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Records 50221 to 50240 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
72710762 88Z1FKS5GS mol2, pdbqt 563,06 0,28189 191,45 -5,567 720,865 2,4442 14 6 3 -21,576 0,174934837376744
72710763 CI0NE7C96T mol2, pdbqt 229,82 0,40184 101,3 -2,19 314,308 -1,8021 10 1 0 -0,63202 0,622241005626427
72710764 RDJ125V8OM mol2, pdbqt 156,94 0,15649 32,26 -2,555 211,691 2,1235 2 2 0 3,1943 0,902135439404877
72710765 B3KYL5163W mol2, pdbqt 332,81 0,46432 198,48 -3,625 459,461 -2,8245 13 7 2 -6,5502 0,364416480865935
72710766 1VZZ62R081 mol2, pdbqt 332,81 0,46432 198,48 -3,625 459,461 -2,8245 13 7 2 -6,5502 0,364416480865935
72710767 66618465IO mol2, pdbqt 562,49 0,28207 188,29 -5,782 718,849 2,2319 14 5 2 -21,594 0,102083534883635
72710768 15Q9I448QT mol2, pdbqt 200,32 0,067642 12,47 -2,424 273,297 2,9635 2 0 0 -3,6455 0,451657453000492
72710769 97EDJ67519 mol2, pdbqt 251,63 0,25967 96,41 -3,133 349,425 0,939 4 1 0 0,62404 0,709925366356627
72710770 W36P44AVBI mol2, pdbqt 259,99 0,17693 57,22 -3,284 347,485 3,1115 3 1 0 5,1786 0,480723559170191
72710771 AL94VXC16J mol2, pdbqt 186,45 0,24259 65,99 -1,897 275,755 1,4172 4 1 0 3,4219 0,919847986359859
72710772 S548K9P0TK mol2, pdbqt 562,27 0,25902 180,08 -3,094 748,992 1,6569 14 5 2 13,854 0,48171615764111
72710773 Q71G788A6H mol2, pdbqt 279,53 0,2135 77,12 -3,46 343,469 3,2198 5 2 0 -8,7212 0,395006234870751
72710774 QCB63R9792 mol2, pdbqt 293,08 0,13948 44,12 -4,87 376,43 4,9719 4 0 0 -1,7784 0,299834017061412
72710775 IK0V72884Q mol2, pdbqt 262 0,22779 77,12 -2,77 357,412 1,8893 5 2 0 5,6217 0,858361125167465
72710776 FU44719P6T mol2, pdbqt 262 0,22779 77,12 -2,77 357,412 1,8893 5 2 0 5,6217 0,858361125167465
72710779 W23EFJ3KDD mol2, pdbqt 548,28 0,44806 321,63 1,462 723,738 -7,8877 21 9 3 -20,816 0,212608433116748
72710780 05P706177M mol2, pdbqt 214,38 0,283 75,15 -1,512 284,379 2,066 5 0 0 -2,1235 0,246171553104773
72710781 97D5ZA2SGH mol2, pdbqt 287,86 0,25596 84,02 -3,049 398,457 0,773 7 2 0 5,1211 0,493413237545422
72710782 8S6VL5XOO0 mol2, pdbqt 601,39 0,038311 26,3 -10,919 619,111 17,55 2 0 2 -33,967 7,47753489556224E-02
72710783 376667M5ZP mol2, pdbqt 601,39 0,038311 26,3 -10,919 619,111 17,55 2 0 2 -33,967 7,47753489556224E-02
These data are only available for scientific research purposes.