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Records 301 to 320 of 321
 
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TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
877399-52-5 kin-877399-52-5.mol2, kin-877399-52-5.pdbqt 77,99 -5,264 450,344 3,5382 6 2 0 3,1708 0,523528594869751
88519-57-7 kin-88519-57-7.mol2, kin-88519-57-7.pdbqt 80,57 -3,92 312,82 2,576 4 2 0 0,28139 0,375664113728884
885692-52-4 kin-885692-52-4.mol2, kin-885692-52-4.pdbqt 105,12 -3,072 460,58 2,551 8 2 0 -3,2994 0,376264780707369
894804-07-0 kin-894804-07-0.mol2, kin-894804-07-0.pdbqt 119,49 -4,551 356,381 1,8617 8 2 0 -4,6733 0,367758177210794
900515-16-4 kin-900515-16-4.mol2, kin-900515-16-4.pdbqt 104,84 -4,627 305,285 2,1834 5 2 0 2,6375 0,257345432561989
915019-65-7 kin-915019-65-7.mol2, kin-915019-65-7.pdbqt 73,12 -9,336 469,547 6,2031 6 0 1 -6,8855 0,047638184734188
918504-65-1 kin-918504-65-1.mol2, kin-918504-65-1.pdbqt 100,3 -9,33 489,929 4,5779 6 2 0 -1,1096 0,116352776309013
92564-34-6 kin-92564-34-6.mol2, kin-92564-34-6.pdbqt 131,84 -2,45 293,35 -0,3791 7 3 0 2,2716 0,881198519153389
93076-89-2 kin-93076-89-2.mol2, kin-93076-89-2.pdbqt 61,21 -5,693 459,587 4,1777 4 0 0 5,7956 0,273952720226144
936091-26-8 kin-936091-26-8.mol2, kin-936091-26-8.pdbqt 116,86 -5,375 524,688 4,9144 9 3 1 -0,84176 0,119221233108807
941678-49-5 kin-941678-49-5.mol2, kin-941678-49-5.pdbqt 83,18 -3,921 306,372 1,6767 6 1 0 -5,579 0,411394880061658
943319-70-8 kin-943319-70-8.mol2, kin-943319-70-8.pdbqt 65,77 -4,215 532,568 3,8413 7 1 1 -0,0811 0,385583772164517
94421-68-8 kin-94421-68-8.mol2, kin-94421-68-8.pdbqt 49,33 -4,192 347,541 6,3046 3 2 1 -16,018 0,238841953603593
944396-07-0 kin-944396-07-0.mol2, kin-944396-07-0.pdbqt 89,63 -3,976 410,399 1,427 8 1 0 -6,0877 0,3744136033005
94825-74-8 kin-94825-74-8.mol2, kin-94825-74-8.pdbqt 108,25 -0,151 235,235 -2,1825 7 4 0 -0,45289 0,677535950564215
950769-58-1 kin-950769-58-1.mol2, kin-950769-58-1.pdbqt 134,4 -5,721 560,677 4,7979 10 2 1 1,8174 0,253696864349079
957054-30-7 kin-957054-30-7.mol2, kin-957054-30-7.pdbqt 144,17 -4,488 513,645 1,3339 10 1 1 7,3525 0,351181408968698
96562-96-8 kin-96562-96-8.mol2, kin-96562-96-8.pdbqt 61,96 -2,066 243,06 0,6861 4 2 0 0,40903 0,758091526252138
989-51-5 kin-989-51-5.mol2, kin-989-51-5.pdbqt 197,37 -2,16 458,374 2,0543 11 8 2 -0,32874 0,545493663535709
99533-80-9 kin-99533-80-9.mol2, kin-99533-80-9.pdbqt 94,72 -6,49 467,48 4,0177 8 2 0 1,9148 0,381914302368002
These data are only available for scientific research purposes.