• UNII FDA
Page 
 of 2794
Records 47341 to 47360 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
56841018 4OC7QTI23H mol2, pdbqt 96,48 0,70015 100,62 -0,151 133,103 -3,813 5 3 0 -11,987 0,495010353470141
56841043 3QJA87N40S mol2, pdbqt 397,02 0,38122 205,45 0,641 527,525 -6,2899 14 5 2 -7,8746 0,354047247672916
56841073 7AT6GVO7OA mol2, pdbqt 891,62 0,41789 474,63 -4,715 1182,31 -5,0492 30 16 3 11,381 0,392791321269973
56841121 HC3530GGGG mol2, pdbqt 895,74 0,30587 366,48 -5,686 1149,33 2,7144 22 11 3 -40,574 0,159228426452479
56841136 9C9H20H712 mol2, pdbqt 188,46 0,26059 61,69 -3,205 252,272 1,5769 4 2 0 0,15908 0,686590564007476
56841305 457804D95J mol2, pdbqt 317,58 0,56672 275,84 0,838 492,23 -15,307 14 8 2 -26,922 0,380269899830455
56841306 M9AHX58RXK mol2, pdbqt 317,58 0,56672 275,84 0,838 492,23 -15,307 14 8 2 -26,922 0,380269899830455
56841307 EI380F0C1Z mol2, pdbqt 317,58 0,56672 275,84 0,838 492,23 -15,307 14 8 2 -26,922 0,380269899830455
56841405 LO53AXD8GP mol2, pdbqt 357,43 0,15832 57,23 -3,887 429,555 4,585 6 0 0 0,77255 0,401901149679133
56841530 Y6911BZ2UL mol2, pdbqt 264,13 0,11324 31,23 -4,737 321,419 4,511 3 0 0 -2,4379 0,324448335234921
56841534 CCJ8I8TG3H mol2, pdbqt 149,74 0,17524 38,91 -3,899 194,236 2,6152 2 1 0 -1,9084 0,168268585437525
56841552 J4D3K58W3Z mol2, pdbqt 309,03 0,184 63,05 -4,17 409,92 2,9187 6 1 0 5,798 0,698602794906225
56841591 33DX49E09G mol2, pdbqt 376,56 0,32505 141,32 -3,212 504,678 1,6912 9 2 1 4,3601 0,673305297144778
56841614 0G63Q22980 mol2, pdbqt 149,08 0,64442 119,5 0,765 265,053 0,7704 7 5 0 -4,3171 0,084331311237456
56841623 9T3UU8T0QK mol2, pdbqt 39,24 1 57,53 2,01 78,0989 0,3317 3 2 0 -2,5375 0,532220323047579
56841653 662MCS79XH mol2, pdbqt 415,9 0,20931 99,77 -4,454 538,662 2,4815 8 3 1 5,7436 0,543956138967352
56841657 N0ZE3Z7AO7 mol2, pdbqt 315,4 0,20793 89,92 -6,066 491,242 5,6279 5 1 1 -16,495 0,161524292697452
56841675 42FOP1YX93 mol2, pdbqt 308,68 0,12958 64,1 -3,744 382,46 2,4718 4 0 0 -20,041 0,38616258891504
56841697 L4LQ8HV8XP mol2, pdbqt 278,17 0,11878 35,53 -5,44 415,209 4,6471 3 0 0 -0,38458 4,36075492916978E-02
56841700 G3XE42P81Y mol2, pdbqt 334,08 0,19373 89,05 -3,975 388,567 5,0008 5 1 1 -32,068 0,291604571042745
Page 
 of 2794
Records 47341 to 47360 of 55865
These data are only available for scientific research purposes.