• UNII FDA
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Records 50781 to 50800 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
72942004 Q54IQZ256J mol2, pdbqt 215,39 0,48215 123,92 -1,705 339,364 -0,9727 9 1 0 -2,4806 0,494765246541865
72942005 Q107JES56Y mol2, pdbqt 122,77 0,19956 29,1 -1,695 141,213 0,925 2 1 0 -2,1935 0,319408274519678
72942006 0BEZ0ZZC20 mol2, pdbqt 442,39 0,13377 72,83 -8,928 570,767 9,6754 5 1 2 -3,8013 5,12301292453693E-02
72942007 5YJ678VC9N mol2, pdbqt 592,27 0,23631 169,2 -8,367 780,02 6,592 14 1 3 -13,482 1,34852117089585E-02
72942008 AXD9D9J5OR mol2, pdbqt 279,42 0,13868 42,39 -3,23 371,871 2,2135 6 0 0 9,7934 0,49239621001137
72942009 31NMD7XVRG mol2, pdbqt 242,81 0,17627 46,5 -4,247 304,396 4,0819 4 1 0 -0,24259 0,495711794004206
72942010 KE0CFW9DHO mol2, pdbqt 655,41 0,035154 26,3 -11,771 673,203 19,115 2 0 2 -33,967 0,069530242527285
72942011 7PP3Q97L9O mol2, pdbqt 655,41 0,035154 26,3 -11,771 673,203 19,115 2 0 2 -33,967 0,069530242527285
72942012 81DVJ4GWP5 mol2, pdbqt 581,98 0,23877 173,65 -7,024 839,871 6,7348 11 3 3 9,2096 0,16318776262661
72942013 R8LI11624G mol2, pdbqt 283,22 0,23367 91,85 -3,906 377,503 3,7113 5 2 0 -13,661 0,353582696630726
72942014 G1380TES6X mol2, pdbqt 304,21 0,22787 87,15 -3,045 414,5 2,1165 7 1 0 -0,73836 0,314700224009882
72942015 N3KQ8A1E0X mol2, pdbqt 216,25 0,19732 54,45 -3,761 315,327 2,3519 4 0 0 3,235 0,800705044561783
72942016 2YF82QN5RY mol2, pdbqt 3636,7 0,43543 2049,6 -14,041 4757,51 -23,789 123 67 3 2,6709 0,24193959294319
72942018 C21M8X095K mol2, pdbqt 311,02 0,54106 182,2 -3,569 370,497 -8,7977 10 8 1 -2,1123 0,456841819156466
72942019 269GQP5C4X mol2, pdbqt 163,78 0,26481 58,69 -1,642 207,276 0,1594 4 1 0 2,2675 0,919861218157649
72942020 9O32SH1GPH mol2, pdbqt 515,2 0,34973 233,89 -4,841 668,753 -0,2464 14 8 3 -6,4847 0,214662603133059
72942021 5EM63X2EYP mol2, pdbqt 186,57 0,37691 71,28 -2,669 226,231 1,4495 6 2 0 -3,8706 0,472132410612054
72942022 HM1505E3C7 mol2, pdbqt 239,58 0,23909 54,21 -4,134 288,346 1,2524 5 2 0 1,0948 0,709649985772477
72942023 I88Q63DM73 mol2, pdbqt 468,53 0,18118 97,77 -7,478 630,738 5,9149 9 1 2 5,0859 0,202425451914134
72942024 5G76IGF54K mol2, pdbqt 306,59 0,37767 146,86 -6,044 426,386 1,3058 10 3 0 -2,2861 0,290275281980559
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Records 50781 to 50800 of 55865
These data are only available for scientific research purposes.