• Drug Bank
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Records 6261 to 6280 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
DB08662 mol2, pdbqt 244,69 -4,794 373,245 4,8227 3 1 0 -1,6764 0,315553175271727 BBB+ HIA+ Caco2+
DB08663 mol2, pdbqt 237,32 -3,818 310,348 3,8092 4 1 0 0,43073 0,358208417534453 BBB+ HIA+ Caco2+
DB08664 mol2, pdbqt 344,43 -5,011 452,505 4,016 8 3 0 -49,437 0,264975531230373 BBB- HIA+ Caco2-
DB08665 mol2, pdbqt 218,58 -4,564 298,301 1,5778 7 0 0 -1,708 0,437532871613848 BBB+ HIA+ Caco2-
DB08666 mol2, pdbqt 187,01 -4,184 268,202 0,6057 6 2 0 -11,14 0,117647897381486 BBB+ HIA+ Caco2+
DB08667 mol2, pdbqt 163,9 -3,72 218,195 -0,1418 6 2 0 -5,2902 0,210818839233579 BBB+ HIA+ Caco2+
DB08668 mol2, pdbqt 181,65 -3,419 244,214 -0,7575 8 3 0 -3,9928 0,130916240584387 BBB+ HIA+ Caco2-
DB08669 mol2, pdbqt 311,86 -2,455 393,482 -0,1076 8 4 0 2,9579 0,834942529968068 BBB- HIA- Caco2-
DB08670 mol2, pdbqt 336,62 -2,982 421,536 0,7355 8 4 0 2,9579 0,783828946471531 BBB- HIA- Caco2-
DB08671 mol2, pdbqt 187,01 -4,184 268,202 0,6057 6 2 0 -11,14 0,147059871726857 BBB+ HIA+ Caco2+
DB08672 mol2, pdbqt 260,89 -4,271 328,386 2,4078 4 2 0 3,1911 0,747374758824576 BBB+ HIA+ Caco2+
DB08673 mol2, pdbqt 213,3 -3,807 297,402 2,8485 5 2 0 3,1184 0,786733424499753 BBB+ HIA+ Caco2-
DB08674 mol2, pdbqt 327,1 -6,118 435,486 2,5746 7 1 0 1,6329 0,166459412430252 BBB+ HIA+ Caco2+
DB08675 mol2, pdbqt 286,48 -4,593 332,486 4,5565 4 1 0 -24,623 0,145381687102585 BBB+ HIA+ Caco2-
DB08676 mol2, pdbqt 344,83 -4,803 453,544 2,5198 7 1 0 2,6694 0,12729314812917 BBB+ HIA+ Caco2+
DB08677 mol2, pdbqt 203,68 -3,229 261,348 1,7779 4 1 0 1,7644 0,820260879328685 BBB+ HIA+ Caco2-
DB08678 mol2, pdbqt 145,67 -1,706 201,245 -0,1224 4 2 0 0,72668 0,646855316898944 BBB+ HIA+ Caco2-
DB08680 mol2, pdbqt 276,51 -5,31 350,869 5,5478 4 1 1 -9,6696 0,22568354364385 BBB+ HIA+ Caco2+
DB08681 mol2, pdbqt 244,64 -4,59 315,82 4,0134 4 1 0 -3,2557 0,341029351405323 BBB+ HIA+ Caco2+
DB08682 mol2, pdbqt 259,35 -4,627 355,841 3,0096 5 1 0 -2,0753 0,230717924748435 BBB+ HIA+ Caco2+
Page 
 of 344
Records 6261 to 6280 of 6870
These data are only available for scientific research purposes.