Page 
 of 213
Records 2461 to 2480 of 4258
 
Download
Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
227485 BDB-kin245530.mol2, BDB-kin245530.pdbqt 343,43 115,42 -5,98 463,54 1,7723 10 3 0 1,824 0,466974959763841
227486 BDB-kin245531.mol2, BDB-kin245531.pdbqt 297,91 92,29 -4,468 395,465 1,4203 9 1 0 1,7785 0,663077378565129
227487 BDB-kin245534.mol2, BDB-kin245534.pdbqt 297,91 92,29 -4,468 395,465 1,4203 9 1 0 1,7785 0,663077378565129
227488 BDB-kin245535.mol2, BDB-kin245535.pdbqt 275,91 92,29 -3,712 367,412 0,7709 9 1 0 1,6868 0,747268285140596
227489 BDB-kin245536.mol2, BDB-kin245536.pdbqt 287,48 108,08 -3,836 384,443 0,3148 10 2 0 3,096 0,772249447219298
227490 BDB-kin245537.mol2, BDB-kin245537.pdbqt 287,48 108,08 -3,836 384,443 0,3148 10 2 0 3,096 0,772249447219298
227491 BDB-kin245538.mol2, BDB-kin245538.pdbqt 350,84 95,19 -6,636 461,568 3,2784 9 2 0 0,63652 0,358496242978592
227492 BDB-kin245539.mol2, BDB-kin245539.pdbqt 332,67 106,19 -7,05 459,552 2,713 9 3 0 1,8394 0,400638683863251
227493 BDB-kin245540.mol2, BDB-kin245540.pdbqt 332,67 106,19 -7,05 459,552 2,713 9 3 0 1,8394 0,400638683863251
227494 BDB-kin245541.mol2, BDB-kin245541.pdbqt 337,08 95,19 -6,366 447,541 2,824 9 2 0 2,5067 0,363159284137469
227495 BDB-kin245542.mol2, BDB-kin245542.pdbqt 324,88 89,2 -5,22 432,53 2,1543 9 2 0 6,4022 0,59406569053272
227496 BDB-kin245543.mol2, BDB-kin245543.pdbqt 336,75 95,19 -6,411 459,552 2,6945 9 2 0 -2,7971 0,24436791129855
227497 BDB-kin245544.mol2, BDB-kin245544.pdbqt 349,14 98,43 -5,365 474,567 1,862 10 2 0 4,3061 0,540180132901882
227498 BDB-kin245546.mol2, BDB-kin245546.pdbqt 323,82 95,19 -6,124 445,525 2,2903 9 2 0 2,9867 0,488004240296332
227499 BDB-kin24654.mol2, BDB-kin24654.pdbqt 337,58 95,19 -6,394 459,552 2,6323 9 2 0 3,4655 0,457385126025549
227500 BDB-kin24656.mol2, BDB-kin24656.pdbqt 348,08 95,19 -6,526 461,568 3,0423 9 2 0 1,932 0,417732426867034
227501 BDB-kin24773.mol2, BDB-kin24773.pdbqt 344,28 85,96 -7,507 485,512 3,9625 8 2 0 -3,1964 0,187407239498464
227502 BDB-kin25013.mol2, BDB-kin25013.pdbqt 334,32 95,19 -6,474 447,541 2,6943 9 2 0 3,0322 0,457096906019541
227503 BDB-kin25018.mol2, BDB-kin25018.pdbqt 336,75 95,19 -6,561 459,552 2,7164 9 2 0 0,7868 0,382150505364278
227504 BDB-kin25028.mol2, BDB-kin25028.pdbqt 331,17 115,42 -5,589 449,513 1,4429 10 3 0 2,5917 0,53174665885353
These data are only available for scientific research purposes.