Page 
 of 2794
Records 401 to 420 of 55865
 
PUBCHEM ID
UNII
Download
Total Surface Area
Relative PSA
TPSA
cLogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
Druglikeness
DrugScore
1669 JCH2767EDP mol2, pdbqt 137,91 0,27822 55,48 -1,41 167,207 0,6789 3 2 0 -1,877 0,550074503065652
1670 SO86T1OB2P mol2, pdbqt 160,75 0,40131 92,78 -1,263 211,216 -1,9649 5 3 0 -10,84 0,486472172549586
1672 VT819VO82Z mol2, pdbqt 85,56 0,29535 35,25 -0,444 89,1373 -0,3917 2 1 0 -2,2691 0,54083545362914
1674 214U33M1RL mol2, pdbqt 203,34 0 0 -7,33 268,358 6,0595 0 0 1 -3,45 4,93125610587804E-02
1676 DT7DT5E518 mol2, pdbqt 145,13 0,45511 78,09 -2,413 194,193 0,2966 6 2 0 5,7339 0,568325657675044
1678 QY4L0FOX0D mol2, pdbqt 102,1 0,68433 79,04 0,258 121,092 -1,7773 5 3 0 -4,2343 0,502889211067827
1679 9JL5O473RB mol2, pdbqt 117,33 0,45052 72,52 -2,216 150,137 0,5167 4 1 0 -1,374 0,2073412652037
1684 9H4570Q89D mol2, pdbqt 285,96 0,24874 74,18 -5,197 381,353 4,1096 6 0 0 -15,22 0,279869588177977
1686 6TC8H54C8T mol2, pdbqt 190,61 0,12088 26,3 -4,578 301,138 4,098 2 0 0 -1,5481 0,38630678559375
1687 M8CDT278F8 mol2, pdbqt 259,04 0,052309 12,47 -4,653 341,881 4,6693 2 0 0 2,1765 0,556432461556777
1688 2QW0IK1742 mol2, pdbqt 227,4 0,12357 32,67 -5,408 319,19 3,5906 3 0 0 3,8838 0,284465555653548
1697 Z13D008FZ2 mol2, pdbqt 249,16 0,24266 70,23 -5,143 329,358 3,8015 5 3 0 1,53 0,55601292523234
1715 EBY0ENK2GQ mol2, pdbqt 334,22 0,14251 58,08 -4 424,607 3,3318 4 0 0 7,3746 0,68186994087158
1725 63GK9KT599 mol2, pdbqt 110,61 0,41714 75,89 -0,961 135,169 -0,3294 3 3 0 -1,2915 0,358416279845465
1727 BH3B64OKL9 mol2, pdbqt 80,54 0,3258 38,91 -0,897 94,1166 -0,0186 2 1 0 -1,9084 0,556028334354897
1731 87045U29QJ mol2, pdbqt 101,38 0,25843 40,46 -1,76 144,557 1,5742 2 2 0 -2,05 0,115386386460738
1732 36W53O7109 mol2, pdbqt 107,29 0,1221 20,23 -2,4 142,585 2,2638 1 1 0 -2,0981 0,309394282399959
1738 X77S6GMS36 mol2, pdbqt 139,73 0,35239 66,76 -1,316 182,174 0,7271 4 2 0 -1,4675 0,576070618632642
1745 QD0132T507 mol2, pdbqt 81,7 0,46585 48,91 -0,339 98,1046 -0,7235 3 2 0 1,0775 0,864044082932746
1748 62MI76A89G mol2, pdbqt 137,91 0,27822 55,48 -1,41 167,207 0,6789 3 2 0 -1,877 0,550074503065652
These data are only available for scientific research purposes.