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Records 4181 to 4200 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50433048 BDB-kin50439522.mol2, BDB-kin50439522.pdbqt 275,56 130,25 -3,779 370,412 -0,037 9 3 0 4,3927 0,641068165377488
50433049 BDB-kin50439523.mol2, BDB-kin50439523.pdbqt 307,01 136,58 -4,491 412,449 0,8057 10 2 0 2,3567 0,537147091054157
50433050 BDB-kin50439524.mol2, BDB-kin50439524.pdbqt 314,6 123,69 -5,268 429,451 1,4507 9 2 0 1,0167 0,416676506921006
50433051 BDB-kin50439525.mol2, BDB-kin50439525.pdbqt 320,59 114,46 -5,912 431,495 2,3854 8 2 0 2,2794 0,401646413606199
50433052 BDB-kin50439526.mol2, BDB-kin50439526.pdbqt 287,45 119,39 -3,973 384,439 0,1317 9 2 0 5,179 0,620976158776558
50433536 BDB-kin50439527.mol2, BDB-kin50439527.pdbqt 316,83 119,12 -3,672 422,512 2,0895 8 1 0 5,5851 0,448411782806588
50434806 BDB-kin50439528.mol2, BDB-kin50439528.pdbqt 349,68 118,67 -3,942 460,54 1,7834 10 1 0 2,6267 0,667138128180251
50436459 BDB-kin50442673.mol2, BDB-kin50442673.pdbqt 309,19 129,45 -5,727 441,477 3,8412 7 2 0 -0,75604 0,192797853742434
50439511 BDB-kin50447249.mol2, BDB-kin50447249.pdbqt 304,89 97,2 -5,303 395,465 1,9388 9 2 0 4,0375 0,613823104587823
50439512 BDB-kin50447250.mol2, BDB-kin50447250.pdbqt 346,17 117,43 -4,956 453,545 2,1042 10 3 0 3,0495 0,58815706940185
50439513 BDB-kin50447251.mol2, BDB-kin50447251.pdbqt 367,78 137,66 -4,454 483,571 1,4335 11 4 1 2,2688 0,594582987273298
50439514 BDB-kin50447252.mol2, BDB-kin50447252.pdbqt 296,13 148,33 -2,598 400,442 -0,6012 11 3 1 0,78119 0,712767679747956
50439515 BDB-kin50447253.mol2, BDB-kin50447253.pdbqt 291,63 97,2 -4,941 393,45 1,1147 9 2 0 6,6149 0,6676598867771
50439516 BDB-kin50447618.mol2, BDB-kin50447618.pdbqt 330,91 97,2 -5,385 423,519 2,2775 9 2 0 4,4697 0,464276525653003
50439517 BDB-kin50447619.mol2, BDB-kin50447619.pdbqt 318,65 97,2 -5,017 409,492 1,8796 9 2 0 4,987 0,510022970871773
50439518 BDB-kin50447620.mol2, BDB-kin50447620.pdbqt 304,89 97,2 -4,747 395,465 1,4252 9 2 0 5,2929 0,683558385958487
50439519 BDB-kin50447621.mol2, BDB-kin50447621.pdbqt 319,89 84,31 -4,937 408,504 2,6726 8 2 0 3,1762 0,496743158091706
50439520 BDB-kin50447622.mol2, BDB-kin50447622.pdbqt 306,13 84,31 -4,667 394,477 2,2182 8 2 0 3,5219 0,673904947596971
50439521 BDB-kin50447623.mol2, BDB-kin50447623.pdbqt 307,65 97,2 -5,195 395,465 1,9561 9 2 0 1,5462 9,93826898321215E-02
50439522 BDB-kin50447624.mol2, BDB-kin50447624.pdbqt 318,65 97,2 -5,573 409,492 2,3932 9 2 0 3,7042 9,79986408153121E-02
These data are only available for scientific research purposes.