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Records 2841 to 2860 of 4258
 
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Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
50092791 BDB-kin50094476.mol2, BDB-kin50094476.pdbqt 286,04 83,14 -4,61 377,447 1,8613 7 2 0 0,18657 0,547887713739937
50092792 BDB-kin50098126.mol2, BDB-kin50098126.pdbqt 303,15 87,58 -4,454 396,489 2,0978 7 2 0 -0,81675 0,461340261884667
50092793 BDB-kin50103898.mol2, BDB-kin50103898.pdbqt 303,15 87,58 -4,454 396,489 2,0978 7 2 0 -0,94324 0,452085716219839
50093068 BDB-kin50108116.mol2, BDB-kin50108116.pdbqt 317,54 125,05 -2,928 421,464 -0,6492 11 2 1 5,0112 0,807606749237573
50093069 BDB-kin50108117.mol2, BDB-kin50108117.pdbqt 305,98 121,81 -4,175 406,449 0,2684 10 2 0 1,7686 0,686400327689486
50093070 BDB-kin50119606.mol2, BDB-kin50119606.pdbqt 330,74 121,81 -4,793 434,502 1,0082 10 2 0 4,5558 0,645056877365872
50093071 BDB-kin50119608.mol2, BDB-kin50119608.pdbqt 330,74 121,81 -4,793 434,502 1,0082 10 2 0 4,5558 0,645056877365872
50093072 BDB-kin50119609.mol2, BDB-kin50119609.pdbqt 316,98 121,81 -4,741 420,476 0,8135 10 2 0 4,1871 0,663418706449701
50093073 BDB-kin50119610.mol2, BDB-kin50119610.pdbqt 316,98 121,81 -4,741 420,476 0,8135 10 2 0 4,1871 0,663418706449701
50093074 BDB-kin50119611.mol2, BDB-kin50119611.pdbqt 316,98 121,81 -4,741 420,476 0,8135 10 2 0 3,5543 0,659126413332591
50093075 BDB-kin50119612.mol2, BDB-kin50119612.pdbqt 301,07 132,81 -4,613 406,449 0,3856 10 3 0 3,8831 0,689384932259778
50093076 BDB-kin50119613.mol2, BDB-kin50119613.pdbqt 301,07 132,81 -4,613 406,449 0,3856 10 3 0 3,8831 0,689384932259778
50093077 BDB-kin50119614.mol2, BDB-kin50119614.pdbqt 292,22 121,81 -4,123 392,422 0,0737 10 2 0 0,72796 0,634878885908473
50093078 BDB-kin50119615.mol2, BDB-kin50119615.pdbqt 265,2 112,58 -4,116 350,385 0,4476 9 2 0 2,973 0,769696349261367
50093079 BDB-kin50119616.mol2, BDB-kin50119616.pdbqt 277,96 121,81 -3,359 366,384 -0,4105 10 2 0 4,9383 0,837017675804186
50093080 BDB-kin50119617.mol2, BDB-kin50119617.pdbqt 277,96 121,81 -3,359 366,384 -0,4105 10 2 0 4,805 0,836594976752086
50093081 BDB-kin50119618.mol2, BDB-kin50119618.pdbqt 254,2 112,58 -3,738 336,358 0,0883 9 2 0 6,1797 0,66482400356714
50093082 BDB-kin50119619.mol2, BDB-kin50119619.pdbqt 254,2 112,58 -3,738 336,358 0,0883 9 2 0 5,1957 0,829597889475854
50094473 BDB-kin50119620.mol2, BDB-kin50119620.pdbqt 338,77 123,88 -0,241 446,517 0,9776 11 1 1 3,8471 0,290980234681537
50094476 BDB-kin50119621.mol2, BDB-kin50119621.pdbqt 349,79 136,77 -0,912 461,532 1,0202 12 1 1 2,6596 0,276042466797958
These data are only available for scientific research purposes.