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Records 1461 to 1480 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
172191 BDB-kin174304.mol2, BDB-kin174304.pdbqt 251,9 64,69 -3,69 300,364 2,97 4 1 0 -5,6089 0,242902126068385
172192 BDB-kin174305.mol2, BDB-kin174305.pdbqt 381,16 75,35 -4,947 483,589 4,6712 6 1 0 -0,83935 0,3015947899839
172193 BDB-kin174307.mol2, BDB-kin174307.pdbqt 325,89 72,11 -5,182 416,911 4,6753 5 1 0 -0,13645 0,364502450403874
172194 BDB-kin174308.mol2, BDB-kin174308.pdbqt 348,45 75,35 -4,065 445,953 3,9627 6 1 0 4,6 0,615405641344974
172195 BDB-kin174309.mol2, BDB-kin174309.pdbqt 390,23 75,35 -5,369 500,044 5,1764 6 1 2 0,5105 0,31244642741375
172196 BDB-kin174310.mol2, BDB-kin174310.pdbqt 335,89 81,34 -4,563 432,91 3,8533 6 1 0 -0,98925 0,379849068901379
172197 BDB-kin174311.mol2, BDB-kin174311.pdbqt 308,87 72,11 -4,496 390,873 3,8843 5 1 0 -1,4203 0,379832408641474
172198 BDB-kin174312.mol2, BDB-kin174312.pdbqt 295,48 94,32 -4,693 377,467 2,9906 5 1 0 -3,7588 0,343760342403488
172199 BDB-kin174313.mol2, BDB-kin174313.pdbqt 347,29 75,35 -4,093 437,545 3,8864 6 1 0 3,2848 0,618586716877453
172200 BDB-kin174314.mol2, BDB-kin174314.pdbqt 293,45 72,11 -3,76 356,428 3,2783 5 1 0 -1,474 0,449807134838142
172201 BDB-kin174315.mol2, BDB-kin174315.pdbqt 320,47 81,34 -3,827 398,465 3,2473 6 1 0 -1,0334 0,45669689045346
172202 BDB-kin174316.mol2, BDB-kin174316.pdbqt 333,03 75,35 -3,329 411,508 3,3567 6 1 0 4,6071 0,733892357894115
172203 BDB-kin174317.mol2, BDB-kin174317.pdbqt 265,66 64,69 -3,849 314,391 3,3856 4 1 0 -5,953 0,230866684955855
172204 BDB-kin174318.mol2, BDB-kin174318.pdbqt 311,53 80,9 -5,017 390,873 4,0334 5 2 0 -2,5688 0,308657767293401
172205 BDB-kin174319.mol2, BDB-kin174319.pdbqt 311,28 75,59 -5,584 366,467 4,8161 4 1 0 -12,67 0,15386523446748
172206 BDB-kin174320.mol2, BDB-kin174320.pdbqt 279,42 64,69 -4,008 328,418 3,8012 4 1 0 -5,953 0,36159032779943
172207 BDB-kin174321.mol2, BDB-kin174321.pdbqt 277,92 64,69 -4,217 328,418 3,7835 4 1 0 -5,953 0,353192633486052
172208 BDB-kin174322.mol2, BDB-kin174322.pdbqt 279,92 64,69 -4,462 340,429 4,1525 4 1 0 -4,237 0,329028520588956
172209 BDB-kin174323.mol2, BDB-kin174323.pdbqt 282,86 64,69 -4,283 368,361 3,89 4 1 0 -13,143 0,33490399926719
172210 BDB-kin174324.mol2, BDB-kin174324.pdbqt 340,58 81,34 -4,3 430,482 3,7637 6 1 0 -2,552 0,336791733232515
These data are only available for scientific research purposes.