• Marine natural products
Page 
 of 725
Records 61 to 80 of 14492
 
CAS number
Polar Surface Area
calculated LogS
Molweight
calculated LogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
1008752-06-4 92,69 -5,365 580,77 5,3971 7 3 2 -2,1533 0,1391112
10088-77-4 46,53 -2,386 178,186 1,0559 3 1 0 -1,4524 0,5632015
100896-77-3 46,53 -4,136 334,498 6,2774 3 1 1 -28,492 0,2437065
100942-71-0 204,65 -2,507 612,799 0,5744 11 5 2 -2,0451 0,2568851
100942-72-1 143,96 -3,704 564,802 3,1307 8 2 1 -2,9484 0,2299475
100942-74-3 143,96 -3,212 560,77 2,774 8 2 1 -1,6547 0,2037404
100942-75-4 143,96 -3,503 574,797 3,4471 8 2 1 -5,073 0,2151943
100992-90-3 20,23 -6,217 400,688 7,1058 1 1 1 -5,573 0,150967
100992-91-4 20,23 -6,217 400,688 7,1058 1 1 1 -5,573 0,150967
100994-55-6 86,99 -5,349 440,578 4,8034 5 3 0 -0,78641 0,3002652
101053-52-5 86,99 -5,349 440,578 4,8034 5 3 0 -0,78641 0,3002652
101129-06-0 112,44 -3,98 496,706 3,992 6 3 0 0,66692 0,2826785
101141-34-8 97,99 -4,868 440,578 5,2897 5 4 1 -0,71069 0,303968
101247-83-0 63,6 -5,911 470,691 5,3304 4 1 1 -3,0776 0,1889786
10125-07-2 58,2 -1,577 204,228 0,0712 4 2 0 4,9782 0,963665
10132-50-0 37,3 -1,533 121,179 -0,3608 2 1 0 -3,0542 0,5107127
101339-88-2 20,23 -1,641 126,198 2,2725 1 1 0 -7,5957 0,2844586
10136-52-4 37,3 -4,281 268,439 6,2647 2 1 1 -28,971 0,2476147
101365-28-0 233,28 -9,644 1111,28 2,1118 20 3 2 -4,0585 0,1000249
101365-29-1 213,05 -9,961 1095,28 2,5227 19 2 2 -4,3941 0,1225671
Page 
 of 725
Records 61 to 80 of 14492