Page 
 of 213
Records 2421 to 2440 of 4258
 
Download
Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
222639 BDB-kin245489.mol2, BDB-kin245489.pdbqt 347,69 131,7 -5,834 466,472 2,0193 10 3 0 0,96761 0,438313465267363
222640 BDB-kin245490.mol2, BDB-kin245490.pdbqt 381,43 173,22 -6,973 553,038 2,9466 10 3 1 2,0296 0,335443156178242
222641 BDB-kin245491.mol2, BDB-kin245491.pdbqt 431,81 137,61 -6,038 581,696 2,6345 12 2 2 1,3811 0,124422622430287
222642 BDB-kin245492.mol2, BDB-kin245492.pdbqt 408,42 118,15 -5,441 532,599 2,9118 11 2 2 1,8373 0,429621697210152
222643 BDB-kin245493.mol2, BDB-kin245493.pdbqt 369,67 131,13 -6,148 497,574 2,2395 10 2 0 2,0654 0,428148347486061
222644 BDB-kin245494.mol2, BDB-kin245494.pdbqt 356,54 117,71 -5,773 462,508 2,5349 10 3 0 2,3793 0,487495338938165
222645 BDB-kin245495.mol2, BDB-kin245495.pdbqt 420,38 120,95 -5,129 533,631 2,4242 11 3 2 5,5266 0,494743097876
222646 BDB-kin245496.mol2, BDB-kin245496.pdbqt 454,89 128,23 -6,59 610,181 4,2882 10 2 1 5,731 0,295146738219552
222647 BDB-kin245497.mol2, BDB-kin245497.pdbqt 381,08 117,57 -7,244 498,609 4,1277 8 2 0 1,9423 0,329326942024484
222648 BDB-kin245498.mol2, BDB-kin245498.pdbqt 369,06 130,6 -5,803 477,523 2,2917 11 3 1 0,9587 0,428073559755906
222649 BDB-kin245499.mol2, BDB-kin245499.pdbqt 422,83 156,9 -6,268 549,586 2,665 13 3 2 -1,3906 0,236892109047379
222650 BDB-kin245500.mol2, BDB-kin245500.pdbqt 327,59 101,5 -4,936 420,472 2,2366 9 2 0 0,36239 0,503328025437907
222651 BDB-kin245501.mol2, BDB-kin245501.pdbqt 367,37 143,16 -6,518 498,562 1,8799 11 3 1 2,4375 0,15006621010232
222652 BDB-kin245502.mol2, BDB-kin245502.pdbqt 419,25 143,6 -4,937 568,653 2,2803 12 2 2 3,1753 0,469598279212077
222653 BDB-kin245503.mol2, BDB-kin245503.pdbqt 379,84 130,46 -6,449 499,597 3,1268 9 2 0 1,9423 0,390785929136524
222654 BDB-kin245504.mol2, BDB-kin245504.pdbqt 471,76 130,62 -4,631 617,705 2,1743 13 2 2 4,0985 0,458629769259973
222655 BDB-kin245505.mol2, BDB-kin245505.pdbqt 458 130,62 -5,006 603,678 1,6028 13 2 2 3,8907 0,160738957621149
222656 BDB-kin245506.mol2, BDB-kin245506.pdbqt 418,44 144,17 -5,01 547,614 1,5873 12 3 2 3,1636 0,491200754494251
222657 BDB-kin245507.mol2, BDB-kin245507.pdbqt 446,91 147,11 -7,329 597,698 3,2305 11 2 2 3,1591 0,110045999286072
222658 BDB-kin245508.mol2, BDB-kin245508.pdbqt 402,15 134,22 -5,971 534,639 3,0527 10 2 1 3,3766 0,410660836837364
These data are only available for scientific research purposes.