• UNII FDA
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Records 50061 to 50080 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
71772025 JZQ040RJ2O mol2, pdbqt 234,1 0,29551 82,06 -3,309 320,34 1,4812 6 1 0 -6,2518 0,431700627106896
71772208 HN7Q687K39 mol2, pdbqt 252,39 0,23705 73,32 -2,736 361,372 -0,3426 7 1 0 5,7723 0,524151495694792
71772237 FS036O58S9 mol2, pdbqt 190,73 0,18854 41,13 -2,735 220,315 1,9542 3 2 0 5,1726 0,913065854742806
71773169 1SU114WXBX mol2, pdbqt 736,75 0,4557 453,28 -2,567 1129,16 -5,8914 28 17 3 -9,1928 0,24006202606333
71774459 5EAR4ERR1L mol2, pdbqt 65,04 0,15375 9,23 -0,991 72,1065 0,546 1 0 0 -8,2624 0,106137788709457
71777151 75DNR1UL8R mol2, pdbqt 184,61 0,1982 38,77 -2,782 235,282 1,7494 4 0 0 3,8404 0,542929715110809
71777427 H77T9T95MQ mol2, pdbqt 206,75 0,49838 147,32 -0,08 279,288 -4,4524 8 6 1 1,221 0,853704920990702
71777631 V68I8147P0 mol2, pdbqt 82,19 0,20258 23,47 0,4 89,1373 -0,656 2 1 0 1,7184 0,916977883623503
71811909 VA101M0K2F mol2, pdbqt 357,54 0,36964 159,3 -2,411 474,445 0,5476 11 3 1 -36,992 0,378066845934121
71811910 G69Z98951Q mol2, pdbqt 399,31 0,16063 87,03 -6,765 554,719 5,7508 5 1 2 -19,968 0,126912344484046
71812246 6W2049SJPH mol2, pdbqt 226,76 0,21948 64,35 -2,988 280,342 1,8452 4 2 0 -0,065874 0,660888972554608
71816169 CO7LOC5EV6 mol2, pdbqt 154,3 0,17576 47,58 -3,034 164,251 2,8542 2 0 0 -5,5028 0,26557439830149
71816170 K0XE496L98 mol2, pdbqt 193,51 0,53635 157,24 -1,587 249,334 -5,3034 6 4 0 -15,869 0,480440194803361
71816262 W0XTQ82Z4P mol2, pdbqt 267,26 0,097807 37,3 -4,669 284,482 6,7352 2 1 1 -14,316 0,219435489431548
71816315 I8IX7L4V51 mol2, pdbqt 272,43 0,15593 43,71 -3,799 316,375 3,6325 4 0 0 -10,1 0,377552454254073
71940264 U85527QJRL mol2, pdbqt 239,34 0,38184 123,94 -2,728 334,351 1,3028 7 2 0 5,0998 0,882317199194175
71954678 2N9562JWVL mol2, pdbqt 210,18 0,46346 145,3 -4,159 291,334 1,2712 7 3 0 -9,8536 5,23388877544083E-02
71954679 ZI73U93388 mol2, pdbqt 333,68 0,15338 61,32 -4,573 446,013 4,6495 5 0 0 8,4194 0,316398359663201
71954680 SW9AYG2XI2 mol2, pdbqt 450,6 0,40564 238,41 -2,535 588,664 -2,6641 15 7 3 6,5947 0,603109966137963
72165228 L1F3R18W77 mol2, pdbqt 314,54 0,27685 103,37 -4,803 449,844 3,7985 8 3 0 0,64636 0,107566830453779
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Records 50061 to 50080 of 55865
These data are only available for scientific research purposes.