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ADMET for phenolic compounds
Mra Y enzyme
Mur A enzyme
Mur B enzyme
Mur C enzyme
Mur D enzyme
Mur E enzyme
Mur F enzyme
Mur G enzyme
Mur I enzyme, head-head dimer, site 1
Mur I enzyme, head-head dimer, site 2
Mur I enzyme, tail-tail dimer
ADMET for phenolic compounds
Mra Y enzyme
Mur A enzyme
Mur B enzyme
Mur C enzyme
Mur D enzyme
Mur E enzyme
Mur F enzyme
Mur G enzyme
Mur I enzyme, head-head dimer, site 1
Mur I enzyme, head-head dimer, site 2
Mur I enzyme, tail-tail dimer
ADMET
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Records 466 to 480 of 931
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Molecule Name
Refractivity
TPSA
LogS
MW
cLogP
H-Acceptors
H-Donors
Ro5 violations
DrugScore
Druglikeness
PE000477
137
320
-1
618
-6
18
10
3
0
-20
PE000478
88
154
-2
368
0
9
5
0
1
-1
PE000479
88
154
-2
368
0
9
5
0
1
-1
PE000480
88
154
-2
368
0
9
5
0
1
-1
PE000481
94
163
-2
398
-1
10
5
0
1
-1
PE000482
94
163
-2
398
-1
10
5
0
1
-1
PE000483
94
163
-2
398
-1
10
5
0
1
-1
PE000484
127
211
-3
516
1
12
7
3
0
-1
PE000485
52
67
-2
194
1
4
2
0
1
0
PE000486
79
157
-1
342
-1
9
6
1
0
-6
PE000487
77
137
-2
326
-1
8
5
0
0
-3
PE000488
79
157
-1
342
-1
9
6
1
0
-3
PE000489
84
146
-2
356
-1
9
5
0
0
-3
PE000491
55
47
-2
192
2
3
1
0
0
-8
PE000492
70
162
-1
312
-1
9
5
0
1
-2
These data are only available for scientific research purposes.