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Records 1541 to 1560 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
172271 BDB-kin174387.mol2, BDB-kin174387.pdbqt 293,98 94,32 -4,902 377,467 2,9729 5 1 0 -3,5847 0,334186033970928
172272 BDB-kin174389.mol2, BDB-kin174389.pdbqt 323,79 80,9 -5,385 404,9 4,4313 5 2 0 -2,5688 0,270908565962657
172273 BDB-kin174390.mol2, BDB-kin174390.pdbqt 307,74 94,32 -5,061 391,494 3,3885 5 1 0 -3,7588 0,310851200036073
172274 BDB-kin174393.mol2, BDB-kin174393.pdbqt 323,79 80,9 -5,385 404,9 4,4313 5 2 0 -2,5688 0,270908565962657
172275 BDB-kin174394.mol2, BDB-kin174394.pdbqt 259,49 51,8 -4,799 317,366 4,0717 3 1 0 -6,9489 0,316220918842615
172276 BDB-kin174395.mol2, BDB-kin174395.pdbqt 381,16 75,35 -4,836 483,589 4,7448 6 1 0 -3,0702 0,243591572884204
172277 BDB-kin174397.mol2, BDB-kin174397.pdbqt 367,4 75,35 -4,566 469,562 4,4028 6 1 0 0,01 0,394744735671943
172278 BDB-kin174399.mol2, BDB-kin174399.pdbqt 412,66 84,58 -4,479 515,631 4,43 7 1 1 -0,98604 0,308040003113847
172279 BDB-kin174407.mol2, BDB-kin174407.pdbqt 388,9 75,35 -4,858 485,605 4,9634 6 1 0 -0,40702 0,312784529290388
172280 BDB-kin174413.mol2, BDB-kin174413.pdbqt 377,9 75,35 -4,48 471,578 4,6041 6 1 0 1,6633 0,379096238892408
172281 BDB-kin174414.mol2, BDB-kin174414.pdbqt 374,31 75,35 -4,289 471,578 4,4958 6 1 0 1,0933 0,469747792581674
172282 BDB-kin174415.mol2, BDB-kin174415.pdbqt 364,14 75,35 -4,18 457,551 4,1978 6 1 0 2,1373 0,550943971104848
172283 BDB-kin174416.mol2, BDB-kin174416.pdbqt 350,88 75,35 -4,374 455,535 3,8873 6 1 0 0,29192 0,463793267669614
172284 BDB-kin174417.mol2, BDB-kin174417.pdbqt 404,73 75,35 -6,533 535,596 5,4833 6 1 2 -1,5814 0,166006552932573
172285 BDB-kin174418.mol2, BDB-kin174418.pdbqt 364,84 81,34 -4,424 446,524 4,1566 6 1 0 -0,41758 0,402775776810328
172286 BDB-kin174419.mol2, BDB-kin174419.pdbqt 365,4 75,35 -4,17 457,551 4,271 6 1 0 3,0471 0,563816827791962
172287 BDB-kin174420.mol2, BDB-kin174420.pdbqt 379,16 75,35 -4,47 471,578 4,6773 6 1 0 3,0809 0,498713268413528
172288 BDB-kin174421.mol2, BDB-kin174421.pdbqt 400,33 75,35 -4,957 499,632 5,4172 6 1 1 0,58799 0,32534909923311
172289 BDB-kin174422.mol2, BDB-kin174422.pdbqt 402,92 84,58 -4,091 501,604 4,1785 7 1 1 2,105 0,513000293943087
172290 BDB-kin174423.mol2, BDB-kin174423.pdbqt 377,4 84,58 -3,947 485,561 3,5808 7 1 0 1,1433 0,533099992643821
These data are only available for scientific research purposes.