• UNII FDA
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Records 47361 to 47380 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
56841706 0H7Q13127S mol2, pdbqt 220,65 0,11144 31,78 -4,173 284,426 3,9058 2 0 0 6,0737 0,205849698954965
56841753 2M3V3B8OEA mol2, pdbqt 4684 0,41689 2517 -22,395 6231,21 -28,312 149 79 3 -0,048333 0,185989892892015
56841761 54F576E38V mol2, pdbqt 273,67 0,14503 49,77 -3,507 357,492 3,1777 4 1 0 2,5437 0,751931475914899
56841768 4GH264P17A mol2, pdbqt 133,32 0,38074 72,72 0,814 150,197 -1,6968 4 4 0 -1,7102 0,16447556034974
56841785 61CU4T79WM mol2, pdbqt 96,76 0,14675 12,96 -1,688 140,189 0,7196 4 0 0 1,5849 0,114936704683002
56841787 F06U405Z9W mol2, pdbqt 54,78 1 82,98 1,524 98,0779 -3,4103 4 2 0 -2,0209 7,20337002000834E-02
56841788 W01G2C1BCF mol2, pdbqt 4205,2 0,60132 3154 -16,664 6649,31 -66,553 217 57 3 -35,743 0,12500107472075
56841789 I4Z5C8FM6H mol2, pdbqt 5028,6 0,5824 3597,2 -49,21 7707,43 -31,761 202 55 3 -19,775 2,88000000743394E-02
56841793 ILE26V76EB mol2, pdbqt 4868 0,56907 3351,9 -47,454 7346,25 -28,215 197 47 3 -21,825 0,02880000000957
56841801 8D81JS19ET mol2, pdbqt 245,52 0,10582 28,16 -3,229 313,831 2,9908 3 1 0 1,8144 0,463263814673173
56841803 7389YR3OOV mol2, pdbqt 262,54 0,68553 275,84 1,918 436,123 -17,124 14 8 2 -21,614 0,420484134544035
56841808 H86HJ92K8Y mol2, pdbqt 2252,3 0,40148 1184 -9,206 2933,48 -17,761 71 42 3 0,76579 0,213415234376148
56841834 LE39B2006U mol2, pdbqt 5391,2 0,48017 3336,5 -15,634 7265,83 -46,021 199 103 3 -31,602 4,50010837138175E-02
56841835 EL5U85UKD2 mol2, pdbqt 2639,1 0,46838 1613,9 -6,175 3464,08 -28,14 92 56 3 -6,8995 0,154649663551992
56841862 CP012282EU mol2, pdbqt 258,17 0,21133 59,95 -2,498 339,405 1,3712 5 2 0 -2,2219 0,488171149677189
56841872 S33056JLS5 mol2, pdbqt 268,83 0,2432 94,83 -3,468 392,465 1,3784 5 3 0 0,89355 0,548624639310717
56841873 01N552709G mol2, pdbqt 320,31 0,60185 282,61 0,141 484,501 -7,4739 15 11 2 2,6543 0,745596602282144
56841901 GKK29YSF88 mol2, pdbqt 3160,1 0,44044 1809 -12,937 4116,78 -26,613 106 60 3 3,1599 0,244999600127329
56841902 JHB2QIZ69Z mol2, pdbqt 2869,2 0,45079 1665,4 -8,911 3790,34 -28,115 100 57 3 -4,4965 0,128858618390383
56841906 37M3MZ001L mol2, pdbqt 269,18 0,18935 49,81 -4,234 339,39 3,443 5 0 0 -1,7454 0,413108079946521
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 of 2794
Records 47361 to 47380 of 55865
These data are only available for scientific research purposes.