• UNII FDA
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Records 50001 to 50020 of 55865
 
PUBCHEM ID
UNII
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Total Surface Area
Relative PSA
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
71749862 4AF6UXL7P7 mol2, pdbqt 316,54 0,48196 200,28 -4,335 443,415 -0,8832 12 6 2 -7,8979 0,344908413300848
71750183 G25D1I5MV5 mol2, pdbqt 187,27 0,23762 47,56 -3,414 235,282 1,9373 4 1 0 0,91657 0,450874687937967
71750191 3O7WP2IF5N mol2, pdbqt 167,01 0,1467 29,1 -2,703 191,273 1,8259 2 1 0 0,9925 0,799002552459106
71750237 A297J1UL90 mol2, pdbqt 165,51 0,14803 29,1 -2,777 191,273 1,7154 2 1 0 3,0303 0,901504528800057
71750299 RUW998528M mol2, pdbqt 255,8 0,14105 43,37 -4,962 368,515 3,8043 3 0 0 -2,6847 0,194701618293951
71750426 P5OOP2R46Y mol2, pdbqt 237,06 0,2758 73,22 -4,518 309,324 2,7984 6 1 0 -1,554 0,124040291152661
71750427 TA03C65A25 mol2, pdbqt 237,43 0,30535 84,08 -5,199 309,324 3,0095 6 2 0 -2,7861 0,20639783286546
71750454 70OGS6YK6X mol2, pdbqt 250,68 0,24294 75,27 -3,769 330,431 2,304 5 2 0 -3,87 0,330341509258977
71750570 YE26H8DS3H mol2, pdbqt 333,3 0,27153 117,27 -3,034 456,63 2,0383 8 2 0 4,3555 0,740159983075298
71750574 ZS47CNX0FD mol2, pdbqt 319,76 0,17741 61,94 -4,699 424,518 3,8615 6 0 0 5,5961 0,591167344984161
71750585 YN1BVC23U3 mol2, pdbqt 179,87 0,092233 20,31 -2,831 217,311 2,3185 2 0 0 4,0031 0,537169117501347
71750742 9TK9IO76V9 mol2, pdbqt 331,64 0,38153 165,86 -2,363 466,485 -0,7595 11 5 1 -6,9683 0,386206036506691
71750756 OSM0Q2A1Y3 mol2, pdbqt 437,06 0,21537 103,4 -4,414 554,681 3,5236 9 1 1 -22,85 0,249826442948467
71750757 ZE52T9A87B mol2, pdbqt 437,06 0,21537 103,4 -4,414 554,681 3,5236 9 1 1 -22,85 0,249826442948467
71750760 6SJ97G618S mol2, pdbqt 365,21 0,2087 85,38 -3,49 480,559 2,4675 8 0 0 1,1356 0,359705085156433
71750797 07HL20X14D mol2, pdbqt 294,5 0,3983 162,78 -3,903 430,412 0,2582 10 5 0 1,7368 0,683941107124034
71750799 B4F924P558 mol2, pdbqt 294,5 0,3983 162,78 -3,903 430,412 0,2582 10 5 0 1,7368 0,683941107124034
71750850 8Z2XN3J4DW mol2, pdbqt 362,29 0,39515 163,47 3,688 485,632 2,4451 11 1 1 4,3401 0,738840055441274
71750851 06564J1R3Z mol2, pdbqt 362,29 0,39515 163,47 3,688 485,632 2,4451 11 1 1 4,3401 0,738840055441274
71750858 9EI1SIA8XV mol2, pdbqt 314,08 0,3232 136,07 -3,072 481,5 -0,6089 10 2 0 1,9929 0,68333955757424
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 of 2794
Records 50001 to 50020 of 55865
These data are only available for scientific research purposes.