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Records 1981 to 2000 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
174736 BDB-kin178338.mol2, BDB-kin178338.pdbqt 337,63 93,49 -6,199 443,506 2,7654 8 1 0 1,4071 0,439453712760941
174737 BDB-kin178339.mol2, BDB-kin178339.pdbqt 365,14 123,69 -7,083 485,542 2,8536 9 2 0 1,9466 0,380754436737007
174738 BDB-kin178340.mol2, BDB-kin178340.pdbqt 374,89 89,83 -7,006 486,57 3,5969 8 1 0 1,2723 0,345730354464321
174739 BDB-kin178341.mol2, BDB-kin178341.pdbqt 368,33 80,6 -7,772 510,515 4,6146 7 1 1 -5,7829 0,155499725213192
174740 BDB-kin178342.mol2, BDB-kin178342.pdbqt 351,13 80,6 -7,338 456,544 4,1102 7 1 0 1,4071 0,341044516386861
174741 BDB-kin178343.mol2, BDB-kin178343.pdbqt 361,13 89,83 -7,012 472,543 3,6963 8 1 0 1,4071 0,356016694551413
174742 BDB-kin178344.mol2, BDB-kin178344.pdbqt 337,63 93,49 -6,724 443,506 3,1168 8 1 0 1,4071 0,403177219179715
174743 BDB-kin178345.mol2, BDB-kin178345.pdbqt 315,37 84,26 -6,181 413,48 2,8354 7 1 0 1,3514 0,45673222797399
174744 BDB-kin178346.mol2, BDB-kin178346.pdbqt 315,37 84,26 -6,181 413,48 2,8354 7 1 0 1,3514 0,45673222797399
174745 BDB-kin178347.mol2, BDB-kin178347.pdbqt 337,63 93,49 -6,199 443,506 2,7654 8 1 0 1,4071 0,439453712760941
174746 BDB-kin178348.mol2, BDB-kin178348.pdbqt 337,63 93,49 -6,724 443,506 3,1168 8 1 0 1,4071 0,403177219179715
174747 BDB-kin178349.mol2, BDB-kin178349.pdbqt 321,72 84,26 -7,02 431,47 3,2876 7 1 0 0,011446 0,328474956615185
174748 BDB-kin178350.mol2, BDB-kin178350.pdbqt 316,83 89,19 -5,743 416,484 1,8986 8 1 0 4,4604 0,556887418789937
174749 BDB-kin178351.mol2, BDB-kin178351.pdbqt 341,35 89,19 -6,479 444,537 2,6944 8 1 0 4,3541 0,466874107904023
174750 BDB-kin178352.mol2, BDB-kin178352.pdbqt 310,68 64,03 -7,033 417,899 4,0387 6 0 0 1,4844 0,377010184604029
174751 BDB-kin178353.mol2, BDB-kin178353.pdbqt 391,17 135,15 -6,797 535,623 3,1358 10 2 1 -0,076535 0,275105173207711
174752 BDB-kin178354.mol2, BDB-kin178354.pdbqt 368,08 109,7 -6,632 485,542 3,6403 9 2 0 2,3833 0,386044132510565
174753 BDB-kin178355.mol2, BDB-kin178355.pdbqt 330,72 106,54 -5,841 435,483 2,781 9 1 0 1,3096 0,4657456631259
174755 BDB-kin178356.mol2, BDB-kin178356.pdbqt 279,11 80,6 -4,849 366,42 2,1233 7 1 0 1,4071 0,6182133829302
174767 BDB-kin178357.mol2, BDB-kin178357.pdbqt 364,27 104,74 -5,91 489,578 1,9927 10 2 0 3,2647 0,472217742345024
These data are only available for scientific research purposes.