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Records 51341 to 51360 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
76958570 3O488IB3CJ mol2, pdbqt 101,8 0,30992 35,33 -2,13 148,273 1,6111 1 0 0 1,2507 0,844593959356246
76958618 0LT1I1B7S8 mol2, pdbqt 1496,1 0,38102 708,13 -6,811 1964,33 -5,1545 47 22 3 3,5665 0,28120644976993
76958637 5565H6X9AO mol2, pdbqt 291,35 0,13602 46,61 -3,684 357,492 3,737 4 0 0 -6,9501 0,367729097305865
76958638 1TL94ZN96T mol2, pdbqt 291,35 0,13602 46,61 -3,684 357,492 3,737 4 0 0 -6,9501 0,367729097305865
76958643 4736R46V0G mol2, pdbqt 608,5 0,22123 180,05 -6,913 777,045 6,0151 11 5 3 -2,9152 9,71553357923771E-02
76958644 4F7MA81184 mol2, pdbqt 615,24 0,19752 159,82 -7,523 775,073 7,1439 10 4 2 -4,1126 7,80582020996284E-02
76958645 387OE420H7 mol2, pdbqt 623,49 0,23683 197,12 -6,725 805,055 5,576 12 5 3 -3,9973 0,102105635706245
76958650 5E8T95VN5L mol2, pdbqt 161,83 0,3542 90,42 -3,269 290,103 -0,0151 4 3 0 0,81668 0,360666411778197
76958654 OZW85P416W mol2, pdbqt 485,92 0,081557 46,61 -9,356 606,219 10,084 4 0 2 -19,079 7,75935957450179E-02
76958655 TPT78ECM79 mol2, pdbqt 365,09 0,47021 232,97 -1,712 563,654 -1,6082 12 5 2 9,7627 0,646595760814976
76958678 QZU7V4G1RX mol2, pdbqt 360,06 0,21905 104,14 -3,154 485,619 1,9752 7 2 0 4,4387 0,41890441432395
76958679 9ZBQ0G1L0B mol2, pdbqt 312,49 0,01136 3,24 -3,934 310,587 6,3009 1 0 1 -23,818 0,151364046371938
76958691 X94T930W1C mol2, pdbqt 183,56 0,36593 83,55 -2,052 276,291 -0,5284 6 1 0 4,5214 0,562199606991202
76958767 4O8T669ITP mol2, pdbqt 249,45 0,15153 39,93 -2,944 339,438 2,867 5 0 0 4,4543 0,8317321548903
76958776 KY0Y81N4WC mol2, pdbqt 414,56 0,23008 122,52 -6,986 544,598 5,1844 8 3 2 -1,2573 0,102202207056235
76958824 D6373C782P mol2, pdbqt 146,34 0,10435 26,02 -2,545 161,247 2,1772 1 1 0 -3,8883 0,472110669709692
76958825 W215T2JD50 mol2, pdbqt 146,34 0,10435 26,02 -2,545 161,247 2,1772 1 1 0 -3,8883 0,472110669709692
76958826 83UZY85DPH mol2, pdbqt 146,34 0,10435 26,02 -2,545 161,247 2,1772 1 1 0 -3,8883 0,472110669709692
76958918 706O8OR5TM mol2, pdbqt 158,13 0,73117 166,72 1,831 260,134 -5,8646 9 6 1 -22,924 0,48642484273903
76958929 744L89AT9T mol2, pdbqt 528,46 0,83912 603,53 9,719 982,8 -17,376 35 8 3 -0,39873 0,35146874207827
These data are only available for scientific research purposes.