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Records 3921 to 3940 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50394173 BDB-kin50394840.mol2, BDB-kin50394840.pdbqt 277,78 63,17 -4,808 367,839 3,372 6 1 0 1,3508 0,58318247999974
50394174 BDB-kin50394841.mol2, BDB-kin50394841.pdbqt 416,39 137,59 -5,826 545,666 4,3036 10 3 1 1,9018 0,208414965140342
50394175 BDB-kin50394842.mol2, BDB-kin50394842.pdbqt 350,31 160,37 -5,642 475,532 2,6925 10 4 0 -1,7289 0,174290905694889
50394176 BDB-kin50394843.mol2, BDB-kin50394843.pdbqt 388,87 137,59 -5,226 517,612 3,491 10 3 1 0,92333 0,244542820821801
50394177 BDB-kin50394844.mol2, BDB-kin50394844.pdbqt 377,77 146,38 -5,64 503,586 3,3978 10 4 1 0,62738 0,227396649018689
50394178 BDB-kin50394845.mol2, BDB-kin50394845.pdbqt 299,46 131,71 -3,971 412,473 1,53 9 2 0 -2,6604 0,23792461615761
50394179 BDB-kin50394846.mol2, BDB-kin50394846.pdbqt 392,03 137,59 -5,618 538,031 3,7531 10 3 1 2,0417 0,235368269123792
50394180 BDB-kin50394847.mol2, BDB-kin50394847.pdbqt 310,96 131,71 -4,813 438,511 1,8862 9 2 0 -2,2027 0,209274115276868
50394181 BDB-kin50394848.mol2, BDB-kin50394848.pdbqt 303,22 122,48 -4,86 410,501 2,694 8 2 0 -3,4106 0,19795350505474
50394182 BDB-kin50394849.mol2, BDB-kin50394849.pdbqt 310,96 131,71 -4,813 438,511 1,8862 9 2 0 -5,3152 0,191265437074937
50394183 BDB-kin50394850.mol2, BDB-kin50394850.pdbqt 296,71 151,5 -3,991 400,462 1,442 9 4 0 -5,3245 0,227628149837975
50394184 BDB-kin50394851.mol2, BDB-kin50394851.pdbqt 362,57 160,37 -5,986 489,559 3,0364 10 4 0 0,94139 0,235662409441186
50394185 BDB-kin50394852.mol2, BDB-kin50394852.pdbqt 380,93 146,38 -6,032 524,004 3,6599 10 4 1 1,7483 0,22451494621212
50394186 BDB-kin50394853.mol2, BDB-kin50394853.pdbqt 299,96 122,48 -4,504 398,49 2,57 8 2 0 -2,0539 0,230249224509564
50394187 BDB-kin50394854.mol2, BDB-kin50394854.pdbqt 284,62 72,4 -4,09 363,42 2,696 7 1 0 1,3201 0,671972085856314
50394188 BDB-kin50394855.mol2, BDB-kin50394855.pdbqt 312,02 125,72 -3,473 425,516 1,6394 9 2 0 2,7483 0,445485786321697
50394189 BDB-kin50394856.mol2, BDB-kin50394856.pdbqt 291,82 63,17 -4,85 401,391 3,6143 6 1 0 -5,873 0,306210522227728
50394838 BDB-kin50394857.mol2, BDB-kin50394857.pdbqt 355,44 154,25 -6,293 477,548 2,5206 10 2 0 0,80721 0,232257876758513
50394839 BDB-kin50394858.mol2, BDB-kin50394858.pdbqt 314,6 111,73 -5,876 399,457 3,5186 8 2 0 -1,0081 0,19750830537522
50394840 BDB-kin50394859.mol2, BDB-kin50394859.pdbqt 335,26 157,49 -3,875 456,53 0,6086 11 2 1 -1,2515 0,260261628590485
These data are only available for scientific research purposes.