• UNII FDA
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Records 52901 to 52920 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
87557624 PBB037F59E mol2, pdbqt 143,19 0,53621 103,7 -0,619 189,166 -1,2236 6 3 0 -14,605 0,490603515333808
87573553 W6KRW1503I mol2, pdbqt 317,93 0,10392 35,53 -5,602 342,561 7,9428 3 0 1 -12,12 0,16604245869316
87621744 PAQNKVLQHJ mol2, pdbqt 256,02 0,22197 66,9 -3,599 356,46 1,9651 4 1 0 2,9557 0,793652339674434
87644603 73N2Y8F3D0 mol2, pdbqt 336,17 0,068537 26,3 -5,451 350,584 8,4282 2 0 1 -26,109 7,98326371304018E-02
87665603 0P5DNO7CEF mol2, pdbqt 745,35 0,42673 416,27 -4,415 994,202 -3,3043 23 11 3 6,6671 0,411329997594734
87695289 1DW53MUK4M mol2, pdbqt 293,27 0,14696 47,92 -3,048 318,496 4,2219 4 1 0 -35,89 0,180012192413482
87747876 2RS3YUM82C mol2, pdbqt 523,17 0,18824 133,52 -7,241 656,897 8,9069 8 4 2 -8,7177 2,84750343999521E-02
87748487 2C3051I0BG mol2, pdbqt 293,46 0,089075 37,3 -4,407 304,472 6,8713 2 1 1 -19,111 0,222745833553308
87800810 4NIU4R914C mol2, pdbqt 364,38 0,29225 125,39 -3,746 483,958 1,4906 10 3 0 0,94876 0,583442338317619
87833701 QF2Z2J9D7K mol2, pdbqt 96,01 0,71336 102,59 1,534 141,063 -6,2446 5 3 0 -21,727 0,496313503008759
87837286 INU1I5I7Q2 mol2, pdbqt 390,32 0,31359 141,32 -3,482 518,705 2,1456 9 2 1 5,5612 0,638045631812486
87891521 AX442PL270 mol2, pdbqt 264,11 0,37837 114,82 -2,099 382,407 -0,3469 8 2 0 0,91199 9,73045858374802E-02
87891888 7GMX194D52 mol2, pdbqt 129,07 0,58402 104,06 -0,104 178,139 -1,876 6 3 0 -8,5889 0,492854818832664
87949193 W9Y8L7GP4C mol2, pdbqt 1088,4 0,35317 498,17 -9,273 1431,06 -0,7136 31 16 3 0,31496 0,199647799386301
88101405 M2U9M12FYT mol2, pdbqt 252,75 0,15525 57,53 -3,883 340,461 2,6532 3 2 0 2,3859 0,7515251721617
88101676 R692A136KC mol2, pdbqt 169,12 0,58231 133,52 -0,114 250,202 -3,2629 8 4 0 -2,2323 0,53333312830398
88131335 B4Z1OE5V6N mol2, pdbqt 168,12 0,077564 17,07 -2,894 168,279 3,6756 1 0 0 -17,802 9,05731830557432E-02
88154879 7412507DY1 mol2, pdbqt 88,84 0,44169 57,53 -0,873 168,974 -0,5062 3 2 0 -5,9844 0,106204000950554
88155541 P2F269FOVL mol2, pdbqt 407,06 0,31946 177,58 -6,198 452,693 3,539 10 6 1 -11,143 0,228504542944357
88163056 UDN15LS88T mol2, pdbqt 229,62 0,42949 150,25 -1,385 273,379 -2,1417 7 5 0 -3,7762 0,488707428770204
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Records 52901 to 52920 of 55865
These data are only available for scientific research purposes.