• Marine natural products
Page 
 of 725
Records 8641 to 8660 of 14492
 
CAS number
Polar Surface Area
calculated LogS
Molweight
calculated LogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
39969-56-7 9,23 -3,038 215,089 3,1755 1 0 0 -4,4242 0,4347696
39969-57-8 9,23 -3,308 229,116 3,6299 1 0 0 -9,215 0,244032
39974-94-2 31,23 -2,146 189,213 1,6951 3 0 0 -1,1888 0,5824107
3999-70-0 20,23 -1,017 74,1224 0,9593 1 1 0 -6,3463 0,1059548
400710-54-5 131,75 -6,351 696,918 7,6551 9 3 2 -8,6667 0,08723
40071-60-1 38,69 -5,989 428,654 6,3859 3 1 1 -2,4641 0,1049848
400766-93-0 9,86 -4,696 500,243 5,3998 2 0 2 -5,7111 0,0850151
400767-00-2 9,86 -4,892 589,145 5,6382 2 0 2 -5,3889 0,0663399
40087-61-4 0 -2,087 108,183 3,0137 0 0 0 -8,6875 0,2187618
40087-62-5 0 -2,087 108,183 3,0137 0 0 0 -8,6875 0,2187618
40136-11-6 123,93 -2,131 253,209 -0,8713 7 4 0 0,88224 0,8091465
40150-92-3 20,23 -2,504 178,274 2,7812 1 1 0 -3,1312 0,4716034
40165-88-6 57,53 -2,49 202,293 2,7687 3 2 0 -17,039 0,4516231
401892-69-1 43,37 -3,318 278,39 3,4451 3 0 0 -5,8332 0,326437
40266-29-3 26,3 -3,275 264,407 6,1417 2 0 1 -2,7034 0,0683179
40290-32-2 72,83 -8,221 568,92 12,249 5 1 2 -26,084 0,084706
4030-92-6 17,07 -6,222 396,656 7,2923 1 0 1 -1,0256 0,1127921
403646-58-2 29,46 -3,949 228,169 4,5978 2 1 0 -2,26 0,224328
403699-20-7 99,38 -6,369 576,855 6,0181 6 4 2 -8,3009 0,1222179
40380-24-3 111,45 -3,278 324,424 2,1724 5 1 0 4,9268 0,8466224
Page 
 of 725
Records 8641 to 8660 of 14492