Page 
 of 213
Records 3401 to 3420 of 4258
 
Download
Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50327420 BDB-kin50327896.mol2, BDB-kin50327896.pdbqt 364,91 104,74 -6,752 487,562 3,1903 10 2 0 1,5217 4,83846319630099E-02
50327421 BDB-kin50327897.mol2, BDB-kin50327897.pdbqt 371,26 104,74 -7,066 505,552 3,2911 10 2 1 0,18172 3,81431579898372E-02
50327422 BDB-kin50327898.mol2, BDB-kin50327898.pdbqt 377,17 104,74 -7,096 501,589 3,5342 10 2 1 1,4848 4,42101330409273E-02
50327423 BDB-kin50327899.mol2, BDB-kin50327899.pdbqt 386,62 128,53 -7,525 512,572 3,0259 11 2 2 -2,7583 2,53191833398175E-02
50327424 BDB-kin50327900.mol2, BDB-kin50327900.pdbqt 409,43 123,2 -6,788 547,614 3,0503 12 2 2 1,575 4,32191322618948E-02
50327425 BDB-kin50327901.mol2, BDB-kin50327901.pdbqt 385,02 124,97 -6,636 517,588 2,593 11 3 2 1,4683 4,73935807391809E-02
50327426 BDB-kin50327902.mol2, BDB-kin50327902.pdbqt 398,78 124,97 -6,748 531,615 3,0231 11 3 2 -0,34167 3,47750626565771E-02
50327427 BDB-kin50327903.mol2, BDB-kin50327903.pdbqt 399,73 107,98 -6,788 530,631 3,0867 11 2 2 2,2714 4,65585081903453E-02
50327428 BDB-kin50327904.mol2, BDB-kin50327904.pdbqt 439,31 111,22 -6,357 585,711 2,9687 12 2 2 5,6368 4,63717537620913E-02
50327429 BDB-kin50327905.mol2, BDB-kin50327905.pdbqt 437,25 117,21 -6,193 574,684 2,8201 12 2 2 4,698 4,86790484768116E-02
50327430 BDB-kin50327906.mol2, BDB-kin50327906.pdbqt 453,07 111,22 -5,835 599,738 2,8916 12 2 2 6,4288 4,91418451028419E-02
50327431 BDB-kin50327907.mol2, BDB-kin50327907.pdbqt 363,67 117,63 -5,957 488,55 2,1894 11 2 1 1,5217 5,61740044373905E-02
50327432 BDB-kin50328085.mol2, BDB-kin50328085.pdbqt 379,09 117,63 -6,456 522,995 2,8928 11 2 2 1,5744 4,76842745806562E-02
50327433 BDB-kin50328584.mol2, BDB-kin50328584.pdbqt 422,19 130,52 -6,94 565,636 2,9387 12 2 2 1,5217 4,11241041948869E-02
50327434 BDB-kin50328585.mol2, BDB-kin50328585.pdbqt 362,43 130,52 -5,748 489,538 1,6271 12 2 1 1,5217 5,86915350322838E-02
50327435 BDB-kin50328586.mol2, BDB-kin50328586.pdbqt 362,43 130,52 -5,506 489,538 1,3605 12 2 1 1,5217 6,13640741984784E-02
50327436 BDB-kin50328587.mol2, BDB-kin50328587.pdbqt 368,76 137,86 -5,558 504,549 1,3373 12 3 2 3,3231 6,37378915446784E-02
50327894 BDB-kin50328588.mol2, BDB-kin50328588.pdbqt 248,62 94,23 -4,007 325,371 1,485 7 1 0 1,8664 0,751705889974687
50327895 BDB-kin50328589.mol2, BDB-kin50328589.pdbqt 258,62 103,46 -4,182 341,37 1,3685 8 1 0 1,8664 0,729405071423701
50327896 BDB-kin50328590.mol2, BDB-kin50328590.pdbqt 214,19 113,15 -2,869 285,31 -0,4193 8 2 0 4,355 0,905681759782928
These data are only available for scientific research purposes.