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Records 1521 to 1540 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
172251 BDB-kin174367.mol2, BDB-kin174367.pdbqt 377,9 75,35 -4,313 471,578 4,0749 6 1 0 2,251 0,539042556227058
172252 BDB-kin174368.mol2, BDB-kin174368.pdbqt 347,75 85 -4,563 425,534 3,8871 6 1 0 -6,2106 0,301657878965126
172253 BDB-kin174369.mol2, BDB-kin174369.pdbqt 319,23 94,23 -3,056 399,453 2,3004 7 1 0 -1,0334 0,507068003576203
172254 BDB-kin174370.mol2, BDB-kin174370.pdbqt 318,63 103,02 -3,272 387,442 1,9724 7 2 0 -3,6832 0,415087108773069
172255 BDB-kin174371.mol2, BDB-kin174371.pdbqt 331,79 88,24 -2,558 412,496 2,4098 7 1 0 4,6071 0,802431268810111
172256 BDB-kin174372.mol2, BDB-kin174372.pdbqt 329,73 94,23 -2,91 401,469 2,2389 7 1 0 0,83201 0,686608733616294
172257 BDB-kin174373.mol2, BDB-kin174373.pdbqt 356,05 88,24 -2,682 428,538 2,4856 7 1 0 2,86 0,761308661997684
172258 BDB-kin174374.mol2, BDB-kin174374.pdbqt 322,99 85 -3,945 397,481 3,4644 6 1 0 -2,1653 0,388209092206056
172259 BDB-kin174375.mol2, BDB-kin174375.pdbqt 380,66 75,35 -4,372 471,578 4,7338 6 1 0 2,8239 0,498080702467083
172260 BDB-kin174376.mol2, BDB-kin174376.pdbqt 381,16 75,35 -4,618 483,589 4,5975 6 1 0 3,5657 0,486946559997127
172261 BDB-kin174377.mol2, BDB-kin174377.pdbqt 339,98 90,13 -4,516 418,471 3,4357 6 2 0 -5,1935 0,3209254428796
172262 BDB-kin174378.mol2, BDB-kin174378.pdbqt 354,34 81,34 -4,57 444,509 4,1057 6 1 0 -5,1677 0,28657928516374
172263 BDB-kin174379.mol2, BDB-kin174379.pdbqt 366,9 75,35 -4,072 457,551 4,2151 6 1 0 1,2829 0,524220918564609
172264 BDB-kin174380.mol2, BDB-kin174380.pdbqt 365,34 81,34 -4,918 458,535 4,5035 6 1 0 -1,5909 0,292245788986247
172265 BDB-kin174381.mol2, BDB-kin174381.pdbqt 359,6 92,34 -4,899 458,535 4,3736 6 2 0 0,16658 0,393656811137585
172266 BDB-kin174382.mol2, BDB-kin174382.pdbqt 349,43 92,34 -4,79 444,509 4,0756 6 2 0 -1,2883 0,336204673465233
172267 BDB-kin174383.mol2, BDB-kin174383.pdbqt 377,9 75,35 -4,48 471,578 4,6387 6 1 0 1,8033 0,47597099393985
172268 BDB-kin174384.mol2, BDB-kin174384.pdbqt 390,66 84,58 -3,723 487,577 3,7806 7 1 0 2,105 0,573769250097825
172269 BDB-kin174385.mol2, BDB-kin174385.pdbqt 407,21 95,66 -3,207 514,603 3,2233 8 1 1 3,6452 0,61928682268506
172270 BDB-kin174386.mol2, BDB-kin174386.pdbqt 310,03 80,9 -5,226 390,873 4,0157 5 2 0 -2,3323 0,303357112973135
These data are only available for scientific research purposes.