Page 
 of 213
Records 2821 to 2840 of 4258
 
Download
Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50092771 BDB-kin50092790.mol2, BDB-kin50092790.pdbqt 312,91 100,47 -4,031 411,504 1,4363 8 2 0 2,0398 0,698648593474814
50092772 BDB-kin50092791.mol2, BDB-kin50092791.pdbqt 283,24 111,47 -3,851 383,45 0,8137 8 3 0 1,1667 0,693233276514984
50092773 BDB-kin50092792.mol2, BDB-kin50092792.pdbqt 288,15 100,47 -3,413 383,45 0,6965 8 2 0 -0,80252 0,536225006667154
50092774 BDB-kin50092793.mol2, BDB-kin50092793.pdbqt 291,91 91,24 -4,302 381,478 1,8605 7 2 0 -2,1367 0,407535862624752
50092775 BDB-kin50093068.mol2, BDB-kin50093068.pdbqt 312,91 100,47 -4,031 411,504 1,4363 8 2 0 2,1618 0,703042092659289
50092776 BDB-kin50093069.mol2, BDB-kin50093069.pdbqt 274,39 100,47 -3,361 369,424 0,5018 8 2 0 -1,2048 0,513643371858399
50092777 BDB-kin50093070.mol2, BDB-kin50093070.pdbqt 274,39 100,47 -3,361 369,424 0,5018 8 2 0 -1,9048 0,471464003914151
50092778 BDB-kin50093071.mol2, BDB-kin50093071.pdbqt 260,13 100,47 -2,597 343,386 0,0176 8 2 0 2,2833 0,850734138015517
50092779 BDB-kin50093072.mol2, BDB-kin50093072.pdbqt 260,13 100,47 -2,597 343,386 0,0176 8 2 0 2,15 0,845464367527357
50092780 BDB-kin50093073.mol2, BDB-kin50093073.pdbqt 307,48 121,81 -4,077 406,449 0,3249 10 2 0 1,788 0,695365062481477
50092781 BDB-kin50093074.mol2, BDB-kin50093074.pdbqt 319,74 121,81 -4,445 420,476 0,7228 10 2 0 1,7543 0,647600162478928
50092782 BDB-kin50093075.mol2, BDB-kin50093075.pdbqt 319,74 121,81 -4,445 420,476 0,7228 10 2 0 1,6279 0,641792690298362
50092783 BDB-kin50093076.mol2, BDB-kin50093076.pdbqt 299,15 100,47 -3,979 397,477 1,2416 8 2 0 0,98318 0,65716341208515
50092784 BDB-kin50093077.mol2, BDB-kin50093077.pdbqt 308,72 108,92 -5,18 405,461 1,2348 9 2 0 1,6599 0,465065762352579
50092785 BDB-kin50093078.mol2, BDB-kin50093078.pdbqt 320,98 108,92 -5,524 419,488 1,5787 9 2 0 1,7543 0,431306147481371
50092786 BDB-kin50093079.mol2, BDB-kin50093079.pdbqt 320,98 108,92 -5,524 419,488 1,5787 9 2 0 1,6279 0,42743833119915
50092787 BDB-kin50093080.mol2, BDB-kin50093080.pdbqt 301,91 100,47 -3,683 397,477 1,1509 8 2 0 -0,94324 0,502464562639062
50092788 BDB-kin50093081.mol2, BDB-kin50093081.pdbqt 301,91 100,47 -3,683 397,477 1,1509 8 2 0 -0,81675 0,512750402410296
50092789 BDB-kin50093082.mol2, BDB-kin50093082.pdbqt 288,15 100,47 -4,377 383,45 1,7306 8 2 0 -1,2626 0,445548065394557
50092790 BDB-kin50094473.mol2, BDB-kin50094473.pdbqt 286,04 83,14 -4,61 377,447 1,8613 7 2 0 0,32377 0,559839179801421
These data are only available for scientific research purposes.