• Drug Bank
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Records 5321 to 5340 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
DB07663 mol2, pdbqt 246,13 -2,63 355,301 1,0642 8 3 0 0,030106 0,528893331698404 BBB+ HIA+ Caco2-
DB07664 mol2, pdbqt 293,45 -4,009 425,443 2,5518 9 4 0 2,248 0,675897047137904 BBB+ HIA+ Caco2+
DB07665 mol2, pdbqt 328,95 -3,03 435,409 -0,0662 9 5 0 -7,0309 0,394492249672502 BBB+ HIA+ Caco2-
DB07666 mol2, pdbqt 308,03 -5,906 448,468 2,4879 6 1 0 -1,2401 0,312994707501404 BBB+ HIA+ Caco2-
DB07667 mol2, pdbqt 211,01 -4,513 270,287 3,689 5 2 0 -5,74 7,60732701524442E-02 BBB- HIA+ Caco2+
DB07668 mol2, pdbqt 203,02 -2,463 249,309 2,4436 4 2 0 2,4469 0,870698916312729 BBB- HIA+ Caco2+
DB07669 mol2, pdbqt 142,7 -3,09 186,209 2,3198 2 0 0 -2,54 0,480349870590701 BBB+ HIA+ Caco2+
DB07670 mol2, pdbqt 244,14 -3,663 327,407 1,728 5 0 0 -0,95248 0,530782997758251 BBB+ HIA+ Caco2+
DB07671 mol2, pdbqt 219,01 -4,191 282,295 2,4753 7 1 0 -15,838 0,393376125548775 BBB+ HIA+ Caco2-
DB07672 mol2, pdbqt 189,75 0,391 249,429 2,4584 2 0 0 -46,618 0,225280957177388 BBB+ HIA- Caco2+
DB07673 mol2, pdbqt 135,88 -2,024 164,203 1,8155 2 1 0 -0,3192 0,673485833734938 BBB+ HIA+ Caco2+
DB07674 mol2, pdbqt 130,62 -1,59 170,168 0,4324 3 1 0 -14,729 0,111718398450513 BBB+ HIA+ Caco2-
DB07675 mol2, pdbqt 323,48 -6,41 419,476 4,6292 6 1 0 -5,8999 0,205760533057343 BBB+ HIA+ Caco2-
DB07676 mol2, pdbqt 275,01 -2,556 365,388 1,7444 7 4 0 -1,4008 0,310478716992871 BBB+ HIA+ Caco2-
DB07677 mol2, pdbqt 132,63 -1,932 182,246 -0,1367 3 1 0 3,6072 0,951653902439999 BBB+ HIA+ Caco2+
DB07678 mol2, pdbqt 253,21 -5,198 326,478 5,4216 2 2 1 -2,856 0,151282476143991 BBB+ HIA+ Caco2+
DB07679 mol2, pdbqt 283,1 -2,988 362,424 1,4238 7 3 0 -14,458 0,426751848999768 BBB- HIA+ Caco2-
DB07680 mol2, pdbqt 291,76 -5,51 431,835 2,006 5 3 0 -7,2342 0,136524047004608 BBB+ HIA- Caco2-
DB07681 mol2, pdbqt 212,05 -2,908 250,401 3,2209 3 1 0 -27,528 0,427966930492696 BBB+ HIA+ Caco2-
DB07683 mol2, pdbqt 252,06 -4,33 363,457 2,8406 5 2 0 1,1168 0,507576626000966 BBB+ HIA+ Caco2-
Page 
 of 344
Records 5321 to 5340 of 6870
These data are only available for scientific research purposes.