• UNII FDA
Page 
 of 2794
Records 1241 to 1260 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
4462 JR17826E4G mol2, pdbqt 201,11 0,22913 52,6 -2,07 250,293 2,5384 4 0 0 0,74833 0,767281662776046
4463 99DK7FVK1H mol2, pdbqt 195,33 0,25593 58,12 -4,666 266,303 1,9589 5 1 0 2,0996 0,710253747968234
4472 T2Q0RYM725 mol2, pdbqt 242,94 0,29402 83,12 -2,423 298,345 0,0724 6 3 0 3,4317 0,326709080775383
4474 CZ5312222S mol2, pdbqt 382,42 0,2741 109,61 -4,154 481,547 1,8812 9 3 0 4,8031 0,644204958966839
4476 F54EHJ34MV mol2, pdbqt 424,03 0,32083 156,76 -2,703 556,53 2,2189 12 0 2 -1,0217 0,313226150960454
4477 8KK8CQ2K8G mol2, pdbqt 236,4 0,34404 91,07 -4,94 329,138 3,0748 6 4 0 -1,8263 0,146229150920676
4485 I9ZF7L6G2L mol2, pdbqt 271,08 0,37358 106,37 -3,408 348,354 1,8771 8 3 0 0,96185 0,718399265053316
4486 5VZ7GZM43E mol2, pdbqt 326,5 0,32165 117,86 -3,068 407,469 -0,622 10 4 0 -0,86804 0,318419666946775
4487 8780F0K71U mol2, pdbqt 233,28 0,23838 65,54 -2,069 308,34 0,5354 6 1 0 4,8899 0,3317480838408
4488 4U5MP5IUD8 mol2, pdbqt 196,8 0,2468 62,22 -3,715 282,22 2,8739 4 2 0 -8,0595 0,244670622623404
4493 51G6I8B902 mol2, pdbqt 218,39 0,38839 91,15 -4,142 319,238 1,5048 7 3 0 -4,989 0,400485540262206
4494 0214FUT37J mol2, pdbqt 305,29 0,37613 130,16 -4,234 387,391 1,8883 9 3 0 -9,6232 0,369388122672232
4495 V4TKW1454M mol2, pdbqt 232,3 0,40366 105,52 -5,636 310,329 1,5053 7 3 0 -3,2946 0,327444918093617
4496 4532264KW6 mol2, pdbqt 233,54 0,30757 74,41 -4,572 297,313 1,78 6 2 0 1,2594 0,403189169770667
4497 57WA9QZ5WH mol2, pdbqt 333,36 0,33378 115,6 -4,007 420,46 2,5502 9 3 0 -4,875 0,216141070704102
4498 1U1QTN40SY mol2, pdbqt 103,1 0,36469 49,33 -0,76 129,158 -2,3259 3 2 0 -0,57306 0,671315629016081
4499 4I8HAB65SZ mol2, pdbqt 309,6 0,3271 106,37 -4,138 390,434 2,9561 8 3 0 0,816 0,364630592935454
4500 17NV064B2D mol2, pdbqt 229,02 0,13737 30,49 -2,801 271,359 2,7058 3 1 0 1,717 0,812235908040096
4501 933301178Z mol2, pdbqt 255,51 0,18344 41,85 -5,944 348,377 4,4686 5 0 0 -1,3042 0,176630314888667
4506 9CLV70W7HS mol2, pdbqt 222,44 0,35848 83,2 -4,596 283,286 1,4217 6 3 0 0,14153 0,350837408074826
Page 
 of 2794
Records 1241 to 1260 of 55865
These data are only available for scientific research purposes.