• UNII FDA
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Records 54961 to 54980 of 55865
 
PUBCHEM ID
UNII
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Total Surface Area
Relative PSA
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
117587604 1C9AK5WN6A mol2, pdbqt 171,73 0,37722 92,21 -1,508 246,282 0,9341 5 2 0 -5,877 0,478696420509373
117587610 DNF75389IT mol2, pdbqt 449,84 0,58381 352,15 -1,487 648,577 -7,4027 21 13 3 1,2775 0,502256593950122
117587619 EXP1VI22ZH mol2, pdbqt 156,67 0,17942 35,5 -0,765 192,261 0,7623 3 2 0 2,6953 0,754418955070014
117587620 81641T105J mol2, pdbqt 275,49 0,51058 198,03 -1,507 389,415 -2,7232 10 4 0 7,4363 0,881509668678541
117587621 55YB78VBFJ mol2, pdbqt 294,26 0,42836 162,37 -2,962 433,508 2,9948 8 2 0 11,298 0,748839857023292
117587623 3A8QY089XN mol2, pdbqt 334,66 0,24568 99,13 -4,519 512,519 1,9558 7 1 1 -4,015 0,294189016715753
117587624 SNM81IV3WM mol2, pdbqt 248,46 0,46909 158,82 -1,143 317,341 -3,4687 9 5 0 -15,151 0,46991733719566
117587625 KU6M163B0R mol2, pdbqt 0   0 -0,53 17,0308 0 1 1 0 -1 0,135608264080025
117587626 951UY70IYU mol2, pdbqt 283,31 0,4177 118,37 -5,338 377,183 2,0104 9 4 0 -1,0928 0,112919193488091
117587630 8AT371DB1B mol2, pdbqt 312,73 0,073674 26,3 -5,875 386,617 6,4315 2 0 1 -15,894 0,173280406037177
117587631 BST7T257DN mol2, pdbqt 524,43 0,3693 259,16 -7,986 758,191 5,7647 15 5 3 -14,395 1,16687170945098E-02
117587637 8D7CX8WO6Z mol2, pdbqt 264,55 0,28543 96,54 -5,111 379,402 2,4519 6 2 0 -8,5435 0,192602435998796
117587638 C3O1G14LR1 mol2, pdbqt 294,26 0,42836 162,37 -2,962 433,508 2,9948 8 2 0 11,298 0,748839857023292
117587639 W64GU7350V mol2, pdbqt 261,98 0,126 42,23 -4,603 321,419 3,9837 3 1 0 -2,5396 0,281781788086555
117587640 22C2TGS7ND mol2, pdbqt 226 0,5135 153,14 -0,301 341,411 0,8672 7 2 0 11,155 0,923547119278782
117587641 R67KC9COEN mol2, pdbqt 207,95 0,034143 6,48 -1,826 233,378 1,5168 2 0 0 7,5247 0,567693213715462
117587642 VI1O81G8CB mol2, pdbqt 226 0,5135 153,14 -0,387 341,411 0,8954 7 2 0 11,557 0,92297050784597
117587643 YW7KEX596G mol2, pdbqt 212,84 0,15552 38,69 -3,658 288,386 3,4899 3 1 0 -0,6515 0,527326769453969
117587644 16AHE7410O mol2, pdbqt 237,55 0,37137 115 -3,349 319,404 1,7901 4 1 0 -1,5864 0,500337853932122
117587645 7V06N8PHIR mol2, pdbqt 381,95 0,30638 142,81 -3,407 520,677 1,3543 10 1 1 5,5789 0,389274853249935
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Records 54961 to 54980 of 55865
These data are only available for scientific research purposes.