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Records 141 to 160 of 321
 
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TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
237430-03-4 kin-237430-03-4.mol2, kin-237430-03-4.pdbqt 90,71 -4,77 293,281 1,6369 6 2 0 -3,195 0,229499314339554
260415-63-2 kin-260415-63-2.mol2, kin-260415-63-2.pdbqt 83,42 -7,035 443,357 4,9379 5 1 0 3,93 0,348205867893443
264218-23-7 kin-264218-23-7.mol2, kin-264218-23-7.pdbqt 124,25 -3,878 359,724 0,7512 8 3 0 -1,1143 0,500561250965278
267243-28-7 kin-267243-28-7.mol2, kin-267243-28-7.pdbqt 88,61 -5,595 485,946 4,0277 8 2 0 -7,6496 6,92851540693117E-02
267654-00-2 kin-267654-00-2.mol2, kin-267654-00-2.pdbqt 70,23 -3,807 260,36 3,6997 3 1 0 2,3144 0,733448363315046
269390-77-4 kin-269390-77-4.mol2, kin-269390-77-4.pdbqt 54,02 -4,494 371,361 3,7196 4 2 0 -5,9252 0,330860106901454
280744-09-4 kin-280744-09-4.mol2, kin-280744-09-4.pdbqt 51,1 -4,165 371,222 2,8893 4 1 0 4,4971 0,728260329163263
284461-73-0 kin-284461-73-0.mol2, kin-284461-73-0.pdbqt 92,35 -6,689 464,83 4,1428 7 3 0 -5,1185 0,198405893946852
28882-53-3 kin-28882-53-3.mol2, kin-28882-53-3.pdbqt 71,44 -5,867 306,316 3,563 4 1 0 -2,0769 0,18658498148244
293302-14-4 kin-293302-14-4.mol2, kin-293302-14-4.pdbqt 49,33 -3,073 237,257 1,92 3 2 0 2,6991 0,521309132882187
293302-19-9 kin-293302-19-9.mol2, kin-293302-19-9.pdbqt 38,33 -4,547 307,392 3,7776 3 1 0 -0,4441 0,284477445525103
30220-46-3 kin-30220-46-3.mol2, kin-30220-46-3.pdbqt 97,99 -2,381 348,437 0,9134 5 4 0 -0,49807 0,221050823434611
302962-49-8 kin-302962-49-8.mol2, kin-302962-49-8.pdbqt 134,75 -4,701 488,014 3,6259 9 3 0 8,0376 0,195597519307076
303-45-7 kin-303-45-7.mol2, kin-303-45-7.pdbqt 155,52 -8,216 518,56 6,5618 8 6 3 -4,3442 5,34885320107143E-02
305350-87-2 kin-305350-87-2.mol2, kin-305350-87-2.pdbqt 101,13 -5,074 335,352 3,0949 3 2 0 -12,054 0,325301227711688
30562-34-6 kin-30562-34-6.mol2, kin-30562-34-6.pdbqt 163,48 -3,929 560,642 2,8712 11 3 2 7,0343 0,547281286543387
30827-99-7 kin-30827-99-7.mol2, kin-30827-99-7.pdbqt 68,54 -0,103 203,236 1,1723 3 1 0 -6,5817 0,292025008744937
312636-16-1 kin-312636-16-1.mol2, kin-312636-16-1.pdbqt 73,39 -5,145 302,784 4,8258 3 2 0 1,819 0,502886456622304
312917-14-9 kin-312917-14-9.mol2, kin-312917-14-9.pdbqt 81,13 -6,759 332,426 5,0501 3 1 1 -6,4253 0,120592364103226
319460-85-0 kin-319460-85-0.mol2, kin-319460-85-0.pdbqt 95,97 -4,87 386,478 3,4441 5 2 0 3,4513 0,61852127293714
These data are only available for scientific research purposes.