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Records 124461 to 124480 of 125298
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50445139 50445139.mol2, BDB-kin50445139.pdbqt 230,33 109,06 -1,335 299,337 -0,942 8 3 0 3,6418 0,933436407492217
50445140 50445140.mol2, BDB-kin50445140.pdbqt 232,63 97,03 -2,36 298,349 0,3655 7 2 0 1,5665 0,843072378275589
50445141 50445141.mol2, BDB-kin50445141.pdbqt 271,28 141,48 -4,025 360,441 1,6963 8 3 0 3,8553 0,772781616512698
50445142 50445142.mol2, BDB-kin50445142.pdbqt 270,04 154,37 -4,087 361,429 1,5035 9 3 0 3,8553 0,768879720275161
50445143 50445143.mol2, BDB-kin50445143.pdbqt 261,52 128,35 -3,74 346,414 1,8113 8 2 0 3,8759 0,804061284077424
50445144 50445144.mol2, BDB-kin50445144.pdbqt 262,76 115,46 -3,424 345,426 2,0222 7 2 0 3,8759 0,823369766441599
50445145 50445145.mol2, BDB-kin50445145.pdbqt 262,76 115,46 -3,424 345,426 2,0222 7 2 0 3,8759 0,823369766441599
50445146 50445146.mol2, BDB-kin50445146.pdbqt 216,16 61,02 -2,219 270,335 1,6898 5 2 0 2,8668 0,90033262053386
50445147 50445147.mol2, BDB-kin50445147.pdbqt 235,11 71,25 -3,95 296,373 2,3673 5 2 0 1,5665 0,737848402973249
50445148 50445148.mol2, BDB-kin50445148.pdbqt 232,94 65,46 -3,053 297,357 2,3475 5 2 0 1,5945 0,796660034896178
50445149 50445149.mol2, BDB-kin50445149.pdbqt 235,11 71,25 -3,425 296,373 2,0159 5 2 0 1,5665 0,782613463976737
50445942 50445942.mol2, BDB-kin50445942.pdbqt 273,67 59,7 -4,71 407,27 3,2446 5 0 0 -6,4082 0,255633795406397
50445943 50445943.mol2, BDB-kin50445943.pdbqt 215,96 45,14 -2,332 336,188 1,8641 5 0 0 -3,2817 0,368562728461507
50445944 50445944.mol2, BDB-kin50445944.pdbqt 242,87 80,45 -4,083 374,197 1,992 7 0 0 -7,9377 0,380782431636827
50445945 50445945.mol2, BDB-kin50445945.pdbqt 238,11 112,08 -4,272 343,358 2,2925 6 3 0 -2,533 0,406515086680158
50445946 50445946.mol2, BDB-kin50445946.pdbqt 209,39 42,85 -3,775 260,295 2,6729 3 0 0 0,28859 0,647896733516081
50445947 50445947.mol2, BDB-kin50445947.pdbqt 208,3 45,75 -5,076 272,306 3,0765 3 1 0 1,4086 0,218198970259315
50445948 50445948.mol2, BDB-kin50445948.pdbqt 174,79 42,85 -2,25 210,235 1,302 3 0 0 0,28859 0,741720458778071
50445949 50445949.mol2, BDB-kin50445949.pdbqt 330,43 95,72 -3,674 474,362 0,8066 9 1 0 -4,9484 0,225650532373608
50445950 50445950.mol2, BDB-kin50445950.pdbqt 284,15 80,45 -4,573 416,278 2,3443 7 0 0 -7,9069 0,336230034222624
These data are only available for scientific research purposes.