• UNII FDA
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 of 2794
Records 49901 to 49920 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
71587984 WK3V0374YQ mol2, pdbqt 308,75 0,35527 134,16 -2,662 399,402 2,713 9 3 0 0,3376 0,638947897133585
71587985 DD3LDH08S8 mol2, pdbqt 431,69 0,43191 236,28 -4,398 576,521 2,7449 15 6 3 -0,68378 7,26667276563251E-02
71587986 HTC87NA4WY mol2, pdbqt 226,4 0,17332 57,53 -4,105 310,392 3,0871 3 2 0 1,2785 0,407777824259647
71587987 A072BZ4KM3 mol2, pdbqt 592,16 0,14231 99,26 -8,804 744,974 9,5674 9 1 2 -18,605 4,06554902260386E-02
71587988 5PDP2ZZR0N mol2, pdbqt 287,89 0,12553 46,53 -5,584 370,531 6,0683 3 1 1 -7,4576 0,116801235097994
71587989 31599TJ137 mol2, pdbqt 210,83 0,51221 135,09 -2,307 265,224 -0,0104 8 5 0 -4,1516 0,476209088130358
71587990 70N628ATGT mol2, pdbqt 236,89 0,4497 132,29 -3,013 294,262 1,3245 8 4 0 -6,6032 0,267924385844624
71587992 N02U08WH7B mol2, pdbqt 266,72 0,18683 64,09 -3,68 375,855 0,7749 6 1 0 6,3141 0,80572335238202
71587993 89DNT9F435 mol2, pdbqt 292,82 0,2271 94,5 -3,713 365,488 1,3987 5 1 0 -1,3421 0,487049117887336
71587995 28LAR2REDG mol2, pdbqt 331,97 0,2027 89,87 -3,256 424,539 1,8392 6 3 0 0,59744 0,638483869207946
71587996 SLN899GNVO mol2, pdbqt 459,29 0,050164 26,3 -8,227 480,858 12,786 2 0 1 -16,951 4,85181464391294E-02
71588001 BTQ82Y9RXZ mol2, pdbqt 309,13 0,16094 62,16 -4,606 457,584 3,2839 5 2 0 1,0915 0,523974909963345
71588002 KPM50228FR mol2, pdbqt 194,52 0,39713 106,35 -2,459 284,726 0,3344 6 2 0 3,4193 0,728523506416445
71588003 WVI85YMP83 mol2, pdbqt 332,39 0,21746 93,06 -4,681 434,571 3,961 6 2 0 0,72687 0,484557043943376
71588004 L0XW1R6D3S mol2, pdbqt 269,08 0,1475 49,77 -3,032 352,88 1,7785 4 1 0 4,4126 0,407193131884255
71588005 CG6F79CJXL mol2, pdbqt 476,26 0,0973 64,01 -6,233 643,653 7,1907 5 2 2 8,5641 0,194124497916042
71599291 LZI0HJ3K2R mol2, pdbqt 434,7 0,42924 252,4 -2,566 554,646 -2,2965 15 7 3 -13,609 0,193076790113956
71599640 02Y3Z2756M mol2, pdbqt 410,19 0,25459 123,07 -8,553 559,62 4,1659 9 2 1 4,6475 0,172976577466605
71599794 U5SD55XZY8 mol2, pdbqt 303,1 0,361 134,94 -2,517 398,455 -0,4717 8 1 0 -9,042 0,255026299513678
71600087 VR86R11J7J mol2, pdbqt 322,63 0,24988 99,88 -6,692 459,472 2,8103 7 2 0 3,2978 0,261779736486313
Page 
 of 2794
Records 49901 to 49920 of 55865
These data are only available for scientific research purposes.