• UNII FDA
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 of 2794
Records 50101 to 50120 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
72710624 1ZVC726A2Y mol2, pdbqt 533,1 0,29015 214,77 -5,17 786,892 1,3853 12 5 2 -28,245 0,111230131687915
72710625 KC2609V6O2 mol2, pdbqt 489,49 0,31008 198,92 -4,29 700,779 1,9252 14 6 3 6,3532 0,265003106125113
72710626 0RM2Y48L7H mol2, pdbqt 372,15 0,34457 177,22 -4,054 543,567 1,7633 11 6 3 6,7354 0,347190769545485
72710627 V4JNK46U1U mol2, pdbqt 330,93 0,40465 190,69 -2,239 507,902 -2,8797 11 6 3 5,9321 0,123573534978196
72710628 B1N53L892B mol2, pdbqt 425,46 0,59434 338,93 -1,013 664,436 -7,4626 21 8 3 -29,561 0,277954942880057
72710629 WPA50V1466 mol2, pdbqt 273,7 0,13182 43,37 -5,165 360,536 4,6393 3 0 0 -1,8823 0,108784850635924
72710630 1K7TA6AS47 mol2, pdbqt 273,7 0,13182 43,37 -5,165 360,536 4,6393 3 0 0 -1,8823 0,108784850635924
72710631 A5432RBN9M mol2, pdbqt 147,34 0,13669 23,55 -1,489 188,229 0,5819 3 0 0 -0,3775 0,245179018869534
72710632 500Y9JV943 mol2, pdbqt 1120,1 0,507 777,98 -7,599 1701,2 5,5312 46 25 4 -0,25527 0,131537562719784
72710633 QD1XLV75PI mol2, pdbqt 323,01 0,26414 110,13 -3,955 448,554 2,4172 7 2 0 2,8112 0,403600839813407
72710634 KD5TU0Z26W mol2, pdbqt 274,06 0,19405 59,08 -3,27 394,469 1,1522 6 0 0 7,1204 0,814122444021416
72710635 8WSX0O02J2 mol2, pdbqt 125,69 0,73236 129,72 -0,612 176,128 -2,3005 7 4 0 -8,1729 0,491909038089599
72710636 N0ZLS3RJX9 mol2, pdbqt 308,46 0,14939 52,6 -5,524 404,589 4,9802 4 0 0 -1,8045 0,258996877638538
72710637 D0KSZ4R1UE mol2, pdbqt 326,65 0,46423 193,83 -1,194 476,429 -2,0675 13 6 2 -6,8024 0,388557024986356
72710638 0Z94VRU2GA mol2, pdbqt 258,65 0,20754 65,56 -3,065 354,448 2,3512 5 2 0 1,5035 0,762417238759813
72710639 Q4844408PB mol2, pdbqt 301,91 0,24405 84,02 -2,812 414,5 1,857 7 2 0 2,696 0,46904493437287
72710640 322B1RE5PI mol2, pdbqt 327,48 0,081196 29,54 -5,68 439,681 5,6877 3 0 1 3,3511 0,293374140335067
72710641 4AL1U7J3NA mol2, pdbqt 321,91 0,26486 106,97 -4,006 446,538 2,5609 7 1 0 2,8521 0,144356384036462
72710642 P69W110VDA mol2, pdbqt 312,83 0,053224 23,47 -5,005 412,679 4,1273 2 1 0 4,9971 0,443314055364595
72710644 PIW6HW0DXW mol2, pdbqt 252,22 0,31139 118,22 -2,355 366,452 0,6518 6 5 0 -2,5627 0,471582486728663
Page 
 of 2794
Records 50101 to 50120 of 55865
These data are only available for scientific research purposes.