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Records 261 to 280 of 321
 
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TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
690206-97-4 kin-690206-97-4.mol2, kin-690206-97-4.pdbqt 56,27 -5,302 333,749 3,8619 5 1 0 -2,1675 0,324526561152987
693228-63-6 kin-693228-63-6.mol2, kin-693228-63-6.pdbqt 117,43 -4,54 368,464 3,0005 7 2 0 2,8101 0,242594989260309
698387-09-6 kin-698387-09-6.mol2, kin-698387-09-6.pdbqt 112,4 -6,074 557,052 4,3389 9 2 1 -4,0813 0,105983701057499
702675-74-9 kin-702675-74-9.mol2, kin-702675-74-9.pdbqt 139,52 -6,424 591,472 4,1768 9 4 1 6,2427 0,315955069391266
70563-58-5 kin-70563-58-5.mol2, kin-70563-58-5.pdbqt 152,48 -3,727 574,668 2,7771 11 2 2 6,347 0,545856315713395
71774-10-2 kin-71774-10-2.mol2, kin-71774-10-2.pdbqt 66,76 -4,333 336,47 6,0516 4 2 1 -17,808 5,65067901232991E-02
7184-60-3 kin-7184-60-3.mol2, kin-7184-60-3.pdbqt 127,85 -5,21 489,65 4,9055 7 3 0 -7,5166 0,211175452109576
71897-07-9 kin-71897-07-9.mol2, kin-71897-07-9.pdbqt 25,78 -3,888 234,301 3,5352 2 0 0 -1,88 0,440655837572533
724708-21-8 kin-724708-21-8.mol2, kin-724708-21-8.pdbqt 112,37 -3,275 295,301 -0,2617 7 4 0 3,6516 0,874394869962729
7272-84-6 kin-7272-84-6.mol2, kin-7272-84-6.pdbqt 25,25 -2,064 194,236 0,8734 2 0 0 0,39015 0,762270901977573
73208-40-9 kin-73208-40-9.mol2, kin-73208-40-9.pdbqt 179,67 -3,491 345,275 -2,2109 10 3 0 -10,597 9,76592301120941E-02
73885-53-7 kin-73885-53-7.mol2, kin-73885-53-7.pdbqt 78,93 -7,616 650,769 6,5577 9 0 2 4,2692 0,177567844175171
755037-03-7 kin-755037-03-7.mol2, kin-755037-03-7.pdbqt 92,35 -7,003 482,82 4,2436 7 3 0 -5,1185 0,183405353479786
755038-02-9 kin-755038-02-9.mol2, kin-755038-02-9.pdbqt 102,93 -5,348 521,664 3,239 10 2 1 7,9566 0,470068226837186
75593-17-8 kin-75593-17-8.mol2, kin-75593-17-8.pdbqt 112,37 -1,774 245,241 -1,5786 7 4 0 3,6912 0,946549197122175
75706-12-6 kin-75706-12-6.mol2, kin-75706-12-6.pdbqt 55,13 -3,371 270,209 2,4636 4 1 0 -6,1082 0,42993607063269
75747-14-7 kin-75747-14-7.mol2, kin-75747-14-7.pdbqt 166,28 -4,302 585,695 3,0722 11 4 2 4,6788 0,491041413821091
764-22-7 kin-764-22-7.mol2, kin-764-22-7.pdbqt 66,48 -4,075 301,513 4,8795 3 3 0 -20,547 0,314337240351911
76958-67-3 kin-76958-67-3.mol2, kin-76958-67-3.pdbqt 125,82 -2,526 378,376 0,5683 8 3 0 -0,20203 0,3763715873432
77286-66-9 kin-77286-66-9.mol2, kin-77286-66-9.pdbqt 78,04 1,121 270,285 -2,7269 6 1 0 -29,945 0,387546176790326
These data are only available for scientific research purposes.