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Records 4201 to 4220 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50439523 BDB-kin50447625.mol2, BDB-kin50447625.pdbqt 304,89 97,2 -5,303 395,465 1,9388 9 2 0 4,0375 0,106068632472775
50439524 BDB-kin50447626.mol2, BDB-kin50447626.pdbqt 293,89 97,2 -4,925 381,439 1,6141 9 2 0 3,7016 0,115132609557104
50439525 BDB-kin50447627.mol2, BDB-kin50447627.pdbqt 318,65 97,2 -5,308 409,492 2,1948 9 2 0 3,6441 0,10308390938256
50439526 BDB-kin50447628.mol2, BDB-kin50447628.pdbqt 318,65 97,2 -5,308 409,492 2,1948 9 2 0 3,6441 0,596550401519445
50439527 BDB-kin50447629.mol2, BDB-kin50447629.pdbqt 304,89 97,2 -5,303 395,465 1,9388 9 2 0 4,0375 0,106068632472775
50439528 BDB-kin50447630.mol2, BDB-kin50447630.pdbqt 346,17 117,43 -4,956 453,545 2,1042 10 3 0 3,0495 0,101633541592639
50442673 BDB-kin50447631.mol2, BDB-kin50447631.pdbqt 262,52 107,16 -5,335 335,37 0,3602 8 2 0 1,5985 0,606496748343934
50447249 BDB-kin50447632.mol2, BDB-kin50447632.pdbqt 391,61 114,71 -8,313 509,628 5,6554 6 2 2 3,0771 0,2497841341175
50447250 BDB-kin50447633.mol2, BDB-kin50447633.pdbqt 350,95 144,68 -5,623 477,544 2,7877 9 3 0 2,126 0,380520427110849
50447251 BDB-kin50447634.mol2, BDB-kin50447634.pdbqt 261,54 125,53 -4,179 377,383 2,0541 8 1 0 5,0233 0,447898856135677
50447252 BDB-kin50447635.mol2, BDB-kin50447635.pdbqt 255,48 97,87 -5,022 334,338 1,9765 8 2 0 4,2957 0,245283693167779
50447253 BDB-kin50447636.mol2, BDB-kin50447636.pdbqt 279,2 76,74 -6,819 384,386 4,4991 5 1 0 0,50667 0,202723155084568
50447618 BDB-kin50447637.mol2, BDB-kin50447637.pdbqt 319,44 128,47 -6,623 457,46 2,9438 8 2 0 -0,65066 0,299680166576808
50447619 BDB-kin50447638.mol2, BDB-kin50447638.pdbqt 364,46 154,25 -7,288 521,507 2,5772 10 2 1 -0,88945 0,242789478299734
50447620 BDB-kin50447639.mol2, BDB-kin50447639.pdbqt 318,2 141,36 -6,673 458,448 2,2258 9 2 0 -0,82758 0,297234965685911
50447621 BDB-kin50447640.mol2, BDB-kin50447640.pdbqt 306,55 108,31 -4,224 397,477 2,5715 8 2 0 0,56836 0,587271671741458
50447622 BDB-kin50447641.mol2, BDB-kin50447641.pdbqt 306,55 108,31 -4,532 397,477 2,4805 8 2 0 0,059455 0,522233512355299
50447623 BDB-kin50447642.mol2, BDB-kin50447642.pdbqt 362,36 135,89 -5,906 515,54 2,1785 9 2 1 1,5846 0,416129487983263
50447624 BDB-kin50447643.mol2, BDB-kin50447643.pdbqt 389,38 145,12 -5,913 557,577 1,8046 10 2 1 -0,69607 0,28020816396856
50447625 BDB-kin50447644.mol2, BDB-kin50447644.pdbqt 398,23 156,12 -6,403 571,603 2,1165 10 3 1 2,3882 0,362204826009685
These data are only available for scientific research purposes.