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Records 1661 to 1680 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
174364 BDB-kin174533.mol2, BDB-kin174533.pdbqt 349,19 72,84 -6,409 467,543 3,5093 8 0 0 1,3117 0,387531914749214
174365 BDB-kin174534.mol2, BDB-kin174534.pdbqt 342,84 72,84 -6,095 449,553 3,4085 8 0 0 2,6517 0,455845739048147
174366 BDB-kin174535.mol2, BDB-kin174535.pdbqt 319,34 76,5 -5,282 420,515 2,4776 8 0 0 2,5992 0,572184535422457
174367 BDB-kin174536.mol2, BDB-kin174536.pdbqt 310,27 76,75 -5,735 409,488 2,6132 8 0 0 2,6676 0,536179482387556
174368 BDB-kin174537.mol2, BDB-kin174537.pdbqt 326,93 83,84 -5,781 435,526 3,1328 8 1 0 2,6109 0,49863754380926
174369 BDB-kin174538.mol2, BDB-kin174538.pdbqt 344,75 79,4 -6,602 458,564 3,5179 8 1 0 2,8435 0,417808685649445
174370 BDB-kin174539.mol2, BDB-kin174539.pdbqt 344,25 109,43 -6,537 464,524 2,2161 10 0 0 -2,445 0,247531259559554
174371 BDB-kin174540.mol2, BDB-kin174540.pdbqt 342,84 72,84 -6,095 449,553 3,4085 8 0 0 2,6517 0,455845739048147
174372 BDB-kin174541.mol2, BDB-kin174541.pdbqt 340,03 121,14 -5,416 465,508 1,9524 10 2 0 1,4232 0,493909463343278
174373 BDB-kin174542.mol2, BDB-kin174542.pdbqt 349,05 101,94 -5,905 476,535 2,0161 10 1 0 2,5638 0,475716641135195
174374 BDB-kin174543.mol2, BDB-kin174543.pdbqt 353,55 96,63 -6,49 460,536 2,9194 9 0 0 -2,8054 0,238795916326927
174375 BDB-kin174544.mol2, BDB-kin174544.pdbqt 371,87 115,93 -6,106 492,578 2,5774 10 1 0 0,56202 0,373072088857116
174376 BDB-kin174545.mol2, BDB-kin174545.pdbqt 367,31 96,63 -6,79 474,563 3,3257 9 0 0 -4,2449 0,210307216141571
174377 BDB-kin174546.mol2, BDB-kin174546.pdbqt 332,51 92,29 -5,773 445,525 2,3643 9 1 0 3,4617 0,519106596366321
174378 BDB-kin174547.mol2, BDB-kin174547.pdbqt 350,05 105,07 -6,718 473,535 2,4351 10 1 0 5,1193 0,437182097688159
174379 BDB-kin174548.mol2, BDB-kin174548.pdbqt 378,31 96,63 -7,168 488,59 3,685 9 0 0 -3,2703 0,196002952919257
174380 BDB-kin174549.mol2, BDB-kin174549.pdbqt 336,04 104,07 -5,287 451,525 2,2108 9 2 0 1,3514 0,510788451830739
174381 BDB-kin174550.mol2, BDB-kin174550.pdbqt 339,05 92,71 -6,09 460,536 2,2631 9 1 0 2,5483 0,47255831570545
174382 BDB-kin174551.mol2, BDB-kin174551.pdbqt 357,4 92,71 -6,018 480,542 2,6934 9 1 0 1,5302 0,428717022610851
174383 BDB-kin174552.mol2, BDB-kin174552.pdbqt 382,87 115,93 -6,484 506,605 2,9367 10 1 1 1,5849 0,37854456185343
These data are only available for scientific research purposes.