Page 
 of 6265
Records 901 to 920 of 125298
 
Download
Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
3875 3875.mol2, BDB-kin3875.pdbqt 164,1 43,84 -5,192 209,251 2,0443 3 1 0 0,83196 0,355112642007793
3876 3876.mol2, BDB-kin3876.pdbqt 154,34 30,71 -5,166 195,224 2,0036 3 0 0 0,98389 0,607341532138852
3877 3877.mol2, BDB-kin3877.pdbqt 173,78 55,29 -5,736 230,29 2,7871 3 0 0 1,8022 0,573700933353809
3878 3878.mol2, BDB-kin3878.pdbqt 173,78 55,29 -5,034 230,29 2,436 3 0 0 1,8447 0,657348091995258
3918 3918.mol2, BDB-kin3918.pdbqt 191,6 27,05 -5,434 238,289 3,0579 3 0 0 -1,0086 0,405120281715811
3919 3919.mol2, BDB-kin3919.pdbqt 205,36 27,05 -5,704 252,316 3,5123 3 0 0 -0,041709 0,4390082239248
3920 3920.mol2, BDB-kin3920.pdbqt 202,6 27,05 -5,812 252,316 3,4172 3 0 0 -0,1295 0,428173069958346
3921 3921.mol2, BDB-kin3921.pdbqt 219,12 27,05 -5,974 266,343 3,9667 3 0 0 -4,9773 0,162396962048854
3922 3922.mol2, BDB-kin3922.pdbqt 203,88 27,05 -5,643 250,3 3,3268 3 0 0 -5,0705 0,18246403069121
3923 3923.mol2, BDB-kin3923.pdbqt 226,97 47,28 -5,467 282,342 3,04 4 1 0 -8,2717 0,313922021660946
3924 3924.mol2, BDB-kin3924.pdbqt 209,75 39,58 -5,279 266,299 2,2674 4 0 0 -5,021 4,39425016554727E-02
3925 3925.mol2, BDB-kin3925.pdbqt 218,3 67,51 -4,798 284,314 1,5638 5 2 0 0,72893 0,6165844031691
3926 3926.mol2, BDB-kin3926.pdbqt 201,62 53,07 -5,003 253,304 1,7334 4 1 0 -1,185 0,442898529902124
3927 3927.mol2, BDB-kin3927.pdbqt 227,92 30,29 -4,557 281,358 2,3514 4 0 0 5,5225 0,750108420621554
3928 3928.mol2, BDB-kin3928.pdbqt 241,68 30,29 -4,827 295,385 2,8058 4 0 0 4,1749 0,698591540863566
3929 3929.mol2, BDB-kin3929.pdbqt 255,44 30,29 -5,097 309,412 3,2602 4 0 0 0,0081156 0,489143626402787
3930 3930.mol2, BDB-kin3930.pdbqt 254,94 39,52 -4,624 323,395 2,3204 5 0 0 2,6503 0,705493145887969
3931 3931.mol2, BDB-kin3931.pdbqt 268,7 39,52 -4,894 337,422 2,7748 5 0 0 2,0404 0,641690781475086
3932 3932.mol2, BDB-kin3932.pdbqt 282,46 39,52 -5,164 351,449 3,2292 5 0 0 -1,4329 0,374366735278667
3933 3933.mol2, BDB-kin3933.pdbqt 186,36 53,07 -5,21 239,277 1,9743 4 1 0 0,60559 9,85065142543915E-02
These data are only available for scientific research purposes.