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Records 3741 to 3760 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50361643 BDB-kin50362908.mol2, BDB-kin50362908.pdbqt 372,05 131,92 -4,892 502,552 1,9824 10 2 1 3,2751 0,546271883187056
50361644 BDB-kin50362909.mol2, BDB-kin50362909.pdbqt 365,7 131,92 -4,578 484,562 1,8816 10 2 0 4,6151 0,603899212910151
50361648 BDB-kin50362910.mol2, BDB-kin50362910.pdbqt 345,5 111,61 -6,136 459,527 3,2085 8 2 0 -1,6164 0,272311634990806
50361649 BDB-kin50362911.mol2, BDB-kin50362911.pdbqt 341,74 120,84 -5,247 461,5 2,0445 9 2 0 -0,85464 0,367412747941664
50361650 BDB-kin50362912.mol2, BDB-kin50362912.pdbqt 341,74 120,84 -5,108 461,5 1,8163 9 2 0 1,2114 0,515546364640766
50361651 BDB-kin50362913.mol2, BDB-kin50362913.pdbqt 343,2 123,64 -5,111 460,516 1,901 9 3 0 1,7681 0,539643862891159
50361652 BDB-kin50362914.mol2, BDB-kin50362914.pdbqt 343,2 123,64 -4,972 460,516 1,6728 9 3 0 2,0039 0,562843022340228
50362403 BDB-kin50362915.mol2, BDB-kin50362915.pdbqt 265,74 80,99 -1,327 357,804 2,3232 8 1 0 3,8995 0,314514347812909
50362404 BDB-kin50362916.mol2, BDB-kin50362916.pdbqt 257,47 89,19 -2,588 338,37 1,8018 8 1 0 1,6432 0,104924884852169
50362405 BDB-kin50362917.mol2, BDB-kin50362917.pdbqt 257,16 120,76 -2,227 339,362 0,2765 10 1 0 1,6158 0,107560895934621
50362406 BDB-kin50362918.mol2, BDB-kin50362918.pdbqt 289,05 84,75 -3,568 375,435 2,6025 8 1 0 1,9586 9,56447194062209E-02
50362407 BDB-kin50362919.mol2, BDB-kin50362919.pdbqt 318,51 84,75 -2,741 443,432 3,2155 8 1 0 -7,5922 7,94689085981558E-02
50362408 BDB-kin50362920.mol2, BDB-kin50362920.pdbqt 287,55 84,75 -3,753 375,435 2,5308 8 1 0 1,8287 9,35525292837065E-02
50362902 BDB-kin50362921.mol2, BDB-kin50362921.pdbqt 258,68 87,58 -4,817 348,361 2,3632 7 2 0 2,8512 0,675925907724039
50362903 BDB-kin50362922.mol2, BDB-kin50362922.pdbqt 281,2 108,92 -5,604 377,407 1,3601 9 2 0 1,4117 0,546325160592325
50362904 BDB-kin50362923.mol2, BDB-kin50362923.pdbqt 258,68 87,58 -4,817 348,361 2,3632 7 2 0 2,8512 0,675925907724039
50362905 BDB-kin50362924.mol2, BDB-kin50362924.pdbqt 258,68 87,58 -4,817 348,361 2,3632 7 2 0 2,8512 0,675925907724039
50362906 BDB-kin50362925.mol2, BDB-kin50362925.pdbqt 242,77 98,58 -4,503 334,334 2,0875 7 3 0 2,8471 0,722043479865292
50362907 BDB-kin50362926.mol2, BDB-kin50362926.pdbqt 236,42 78,35 -4,799 318,335 2,4332 6 2 0 2,8471 0,690003684323152
50362908 BDB-kin50362927.mol2, BDB-kin50362927.pdbqt 244,46 78,35 -5,102 324,383 2,7655 6 2 0 -1,4518 0,394748275481022
These data are only available for scientific research purposes.