• UNII FDA
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Records 52361 to 52380 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
76972550 526904F5EO mol2, pdbqt 310,95 0,16286 66,4 -4,09 337,502 5,5506 4 2 1 -24,885 0,274223607643097
76972552 K0FL9732DI mol2, pdbqt 1214 0,42849 678,15 -10,983 1808,12 -6,0094 43 24 3 0,33128 7,13716503396176E-02
76972557 ZOZ0RPZ001 mol2, pdbqt 198,91 0,13368 29,54 -1,876 227,347 2,0815 3 0 0 -1,7773 0,428744653766231
76972606 V2U66N03OH mol2, pdbqt 151,08 0,18778 46,25 -2,365 191,273 1,4095 2 2 0 0,55289 0,770089045177105
76972612 06F1BL6L7G mol2, pdbqt 146,49 0,52536 113,18 0,554 195,214 -3,1921 6 6 1 3,6685 0,973126312267861
76972622 DV74WJ5PJB mol2, pdbqt 191,81 0,26464 72,72 -1,79 239,314 1,2639 4 4 0 4,0634 0,94083444379827
76972649 1YEO6NB5V5 mol2, pdbqt 325,41 0,20841 100,05 -5,589 669,965 3,0647 5 2 1 -5,2826 6,83889095204679E-02
76972661 JAZ7ID45Z2 mol2, pdbqt 392,73 0,61202 339,59 -0,74 583,594 -7,6474 19 13 3 2,959 0,614219550587818
76972668 3VU333Q494 mol2, pdbqt 183,61 0,39333 89,9 -0,971 230,215 0,5341 6 1 0 -12,482 0,290103495309948
76972681 3KRN834K22 mol2, pdbqt 277,87 0,17116 51,66 -5,302 348,401 3,7069 5 0 0 2,5885 0,570795112441677
76972683 57Z93T54G5 mol2, pdbqt 244,3 0,22571 68,36 -2,242 325,411 0,8747 5 3 0 6,2554 0,545318447146222
76972707 438P29IEDO mol2, pdbqt 450,97 0,24059 126,41 -4,978 617,026 3,2386 10 2 1 -1,6802 0,241561596676194
76972708 5TW408347K mol2, pdbqt 165,09 0,15834 37,3 -2,822 198,305 2,9363 2 1 0 -6,1349 0,265766915023831
76972714 21G81IKJ8L mol2, pdbqt 1007,7 0,30699 393,75 -7,554 1237,51 4,367 25 10 3 -54,623 0,110794575691689
76972735 D2JUE6GD5A mol2, pdbqt 543,7 0,28532 193,91 -3,645 733,933 1,6719 14 5 2 11,291 0,466073257169356
76972744 F91E4BDR6S mol2, pdbqt 134,29 0,69119 141,28 0,564 195,146 -5,5714 7 5 0 0,30613 0,776573802939592
76972759 DNS84NJF1Q mol2, pdbqt 335,79 0,14619 60,88 -4,164 442,025 4,7381 4 1 0 8,9546 0,332210790027488
76972760 YTM71D696J mol2, pdbqt 96,48 0,70015 100,62 -0,151 133,103 -3,813 5 3 0 -11,987 0,495010353470141
76972783 W11ET455ZI mol2, pdbqt 219,71 0,13541 43,7 -2,856 285,386 2,5386 3 2 0 1,4042 0,791552239406296
76972805 JB87J72236 mol2, pdbqt 679,27 0,35918 308,51 -5,398 1001,12 -0,3092 21 9 3 -0,99515 0,222510400809831
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Records 52361 to 52380 of 55865
These data are only available for scientific research purposes.