Molecular Weight

242.98

H-bond Acceptors

7

H-bond Donors

0

Rotors

5

LogP

-0.72

Chiral centers

0

Rings

0

Reactions

508

Reactive atoms

0

CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]
Tag Element Regiochemistry Product Substrate Enzyme
PTDBREC00101 C Regular 7-DMATS
PTDBREC00102 C Regular 7-DMATS
PTDBREC00103 C Regular 7-DMATS
PTDBREC00104 C Regular 7-DMATS
PTDBREC00105 C Regular 7-DMATS
PTDBREC00106 C Regular FgaPT2
PTDBREC00107 C Regular 7-DMATS
PTDBREC00108 C Regular FgaPT2
PTDBREC00109 C Regular FgaPT2
PTDBREC00110 C Regular FgaPT2
PTDBREC00111 C Regular FgaPT2
PTDBREC00112 C Regular FgaPT2
PTDBREC00113 C Regular FgaPT2
PTDBREC00114 C Regular FgaPT2
PTDBREC00115 C Regular FgaPT2
PTDBREC00116 C Regular FgaPT2
PTDBREC00117 C Regular FgaPT2
PTDBREC00118 C Regular FgaPT2
PTDBREC00119 C Regular FgaPT2
PTDBREC00120 C Regular FgaPT2
PTDBREC00121 C Regular FgaPT2
PTDBREC00122 C Regular FgaPT2
PTDBREC00123 C Regular FgaPT2
PTDBREC00124 C Regular 7-DMATS
PTDBREC00125 C Regular 7-DMATS
PTDBREC00126 C Regular 7-DMATS
PTDBREC00127 C Regular 7-DMATS
PTDBREC00128 C Regular FgaPT2
PTDBREC00129 C Regular 7-DMATS
PTDBREC00130 C Regular 7-DMATS
PTDBREC00131 C Regular 7-DMATS
PTDBREC00132 C Regular 7-DMATS
PTDBREC00133 C Regular 7-DMATS
PTDBREC00134 C Regular 7-DMATS
PTDBREC00135 C Regular 7-DMATS
PTDBREC00136 C Regular 7-DMATS
PTDBREC00137 C Regular 7-DMATS
PTDBREC00138 C Regular 7-DMATS
PTDBREC00139 C Regular FgaPT2
PTDBREC00140 C Regular 7-DMATS
PTDBREC00141 C Regular FgaPT2
PTDBREC00142 C Regular FgaPT2
PTDBREC00143 C Regular FgaPT2
PTDBREC00144 C Regular 4-DMATS
PTDBREC00145 C Regular FgaPT2
PTDBREC00146 C Regular FgaPT2
PTDBREC00147 C Reverse AnaPT
PTDBREC00148 C Regular PtfAt
PTDBREC00149 C Regular PtfBf
PTDBREC00150 C Regular PtfSs
PTDBREC00151 C Regular Fur7
PTDBREC00152 C Reverse Fur7
PTDBREC00153 C Regular 5-DMATS
PTDBREC00154 C Regular 5-DMATS
PTDBREC00155 C Regular 5-DMATS
PTDBREC00156 C Regular 5-DMATS
PTDBREC00157 C Regular 5-DMATS
PTDBREC00158 C Regular 5-DMATS
PTDBREC00159 C Regular 5-DMATS
PTDBREC00160 C Regular 5-DMATS
PTDBREC00161 C Regular 5-DMATS
PTDBREC00162 C Regular 5-DMATS
PTDBREC00163 C Regular 5-DMATS
PTDBREC00164 C Regular 5-DMATS
PTDBREC00165 C Regular FgaPT2
PTDBREC00166 C Regular FgaPT2
PTDBREC00167 C Regular FgaPT2_K174F
PTDBREC00168 C Regular FgaPT2
PTDBREC00169 C Regular FgaPT2_K174F
PTDBREC00170 N Regular FgaPT2
PTDBREC00171 N Regular FgaPT2_K174F
PTDBREC00224 O Regular AstPT
PTDBREC00225 O Regular AstPT
PTDBREC00226 O Regular AstPT
PTDBREC00231 O Regular AstPT
PTDBREC00232 O Regular AstPT
PTDBREC00237 C Regular FgaPT2
PTDBREC00238 C Regular 5-DMATS
PTDBREC00239 C Regular 5-DMATS
PTDBREC00240 C Regular 5-DMATS
PTDBREC00241 C Regular FgaPT2
PTDBREC00242 C Regular 5-DMATS
PTDBREC00243 C Regular FgaPT2
PTDBREC00244 C Regular 5-DMATS
PTDBREC00245 C Regular 7-DMATS
PTDBREC00246 O Regular SirD
PTDBREC00247 O Regular 7-DMATS
PTDBREC00248 O Regular 7-DMATS
PTDBREC00249 O Regular 7-DMATS
PTDBREC00250 O Regular SirD
PTDBREC00251 N Regular 7-DMATS
PTDBREC00252 O Regular 7-DMATS
PTDBREC00253 O Regular 7-DMATS
PTDBREC00254 O Regular 7-DMATS
PTDBREC00255 C Regular SirD
PTDBREC00256 N Regular SirD
PTDBREC00257 O Regular SirD
PTDBREC00258 C Regular 4-DMATS
PTDBREC00259 C Regular FgaPT2
PTDBREC00260 C Reverse FgaPT1