• Marine natural products
Page 
 of 725
Records 661 to 680 of 14492
 
CAS number
Polar Surface Area
calculated LogS
Molweight
calculated LogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
109954-46-3 63,6 -2,677 292,374 3,3465 4 1 0 -1,3365 0,5104519
109954-47-4 63,6 -2,677 292,374 3,3465 4 1 0 -1,3365 0,5104519
109954-48-5 43,37 -2,863 274,359 4,3419 3 0 0 -0,33117 0,5395916
109979-15-9 121,49 -4,287 417,616 3,7183 5 1 0 -1,723 0,1138645
109979-16-0 121,49 -4,287 417,616 3,7183 5 1 0 -1,723 0,1138645
109979-17-1 97,7 -4,907 426,043 4,7552 4 1 0 -4,2371 0,0333695
109979-18-2 53,25 -4,314 366,951 3,6037 3 1 0 -2,9349 0,0467488
1099-87-2 89,05 -2,915 368,492 1,8814 5 1 0 0,62577 0,6982851
110012-18-5 20,23 -6,405 412,699 7,9911 1 1 1 -4,0757 0,1387053
110012-19-6 20,23 -6,405 412,699 7,9911 1 1 1 -4,0757 0,1387053
1100-15-8 63,22 -3,687 342,346 2,3843 6 0 0 -0,010284 0,6041929
110025-80-4 99,13 -6,164 560,769 6,0054 7 1 2 -0,49131 0,1076201
110025-83-7 65,22 -0,324 193,209 -0,5774 6 1 0 4,653 0,9766727
110042-28-9 99,13 -6,164 560,769 6,0054 7 1 2 -0,40837 0,1091583
110043-50-0 77,04 -4,067 394,985 2,8814 4 1 0 0,2222 0,0728651
11004-68-5 119,61 -6,218 731,023 10,996 7 5 2 1,2023 0,144145
110115-10-1 44,76 -5,479 406,604 6,176 4 0 1 -12,651 0,1123812
110189-02-1 84,3 -2,374 295,341 2,1808 5 3 0 2,5079 0,868002
110189-04-3 120,05 -2,623 405,413 1,3383 9 3 0 4,4311 0,825661
110189-06-5 109,05 -3,882 433,467 2,1264 9 2 0 3,3601 0,708837
Page 
 of 725
Records 661 to 680 of 14492