• UNII FDA
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Records 48801 to 48820 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
71463598 MS1UFS6FAB mol2, pdbqt 331,87 0,30572 138,2 -3,743 480,527 1,4116 8 3 0 0,91869 0,351604506354239
71463600 93AN1BC524 mol2, pdbqt 272,43 0,34167 113,04 -2,616 377,464 1,6327 7 2 0 8,496 0,512247201502131
71463607 I8N0G33SOF mol2, pdbqt 225,85 0,12229 36,36 -3,079 294,397 2,6804 3 1 0 0,88095 0,733394156005022
71463610 K8064V0P9V mol2, pdbqt 273,76 0,4851 175,09 -1,939 416,413 0,5701 10 3 0 10,635 0,50487828717947
71463715 283Q61MZID mol2, pdbqt 296,22 0,26244 91,34 -3,936 413,472 -1,1244 8 2 0 2,9357 0,737852794655956
71463918 3VYM1G0Y0X mol2, pdbqt 92,49 0,58936 83,55 -0,169 119,119 -3,4634 4 3 0 -7,0246 0,297514750247028
71465152 38H206R00R mol2, pdbqt 298,35 0,32221 130,55 -1,766 375,471 -1,1649 8 4 0 7,6117 0,88999404276453
71471223 DDD2AB5TWK mol2, pdbqt 861,43 0,24636 258,27 -5,959 1082,43 0,8476 20 6 3 -14,327 0,158544957002569
71474000 BKB9A29AQ0 mol2, pdbqt 563,06 0,28189 191,45 -5,567 720,865 2,4442 14 6 3 -21,576 0,174934837376744
71474517 OVR52K7BDW mol2, pdbqt 756,62 0,20103 174,64 -11,582 1001,28 10,444 14 4 3 -14,17 2,26832009740787E-02
71475850 R2DSA9X1S7 mol2, pdbqt 289,48 0,21932 89,49 -5,373 376,463 1,8531 7 1 0 -2,1864 0,344393154629077
71476300 2UA31Z29H1 mol2, pdbqt 435,27 0,22588 118,21 -4,653 651,684 4,2515 10 3 1 2,7652 0,220784939746744
71478448 P4B6L1259C mol2, pdbqt 301,61 0,22967 95,08 -5,05 427,47 2,8238 6 4 0 -2,2704 0,328998434267023
71479709 ZA45457L1K mol2, pdbqt 340,67 0,22092 93,37 -6,911 429,522 3,8451 7 2 0 -2,7348 6,88046060514543E-02
71481097 31TZ62FO8F mol2, pdbqt 303,11 0,28607 97,62 -4,583 443,31 2,572 8 2 0 -4,5155 0,258628224976238
71481187 LZ0835OW2M mol2, pdbqt 237,93 0,26865 70,42 -3,404 314,34 2,3445 6 0 0 1,6151 0,772709463806475
71484494 8347HC35J6 mol2, pdbqt 274,95 0,25859 103,86 -3,044 385,482 0,1048 6 3 0 7,0282 0,839831290287157
71487912 88VXS58L1Z mol2, pdbqt 260,09 0,32827 113,29 -2,873 344,318 1,7546 7 3 0 -0,47534 0,599596417791431
71488934 HR8O7441H1 mol2, pdbqt 264,56 0,24463 89,05 -3,189 322,464 3,1381 5 1 0 -33,098 0,41059319392432
71488935 53J4395OCC mol2, pdbqt 264,56 0,24463 89,05 -3,189 322,464 3,1381 5 1 0 -33,098 0,41059319392432
Page 
 of 2794
Records 48801 to 48820 of 55865
These data are only available for scientific research purposes.