• UNII FDA
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Records 55821 to 55840 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
123133443 0CXY83M7IT mol2, pdbqt 248,53 0,11286 32,34 -4,281 320,862 3,8369 3 1 0 1,3416 0,37551187311965
123133447 9PC6YB8658 mol2, pdbqt 410,47 0,20386 101,93 -5,268 535,679 4,9259 7 2 1 1,8625 0,353933782296871
123133449 5H88K2AQ3R mol2, pdbqt 311,78 0,25614 83,37 -6,16 411,468 2,1127 8 2 0 3,9446 0,187400710167193
123133450 G34ZCK7E58 mol2, pdbqt 369,36 0,28173 121,22 -3,57 552,158 1,5142 10 2 1 -11,129 6,48089385788545E-02
123133451 SO7S6DS7TQ mol2, pdbqt 345,86 0,25768 97,36 -5,25 486,559 2,9662 8 0 0 -6,3711 0,261254529173093
123133452 0W8AEU89FI mol2, pdbqt 354,8 0,37153 184,84 -2,602 430,544 -3,3392 10 6 1 -21,798 0,4065472595516
123133457 G0I5C2CC38 mol2, pdbqt 204,41 0,54317 112,91 -1,054 246,29 -0,292 7 3 0 2,6376 0,933352523701784
123133461 6H584T9PPK mol2, pdbqt 377,97 0,27044 117,59 -4,897 518,601 3,2145 9 1 1 -7,7833 0,255799181365393
123133462 8A00247K9O mol2, pdbqt 223,29 0,31036 88,38 -2,342 320,34 1,5514 6 3 0 -0,44574 0,376624492423187
123133484 3J363KK66E mol2, pdbqt 317,44 0,4576 202,32 -1,119 457,43 -3,0796 12 7 2 -11,211 8,68510516971456E-02
123133486 04BAC87S7F mol2, pdbqt 281,51 0,2152 63,79 -3,159 382,458 2,1974 6 1 0 2,6043 0,788048172877584
123133487 8T3XG6I1X3 mol2, pdbqt 222,8 0,42199 140,51 -1,801 318,345 -1,9061 7 4 0 -13,297 0,465071462015894
123133490 F3U1E43GFT mol2, pdbqt 230,35 0,22596 73,63 -4,048 263,384 2,9215 4 2 0 -10,058 0,121418252153627
123133493 E1YR453BA1 mol2, pdbqt 281,51 0,2152 63,79 -3,159 382,458 2,1974 6 1 0 2,6043 0,788048172877584
123133511 1MSQ9O0VPM mol2, pdbqt 275,72 0,24775 80,01 -2,848 357,405 1,4548 6 1 0 0,16559 0,399101108006951
123133513 Y96320SM3Z mol2, pdbqt 379,88 0,33966 117,88 -3,817 542,579 0,7106 10 0 1 -0,035194 9,70758098537825E-02
123133517 N5521DH3GD mol2, pdbqt 337,51 0,5068 238,94 -0,065 532,526 -1,7726 13 4 2 2,3098 0,40041296547779
123133518 50W55STH6J mol2, pdbqt 337,51 0,5068 238,94 -0,065 532,526 -1,7726 13 4 2 2,3098 0,40041296547779
123133521 Z0URG010OP mol2, pdbqt 222,27 0,31178 88,38 -2,566 318,324 1,2839 6 3 0 -0,37371 0,380125340411524
123133522 7XD9EN3A7B mol2, pdbqt 334,22 0,47663 218,63 -0,598 489,472 -5,0245 13 9 2 -3,0731 0,397392161221488
Page 
 of 2794
Records 55821 to 55840 of 55865
These data are only available for scientific research purposes.