Page 
 of 6265
Records 581 to 600 of 125298
 
Download
Total Surface Area
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
3534 3534.mol2, BDB-kin3534.pdbqt 250,58 56,27 -5,03 349,311 4,0034 5 1 0 -8,0642 0,300185673843132
3535 3535.mol2, BDB-kin3535.pdbqt 218,95 49,84 -5,11 329,2 3,6673 4 2 0 -1,7635 0,356407749196049
3536 3536.mol2, BDB-kin3536.pdbqt 230,05 41,05 -5,086 343,227 3,9167 4 1 0 -1,156 0,373729763666765
3537 3537.mol2, BDB-kin3537.pdbqt 246,7 76,14 -5,707 373,209 3,9272 6 2 0 -5,9881 0,264839240190493
3538 3538.mol2, BDB-kin3538.pdbqt 201,58 58,04 -4,754 316,157 3,6746 4 2 0 -2,7556 0,351848982962309
3539 3539.mol2, BDB-kin3539.pdbqt 236,7 66,91 -5,392 357,21 3,724 5 2 0 -1,3571 0,133539811890801
3540 3540.mol2, BDB-kin3540.pdbqt 218,95 49,84 -5,11 329,2 3,6673 4 2 0 -1,7635 0,356407749196049
3541 3541.mol2, BDB-kin3541.pdbqt 232,71 49,84 -5,41 343,227 4,0736 4 2 0 -2,095 0,310996500705158
3542 3542.mol2, BDB-kin3542.pdbqt 230,05 41,05 -5,086 343,227 3,9167 4 1 0 -1,156 0,373729763666765
3544 3544.mol2, BDB-kin3544.pdbqt 227,47 75,86 -5,186 344,215 2,99 5 3 0 -1,8795 0,361358821875249
3545 3545.mol2, BDB-kin3545.pdbqt 238,57 67,07 -5,162 358,242 3,2394 5 2 0 -1,2608 0,380948131304817
3546 3546.mol2, BDB-kin3546.pdbqt 226,01 73,06 -5,144 345,199 3,273 5 2 0 -2,7442 0,267689934121375
3547 3547.mol2, BDB-kin3547.pdbqt 219,17 63,83 -5,862 349,618 3,949 4 2 0 -2,6372 0,279814868840779
3548 3548.mol2, BDB-kin3548.pdbqt 227,42 109,65 -5,586 360,17 2,4214 7 2 0 -8,1221 0,301747205382225
3549 3549.mol2, BDB-kin3549.pdbqt 242,62 95,66 -5,57 374,197 2,7457 7 2 0 -7,2642 0,295020103080362
3550 3550.mol2, BDB-kin3550.pdbqt 253,72 86,87 -5,546 388,224 2,9951 7 1 0 -6,6044 0,288495627565775
3551 3551.mol2, BDB-kin3551.pdbqt 260,37 112,73 -5,852 402,207 2,8024 8 2 0 -6,515 0,163490462410585
3552 3552.mol2, BDB-kin3552.pdbqt 241,16 92,86 -5,528 375,181 3,0287 7 1 0 -7,9537 0,292494319236577
3553 3553.mol2, BDB-kin3553.pdbqt 234,32 83,63 -6,246 379,601 3,7047 6 1 0 -7,9877 0,247017425111256
3554 3554.mol2, BDB-kin3554.pdbqt 215,49 56,27 -5,761 344,167 4,1317 5 1 0 -2,9097 0,275680763855232
These data are only available for scientific research purposes.