-22639 0.486 - Green 0.55 - 40 -4.7 61 370 1 4.2 3.2
1234 BBP-20082 BBP-20082 0.486 - Yellow 0.69 -7.5 60 -4.7 83 385 2 3.5 3.5
1235 BBP-21708 BBP-21708 0.486 - Yellow 0.70 -7.1 84 -4.8 88 431 2 4.2 3.0
1236 BBP-23234 BBP-23234 0.486 - Green 0.63 - 47 -4.7 74 393 1 4.3 3.4
1237 BBP-25098 LEAD BBP-25098 0.486 - Green 0.54 - 29 -4.7 75 359 2 3.5 3.4
1238 BBP-22207 BBP-22207 0.485 - Green 0.72 - 75 -4.7 70 387 2 4.4 2.8
1239 BBP-21721 BBP-21721 0.485 - Green 0.71 -7.6 102 -4.8 83 414 2 4.4 3.0
1240 BBP-10043 BBP-10043 0.485 - Yellow 0.45 -6.8 65 -4.7 79 404 2 4.3 3.6
1241 BBP-20425 BBP-20425 0.485 - Yellow 0.77 -6.9 86 -4.7 83 381 2 3.5 2.8
1242 BBP-26129 BBP-26129 0.485 - Green 0.58 - 45 -4.7 74 385 1 3.9 3.3
1243 BBP-23075 BBP-23075 0.485 - Green 0.71 - 43 -4.7 70 380 2 4.4 2.8
1244 BBP-17298 BBP-17298 0.485 - Yellow 0.73 -6.9 63 -4.7 86 390 2 2.9 2.8
1245 BBP-19437 BBP-19437 0.485 - Yellow 0.78 -7.2 53 -4.7 83 378 2 3.8 3.3
1246 BBP-22276 BBP-22276 0.485 - Green 0.67 - 50 -4.7 70 381 2 4.3 2.8
1247 BBP-18440 BBP-18440 0.484 - Yellow 0.64 -7.2 47 -4.7 79 387 3 4.1 4.2
1248 BBP-21840 BBP-21840 0.484 - Green 0.63 -7.9 47 -4.7 86 414 2 3.4 3.8
1249 BBP-21652 BBP-21652 0.484 - Yellow 0.70 -6.7 73 -4.7 85 392 3 3.4 3.2
1250 BBP-23098 BBP-23098 0.484 - Green 0.70 - 57 -4.7 74 420 1 4.0 3.2