• UNII FDA
Page 
 of 2794
Records 53481 to 53500 of 55865
 
PUBCHEM ID
UNII
Download
Total Surface Area
Relative PSA
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
91617602 A61QSR101S mol2, pdbqt 342,13 0,12507 60,77 -4,935 455,68 4,8609 4 2 0 4,7134 0,471994114501701
91617603 E695J9A64A mol2, pdbqt 234,6 0,13061 39,26 -2,663 309,432 1,7094 3 2 0 3,9415 0,709578786084686
91617607 604K48N8VW mol2, pdbqt 219,3 0,39872 105,32 -3,524 305,337 0,1612 8 3 0 2,6717 0,835664693809836
91617623 O9N5N83DZZ mol2, pdbqt 634,86 0,34672 299,66 -4,985 927,087 0,6625 18 10 3 -3,2308 0,195003170197902
91617624 8A3Q9VKO7U mol2, pdbqt 222,76 0,57201 170,1 -0,509 304,254 -2,6025 10 5 0 -13,911 0,475443979085695
91617625 9SOX10H3W3 mol2, pdbqt 508,08 0,26801 160,21 -4,43 638,844 2,8179 12 3 2 6,5731 0,450427515395743
91617629 5C761FYB9S mol2, pdbqt 97,12 0,85832 125,5 0,111 176,169 -3,5605 6 2 0 -4,5338 0,398946995840858
91617630 JVR38ZM64B mol2, pdbqt 289,02 0,33513 124,09 -2,836 393,438 0,354 9 2 0 -6,0782 0,151761128328086
91617636 951F046A5J mol2, pdbqt 228,52 0,47497 145,91 -1,664 340,283 -1,1833 9 5 0 -6,0331 0,460526947052575
91617642 69ZJ529UBI mol2, pdbqt 402,71 0,40908 214,06 -3,263 592,548 -0,2883 14 7 3 2,463 0,553140184373689
91617644 935U7J0T93 mol2, pdbqt 246,4 0,095576 21,7 -3,337 395,134 3,383 3 0 0 3,4313 0,266028584396441
91617645 HH9RL35865 mol2, pdbqt 548,64 0,33523 249,97 -5,162 808,955 1,3321 15 8 3 -4,3728 0,186791712341246
91617646 X536WKK41G mol2, pdbqt 452,07 0,16834 83,14 -5,576 572,747 4,0018 8 2 1 4,0475 0,135935283841286
91617667 ADC3TWU42R mol2, pdbqt 411,68 0,25923 119,55 -4,3 564,633 3,2175 10 2 1 2,4307 0,488455885002824
91617669 M2B3X4HA2W mol2, pdbqt 842,15 0,46613 477,56 -5,898 1146,12 0,3061 30 12 3 -4,8469 0,161771460731466
91617670 O42P8SO5U6 mol2, pdbqt 189,63 0,19807 42,43 -0,985 222,287 1,0841 4 0 0 7,9758 0,578625955010369
91617671 6226IMZ7MC mol2, pdbqt 106,54 0,14333 26,02 -1,647 121,182 0,9512 1 1 0 -1,551 0,569586635880461
91617672 UA7DCP63XV mol2, pdbqt 539,33 0,25977 203,85 -2,501 749,904 -0,4324 11 3 2 -8,3521 7,24143540952364E-02
91617675 8GJK87S89F mol2, pdbqt 527,73 0,11225 75,99 -8,637 614,948 11,236 5 2 2 -20,81 7,71457184517998E-02
91617677 YTE9WDS0HW mol2, pdbqt 545,68 0,28075 224,08 -2,205 765,903 -0,7781 12 4 2 -11,233 4,35470147412945E-02
Page 
 of 2794
Records 53481 to 53500 of 55865
These data are only available for scientific research purposes.