• UNII FDA
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Records 761 to 780 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
2966 X31CDK040E mol2, pdbqt 140,17 0,24556 53,11 -1,204 175,234 0,4135 3 2 0 2,9336 0,949632363573775
2968 C1CG1S3T2W mol2, pdbqt 258,76 0,027439 6,48 -0,86 258,492 1,2234 2 0 0 -6,765 0,286958686294179
2969 4G9EDB6V73 mol2, pdbqt 159,94 0,16344 37,3 -2,619 172,267 3,3361 2 1 0 -25,216 0,157133853111373
2972 2BTY8KH53L mol2, pdbqt 108,34 0,27404 40,54 -1,05 139,153 -0,0767 3 1 0 3,4574 0,579649089352754
2973 J06Y7MXW4D mol2, pdbqt 457,34 0,33529 205,84 -2,232 560,69 -0,3149 14 6 3 -2,9001 0,121517022795698
2984 04B949KO6F mol2, pdbqt 254,67 0,25154 75,51 -2,751 320,392 2,1092 7 0 0 2,8174 0,546755248830917
2993 E7QC7V26B8 mol2, pdbqt 384,2 0,11525 61,9 -6,044 456,676 6,828 4 2 1 -5,3325 8,79751362555591E-02
2995 TG537D343B mol2, pdbqt 222,34 0,067509 15,27 -4,279 266,387 3,6244 2 1 0 2,1225 0,248942727996613
2997 67220MCM01 mol2, pdbqt 200,88 0,17926 41,46 -4,696 270,718 2,6263 3 1 0 2,7971 0,255780425585045
2998 S846B891OR mol2, pdbqt 253,42 0,18783 58,56 -3,386 293,405 3,8378 4 2 0 -19,466 0,388253294684067
3007 CK833KGX7E mol2, pdbqt 120,3 0,12693 26,02 -2,066 135,209 1,4539 1 1 0 -1,4507 0,340951407222986
3009 ZQN1G5V6SR mol2, pdbqt 131,53 0,43093 89,34 -1,095 182,169 -4,9852 4 3 0 -8,9035 0,293865991015511
3012 PF550QIT3I mol2, pdbqt 344,84 0,1425 61,21 -5,693 459,587 4,1777 4 0 0 5,7956 0,273952720226144
3016 Q3JTX2Q7TU mol2, pdbqt 211,98 0,13256 32,67 -4,672 284,745 2,9846 3 0 0 3,8838 0,15352818861289
3017 YUS1M1Q929 mol2, pdbqt 240,83 0,34846 95,37 -3,802 304,35 3,8032 5 0 0 -9,7111 4,84358106068937E-02
3019 O5CB12L4FN mol2, pdbqt 150,45 0,34264 66,91 -2,7 230,675 1,415 4 1 0 1,6127 0,846913631790791
3023 Z3D4AJ1R48 mol2, pdbqt 138,4 0,14711 28,24 -4,194 184,262 3,5532 0 0 0 -1,2484 0,462665888186613
3024 V69B659W01 mol2, pdbqt 64,52 0 0 -2,527 173,835 1,7607 0 0 0 -4,1475 0,102415366704021
3025 L6JW2TJG99 mol2, pdbqt 289,23 0,16948 54,46 -3,733 343,469 3,5233 5 1 0 2,5252 0,435548309014977
3026 2286E5R2KE mol2, pdbqt 235,84 0,19539 52,6 -3,578 278,347 4,1158 4 0 0 -6,4287 4,83974501836842E-02
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Records 761 to 780 of 55865
These data are only available for scientific research purposes.