• UNII FDA
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Records 53581 to 53600 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
91617971 X42P3B148J mol2, pdbqt 402,18 0,35989 195,6 -3,476 585 -0,1826 12 7 3 -1,98 0,322007071984116
91617977 WJV4U1O78C mol2, pdbqt 301,47 0,25485 85,36 -4,31 430,539 2,2859 6 1 0 -0,11386 0,302347237300226
91617980 X79OK4ZSBR mol2, pdbqt 189,63 0,54306 144,16 -0,927 269,208 -0,9256 8 5 0 -8,1887 0,480682240424655
91617981 OT7B1JGO3Q mol2, pdbqt 394,11 0,20862 99,13 -5,421 546,673 4,0886 7 1 1 -20,022 0,203866766019895
91617983 4OU745T241 mol2, pdbqt 30,54 1 52,04 -0,654 32,0458 -1,652 2 2 0 -1,7675 0,122658411708021
91617988 BCZ3IO17HK mol2, pdbqt 332,8 0,26956 115,2 -3,925 492,606 1,7812 6 1 0 -0,76225 0,429375815768176
91617989 N157UG61BS mol2, pdbqt 185,57 0,51366 125,76 -1,514 265,272 -1,9595 8 4 0 2,0707 0,903319881019232
91617994 P56WJ9MD0N mol2, pdbqt 276,13 0,29841 108,61 -2,027 376,404 1,4612 7 4 0 0,69949 0,728069992737832
91617999 Z7L8L2CX3Y mol2, pdbqt 233,04 0,015233 3,24 -4,412 287,405 4,5999 1 0 0 6,4602 0,227658718772792
91618000 E122S1F674 mol2, pdbqt 472,95 0,2595 131,45 -3,85 673,797 2,1085 12 1 2 3,9732 0,471254896305125
91618001 X5D79X18ST mol2, pdbqt 218,44 0,43133 135,8 -3,54 284,403 1,2154 4 2 0 -2,9038 0,454644160033011
91618002 17E01H280E mol2, pdbqt 652,65 0,37285 335,44 -4,43 975,127 -1,1512 20 13 3 -12,343 0,205309864049189
91618003 58992VKD0P mol2, pdbqt 272,52 0,19698 65,56 -2,443 367,467 1,1925 5 2 0 2,0868 0,659716792952443
91618004 ER8B029ZA8 mol2, pdbqt 272,52 0,19698 65,56 -2,443 367,467 1,1925 5 2 0 2,0868 0,659716792952443
91618005 6124O2BUW4 mol2, pdbqt 449,42 0,20765 101,09 -4,719 666,772 2,6412 11 0 2 3,6777 7,17172579364338E-02
91618009 3PE8S99ZTG mol2, pdbqt 283,63 0,26577 104,06 -3,535 374,431 2,6245 6 3 0 -4,622 0,398297626150375
91618010 4X20XT15HG mol2, pdbqt 304,93 0,23704 93,06 -4,228 432,555 2,5836 6 2 0 -0,26588 0,489769023715683
91618023 Q13015IJTU mol2, pdbqt 281,5 0,43105 154,42 -1,687 406,39 -0,4336 10 5 0 2,3588 0,394982288644315
91618027 W5Y3KOX4Y9 mol2, pdbqt 881,23 0,50128 589,72 -3,351 1178,24 -11,928 33 18 3 -18,136 0,229911564957205
91618030 E393U127PM mol2, pdbqt 10 1 9,23 -0,53 18,0149 0 1 1 0 -1 0,135605826048597
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 of 2794
Records 53581 to 53600 of 55865
These data are only available for scientific research purposes.