• UNII FDA
Page 
 of 2794
Records 301 to 320 of 55865
 
PUBCHEM ID
UNII
Download
Total Surface Area
Relative PSA
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
1091 F6A27P4Q4R mol2, pdbqt 39,24 1 57,53 0,446 128,973 -3,1074 3 2 0 -5,8375 0,29845232292151
1099 15744271E9 mol2, pdbqt 48,92 1 76,74 -0,935 82,0789 -3,1074 3 2 0 -2,39 0,321326668459149
1100 J1P7893F4J mol2, pdbqt 48,92 1 76,74 -0,935 82,0789 -3,1074 3 2 0 -2,39 0,321326668459149
1102 U87FK77H25 mol2, pdbqt 138,32 0,30364 64,07 -0,717 145,249 -0,8753 3 3 0 -5,5 0,296665586980538
1103 2FZ7Y3VOQX mol2, pdbqt 191,06 0,27981 76,1 -0,772 202,344 -0,9876 4 4 0 -5,3518 0,294789774982971
1110 AB6MNQ6J6L mol2, pdbqt 89,22 0,58597 74,6 -0,474 118,088 -0,6666 4 2 0 -2,8683 0,187379935189754
1112 M73BX3CPMU mol2, pdbqt 84,66 0,46279 54,37 -0,707 102,089 -0,5293 3 1 0 -4,905 0,17899375698649
1117 7IS9N8KPMG mol2, pdbqt 54,78 1 82,98 1,524 98,0779 -3,4103 4 2 0 -2,0209 7,20337002000834E-02
1118 O40UQP6WCF mol2, pdbqt 54,78 1 82,98 1,524 98,0779 -3,4103 4 2 0 -2,0209 7,20337002000834E-02
1119 0UZA3422Q4 mol2, pdbqt 26,08 1 34,14 -0,138 64,064 -1,0516 2 0 0 -2,555 6,89398141511712E-02
1127 744EHT13FM mol2, pdbqt 72,53 0,24114 25,3 -1,677 88,1735 0,9529 0 0 0 -2,6908 0,516186158381559
1130 4ABT0J945J mol2, pdbqt 208,56 0,37179 105,2 -0,761 265,36 0,5844 5 2 0 1,1264 0,50501057664637
1133 7857H94KHM mol2, pdbqt 67,22 0,72523 76,1 -1,116 92,1178 -0,3663 2 1 0 -5,9606 0,295944732343363
1135 QR26YLT7LT mol2, pdbqt 95,39 0,51368 58,2 -1,376 126,115 -0,601 4 2 0 2,2627 0,560120781503881
1136 3XYV4I47I8 mol2, pdbqt 114,09 0,38943 61,36 -1,083 143,209 0,7498 2 1 0 -0,43999 0,407744256018319
1140 3FPU23BG52 mol2, pdbqt 85,52 0 0 -1,96 92,1405 2,0035 0 0 0 -2,4599 0,066432411896103
1145 FLD0K1SJ1A mol2, pdbqt 62,45 0,086789 17,07 2,362 76,1184 -1,0212 2 1 0 -6,0245 0,498904312723713
1146 LHH7G8O305 mol2, pdbqt 60,58 0,0586 3,24 0,193 59,1115 -0,1356 1 0 0 -3,605 0,305424132909155
1147 8U5M0SJV65 mol2, pdbqt 57,03 0 0 -1,826 78,1784 0,4185 0 0 0 -1,9719 0,545318912932019
1148 X9U7434L7A mol2, pdbqt 156,31 0,35442 79,11 -2,066 204,228 -1,5098 4 3 0 -10,243 0,480226096575501
Page 
 of 2794
Records 301 to 320 of 55865
These data are only available for scientific research purposes.