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Records 3101 to 3120 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50308144 BDB-kin50308773.mol2, BDB-kin50308773.pdbqt 365,67 104,74 -6,254 475,551 3,178 10 2 0 1,7466 0,053637686921531
50308145 BDB-kin50308774.mol2, BDB-kin50308774.pdbqt 368,83 104,74 -6,646 495,969 3,4401 10 2 0 1,8467 4,84289206995635E-02
50308146 BDB-kin50308775.mol2, BDB-kin50308775.pdbqt 366,11 104,74 -6,538 497,505 3,0357 10 2 0 0,45793 4,34930436500568E-02
50308147 BDB-kin50308776.mol2, BDB-kin50308776.pdbqt 373,52 124,97 -5,794 491,55 2,2368 11 3 1 1,7191 5,81041412244305E-02
50308148 BDB-kin50308777.mol2, BDB-kin50308777.pdbqt 387,28 124,97 -5,906 505,577 2,6669 11 3 2 -0,16347 4,31594774375631E-02
50308149 BDB-kin50308778.mol2, BDB-kin50308778.pdbqt 349,35 132,98 -5,96 467,553 2,8081 10 2 0 2,6718 6,06881864838753E-02
50308150 BDB-kin50308779.mol2, BDB-kin50308779.pdbqt 352,17 117,63 -5,115 462,512 1,8332 11 2 1 1,7979 6,98796033883523E-02
50308151 BDB-kin50308780.mol2, BDB-kin50308780.pdbqt 352,17 117,63 -5,115 462,512 1,8332 11 2 1 1,7979 6,98796033883523E-02
50308152 BDB-kin50308781.mol2, BDB-kin50308781.pdbqt 350,93 130,52 -4,664 463,501 1,0043 12 2 1 1,7979 7,59212041727706E-02
50308153 BDB-kin50308782.mol2, BDB-kin50308782.pdbqt 393,42 131,04 -6,051 519,56 2,7471 12 2 2 -0,47575 3,87380896700219E-02
50308154 BDB-kin50308783.mol2, BDB-kin50308783.pdbqt 377,51 142,04 -5,923 505,533 2,3192 12 3 2 1,7543 5,53431689006707E-02
50308155 BDB-kin50308784.mol2, BDB-kin50308784.pdbqt 394,88 133,84 -5,915 518,576 2,2729 12 3 2 3,2543 5,72543361507233E-02
50308156 BDB-kin50308785.mol2, BDB-kin50308785.pdbqt 444,96 137,08 -5,338 575,672 1,9727 13 3 2 5,0312 5,75238849964357E-02
50308767 BDB-kin50308786.mol2, BDB-kin50308786.pdbqt 432,3 133,64 -5,627 570,656 2,3711 13 2 2 3,7721 0,418618233630651
50308768 BDB-kin50308787.mol2, BDB-kin50308787.pdbqt 338,91 122,98 -5,62 445,486 1,5865 11 2 1 -1,5989 0,321558712731975
50308769 BDB-kin50308788.mol2, BDB-kin50308788.pdbqt 349,91 122,98 -5,535 459,513 2,0739 11 2 1 -1,7143 0,31131208692952
50308770 BDB-kin50308789.mol2, BDB-kin50308789.pdbqt 339,41 122,98 -5,621 457,497 2,1483 11 2 1 -1,3523 0,321402931389896
50308771 BDB-kin50308790.mol2, BDB-kin50308790.pdbqt 338,91 122,98 -5,62 445,486 1,5865 11 2 1 -1,5989 0,321558712731975
50308772 BDB-kin50308791.mol2, BDB-kin50308791.pdbqt 349,91 122,98 -5,535 459,513 2,0739 11 2 1 -1,7143 0,31131208692952
50308773 BDB-kin50308792.mol2, BDB-kin50308792.pdbqt 325,15 122,98 -5,615 431,459 1,3305 11 2 1 -1,5553 0,33189832744823
These data are only available for scientific research purposes.