Page 
 of 725
Records 12961 to 12980 of 14492
 
CAS number
Polar Surface Area
calculated LogS
Molweight
calculated LogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
83524-44-1 29,26 -0,221 145,269 -0,6786 2 1 0 -4,2902 0,5002682
83542-16-9 20,23 -6,535 412,699 7,1304 1 1 1 -0,093908 0,209147
83560-98-9 78,27 -3,965 370,4 3,2342 6 0 0 -20,162 0,2205806
835629-53-3 39,44 -3,273 254,284 2,7738 3 0 0 -1,6582 0,3979182
835629-54-4 26,3 -2,487 224,258 1,8623 2 0 0 -2,0052 0,4143035
83572-78-5 20,23 -7,672 548,852 12,889 1 1 2 0,35 0,0516135
83572-91-2 95,2 -3,612 402,441 3,1744 7 1 0 -19,709 0,1772477
835925-59-2 66,9 -2,851 306,4 2,4237 4 1 0 -1,1026 0,1964216
83630-99-3 43,37 -3,465 276,375 2,6796 3 0 0 -6,3917 0,2532536
83631-17-8 13,14 -3,773 218,339 4,1962 1 0 0 -7,6345 0,2950321
83631-19-0 44,45 -4,402 263,448 5,2117 1 0 1 -9,2478 0,0666855
83643-92-9 37,3 -3,93 302,456 4,512 2 1 0 -8,2112 0,2029218
83643-93-0 43,37 -4,34 344,493 4,9966 3 0 0 -7,7445 0,1743347
83644-04-6 86,99 -4,652 458,636 6,6674 5 3 1 -0,9926 0,2366478
83-67-0 67,23 -1,506 180,167 -0,4313 6 1 0 3,421 0,206789
83681-79-2 20,23 -6,057 386,661 6,8643 1 1 1 -6,5048 0,1603652
83681-81-6 20,23 -6,289 400,688 7,5175 1 1 1 -1,9242 0,1627084
83681-83-8 20,23 -6,275 386,661 7,0116 1 1 1 -2,5196 0,1642723
83704-10-3 20,23 -5,787 372,634 6,4331 1 1 1 -3,6045 0,1829903
83704-11-4 20,23 -5,793 384,645 6,783 1 1 1 -2,6139 0,1802701