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Records 1021 to 1040 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
125488 BDB-kin127480.mol2, BDB-kin127480.pdbqt 266,45 122,73 -4,305 355,376 1,798 8 3 0 -3,3261 0,234666930566981
125489 BDB-kin127481.mol2, BDB-kin127481.pdbqt 282,36 131,96 -4,009 367,412 1,6272 9 3 0 -1,7916 0,266869938232233
125490 BDB-kin127482.mol2, BDB-kin127482.pdbqt 294,62 131,96 -4,878 381,439 2,3225 9 3 0 -1,7916 0,229271302509539
125491 BDB-kin127483.mol2, BDB-kin127483.pdbqt 300,94 165,25 -4,408 415,477 0,6992 10 3 0 -1,1335 0,264038054161765
125492 BDB-kin127484.mol2, BDB-kin127484.pdbqt 348,44 165,25 -5,527 477,548 2,4024 10 3 0 -10,091 0,155570528890934
125493 BDB-kin127485.mol2, BDB-kin127485.pdbqt 400,66 138,52 -4,339 524,603 2,3226 12 2 2 3,5832 0,339075867204421
125494 BDB-kin127487.mol2, BDB-kin127487.pdbqt 406,86 138,52 -4,701 564,546 2,4476 12 2 2 -0,98016 0,190549483765858
125495 BDB-kin127488.mol2, BDB-kin127488.pdbqt 390,16 138,52 -4,425 522,587 2,0867 12 2 2 5,0548 0,342251336677047
125496 BDB-kin127489.mol2, BDB-kin127489.pdbqt 378,58 173,62 -3,936 514,613 1,0898 13 2 2 5,569 0,376384928378256
125497 BDB-kin127490.mol2, BDB-kin127490.pdbqt 372,98 151,5 -4,355 518,044 2,056 11 2 2 5,3365 0,349358567051896
125498 BDB-kin127491.mol2, BDB-kin127491.pdbqt 375,17 160,73 -4,642 517,588 1,4481 12 2 2 3,9536 0,336891447293533
125499 BDB-kin127492.mol2, BDB-kin127492.pdbqt 265,02 137,75 -4,215 358,792 1,3774 9 3 0 -0,80603 0,301461605174861
125500 BDB-kin127493.mol2, BDB-kin127493.pdbqt 373,14 169,52 -4,86 520,016 1,052 12 3 2 3,892 0,325180345976702
125501 BDB-kin127494.mol2, BDB-kin127494.pdbqt 395,7 172,76 -3,893 549,058 0,9097 13 3 2 3,289 0,347225055179987
125502 BDB-kin127495.mol2, BDB-kin127495.pdbqt 373,14 169,52 -4,86 520,016 1,052 12 3 2 3,892 0,325180345976702
125503 BDB-kin127496.mol2, BDB-kin127496.pdbqt 373,14 169,52 -4,86 520,016 1,052 12 3 2 3,892 0,325180345976702
125504 BDB-kin127497.mol2, BDB-kin127497.pdbqt 395,7 172,76 -3,893 549,058 0,9097 13 3 2 3,289 0,347225055179987
125505 BDB-kin127498.mol2, BDB-kin127498.pdbqt 395,7 172,76 -3,893 549,058 0,9097 13 3 2 3,289 0,347225055179987
125506 BDB-kin127499.mol2, BDB-kin127499.pdbqt 310,34 147,4 -3,751 434,911 1,2439 10 3 0 1,7352 0,684958318976879
125507 BDB-kin128471.mol2, BDB-kin128471.pdbqt 343,16 175,51 -5,016 460,518 0,7054 12 3 1 -3,351 0,186225708636514
These data are only available for scientific research purposes.