• UNII FDA
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Records 53321 to 53340 of 55865
 
PUBCHEM ID
UNII
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Total Surface Area
Relative PSA
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
90479370 6LB11K0X2N mol2, pdbqt 226,17 0 0 -7,872 548,692 6,9448 0 0 2 -3,9741 3,93449402656287E-02
90479372 8JJC99KHGL mol2, pdbqt 275,37 0,14944 52,57 -4,243 354,492 2,8858 4 2 0 3,3677 0,723774134538109
90479374 2K30142185 mol2, pdbqt 2931,6 0,45593 1794,9 -5,524 3822,5 -27,872 106 64 3 4,0298 0,339983863687371
90479386 Z8E5581IUG mol2, pdbqt 136,22 0,20592 32,34 -1,026 170,255 1,1712 3 1 0 0,063466 0,735980837631611
90479390 N7D0542X6L mol2, pdbqt 248,11 0,15163 45,59 -3,097 324,423 2,6104 4 1 0 0,87864 0,722965631598309
90479391 B34E0338PZ mol2, pdbqt 225,94 0,40896 117,84 -1,242 316,305 -0,8154 8 4 0 -4,4817 0,474292533410638
90479394 220D1ADD8Q mol2, pdbqt 64,56 0,60688 54,37 0,252 128,909 -2,3424 3 1 0 -2,5375 0,340470680979499
90479398 IB826O2414 mol2, pdbqt 1953,6 0,37242 1046,4 -10,818 2696,16 -5,5668 58 46 3 -7,6284 6,02063671133865E-02
90479402 3QE6HU601V mol2, pdbqt 327,32 0,13091 63,93 -4,295 446,693 2,5114 4 3 0 6,1673 0,663374733062872
90479404 4R60QXK7HW mol2, pdbqt 301,67 0,098618 43,7 -4,763 413,643 4,2764 3 2 0 0,18027 0,350271345170791
90479405 1J9VRR14LW mol2, pdbqt 327,04 0,17343 77,54 -2,53 443,634 3,8126 5 0 0 10,199 0,423391827716797
90479406 94FE4SA1S5 mol2, pdbqt 256,92 0,25448 94,83 -3,477 380,454 1,3404 5 3 0 0,82261 0,413145258531317
90479416 Y19P95P85D mol2, pdbqt 1063,6 0,41292 569,18 -9,292 1544,96 -7,415 36 20 3 2,4306 0,243128622921754
90479418 PLB0L4978Y mol2, pdbqt 464,75 0,31882 192,52 -4,158 693,828 1,2564 13 5 2 4,0407 0,453223418280827
90479419 US47C3O4GK mol2, pdbqt 33,03 0 0 -0,53 127,908 0 0 0 0 -1 0,625193730932556
90479422 IP8V70N015 mol2, pdbqt 210,99 0,48358 136,76 1,001 294,279 -4,1803 9 4 0 -2,4531 0,517871329762959
90479424 0WU4R69L0L mol2, pdbqt 207,54 0 0 -7,038 469,796 6,2196 0 0 1 -3,9741 0,138578973462144
90479437 7TO1561517 mol2, pdbqt 375,66 0,14644 52,19 -4,066 480,647 4,9095 6 1 0 3,8313 0,18141542095977
90479440 Q667EQ6N28 mol2, pdbqt 262,93 0,19724 64,79 -2,714 308,42 2,6528 5 1 0 2,8458 0,182892678418171
90479444 BTV2R9I8D4 mol2, pdbqt 547,62 0,26964 197,12 -5,822 722,825 5,0438 12 5 3 -7,2774 0,129411051611079
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Records 53321 to 53340 of 55865
These data are only available for scientific research purposes.