• Drug Bank
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Records 3741 to 3760 of 6870
 
Molecule Name
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TPSA
cLogS
MW
cLogP
HBA
HBD
Ro5 violations
Druglikeness
DrugScore
Blood-Brain Barrier
Human Intestinal Absorption
Caco-2 Permeability
DB04208 mol2, pdbqt 169,4 -1,9 210,228 1,4572 4 1 0 -2,4933 0,511383418667126 BBB+ HIA+ Caco2+
DB04209 mol2, pdbqt 61,9 -6,044 456,676 6,828 4 2 1 -5,3325 8,79751362555591E-02 BBB+ HIA+ Caco2+
DB04210 mol2, pdbqt 812,56 -2,298 1133,17 -8,0486 30 12 3 -4,5728 0,244740928888652 BBB- HIA- Caco2-
DB04211 mol2, pdbqt 212,95 -0,133 327,26 -3,8834 10 7 1 -0,61378 0,635366098104936 BBB- HIA- Caco2-
DB04212 mol2, pdbqt 69,84 0,439 88,0856 -1,2967 3 2 0 -0,81631 0,648955265391007 BBB+ HIA+ Caco2-
DB04213 mol2, pdbqt 223,01 -3,909 260,38 3,2419 3 2 0 -3,3269 0,40785923703932 BBB+ HIA+ Caco2+
DB04214 mol2, pdbqt 143,4 -0,67 219,089 -2,8527 7 2 0 -26,179 0,488405861985513 BBB+ HIA- Caco2-
DB04215 mol2, pdbqt 224,11 -4,07 344,211 1,2829 4 3 0 -1,1514 0,490934489874542 BBB+ HIA+ Caco2-
DB04216 mol2, pdbqt 201,94 -2,491 302,237 1,4902 7 5 0 -0,082832 0,241775078959835 BBB- HIA+ Caco2-
DB04217 mol2, pdbqt 82,43 -0,73 99,0887 -3,3702 3 2 0 -6,8389 0,495019941520116 BBB+ HIA+ Caco2-
DB04218 mol2, pdbqt 182,41 -2,009 266,256 -1,5287 8 4 0 -0,90819 0,609920293872004 BBB+ HIA+ Caco2-
DB04219 mol2, pdbqt 98,36 -0,854 282,834 1,3268 8 2 0 -2,5375 0,507783819528267 BBB+ HIA- Caco2-
DB04220 mol2, pdbqt 690,09 -5,492 936,061 2,6567 18 6 3 6,0051 0,264875513075571 BBB- HIA- Caco2-
DB04221 mol2, pdbqt 327,27 -4,462 326,63 6,9594 1 0 1 -14,384 0,129835182436708 BBB+ HIA- Caco2+
DB04222 mol2, pdbqt 261,91 -1,938 361,442 -1,8138 8 4 0 1,1577 0,791739257401558 BBB- HIA+ Caco2-
DB04223 mol2, pdbqt 166,8 -0,965 219,2 -4,0558 9 5 0 -13,452 0,487385134837797 BBB+ HIA- Caco2-
DB04224 mol2, pdbqt 37,3 -4,551 282,466 6,7191 2 1 1 -28,971 0,223956097390678 BBB+ HIA+ Caco2+
DB04225 mol2, pdbqt 98,29 -0,694 115,131 -1,2466 3 2 0 1,1585 0,869556071075811 BBB- HIA+ Caco2-
DB04226 mol2, pdbqt 420,81 0,322 647,621 -7,0726 19 14 3 -10,503 0,285651799162292 BBB- HIA- Caco2-
DB04227 mol2, pdbqt 204,22 -0,445 290,271 -5,3692 9 6 1 0,63375 0,791644083005861 BBB- HIA- Caco2-
Page 
 of 344
Records 3741 to 3760 of 6870
These data are only available for scientific research purposes.