Compounds

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ALA61403
Name:
6-(Hexadec-2-enoyl-hydroxy-amino)-2-{[2-(2-hydroxy-phenyl)-4,5-dihydro-oxazShow More⌵
Mol. Formula:
C45H71N5O10
M.W.:
842.09
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
6.76
Polar Surface Area:
207.40
HBA:
11
HBD:
5
#RO5 Violations:
3
#Rotatable Bonds:
27
Passes Ro3:
N
QED Weighted:
0.02
DETAILS
CLOSE
ALA303540
Name:
2-Hydroxy-N-{3-[hydroxy-(3-phenyl-acryloyl)-amino]-propyl}-2-({3-[hydroxy-(Show More⌵
Mol. Formula:
C30H36N4O9
M.W.:
596.64
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
1.46
Polar Surface Area:
196.81
HBA:
8
HBD:
6
#RO5 Violations:
2
#Rotatable Bonds:
17
Passes Ro3:
N
QED Weighted:
0.07
DETAILS
CLOSE
ALA303290
Name:
2-(3-Carboxy-3-hydroxy-4-{5-[hydroxy-(3-phenyl-acryloyl)-amino]-1-methoxycaShow More⌵
Mol. Formula:
C38H48N4O13
M.W.:
768.82
21 activity values
18 unique targets
Type:
Small molecule
AlogP:
2.10
Polar Surface Area:
249.41
HBA:
12
HBD:
6
#RO5 Violations:
3
#Rotatable Bonds:
23
Passes Ro3:
N
QED Weighted:
0.03
DETAILS
CLOSE
ALA63221
Name:
2-Hydroxy-N-{4-[hydroxy-(3-phenyl-acryloyl)-amino]-butyl}-2-({4-[hydroxy-(3Show More⌵
Mol. Formula:
C32H40N4O9
M.W.:
624.69
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
2.24
Polar Surface Area:
196.81
HBA:
8
HBD:
6
#RO5 Violations:
2
#Rotatable Bonds:
19
Passes Ro3:
N
QED Weighted:
0.06
DETAILS
CLOSE
ALA293172
Name:
2-Hydroxy-N-[3-(hydroxy-oct-2-enoyl-amino)-propyl]-2-{[3-(hydroxy-oct-2-enoShow More⌵
Mol. Formula:
C32H56N4O9
M.W.:
640.82
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
3.56
Polar Surface Area:
185.81
HBA:
9
HBD:
5
#RO5 Violations:
1
#Rotatable Bonds:
23
Passes Ro3:
N
QED Weighted:
0.04
DETAILS
CLOSE
ALA65682
Name:
2-Hydroxy-N-[3-(hydroxy-oct-2-enoyl-amino)-propyl]-2-{[3-(hydroxy-oct-2-enoShow More⌵
Mol. Formula:
C28H48N4O9
M.W.:
584.71
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
2.30
Polar Surface Area:
196.81
HBA:
8
HBD:
6
#RO5 Violations:
2
#Rotatable Bonds:
23
Passes Ro3:
N
QED Weighted:
0.05
DETAILS
CLOSE
ALA62318
Name:
2-Hydroxy-N-{3-[hydroxy-(3-phenyl-acryloyl)-amino]-propyl}-2-({3-[hydroxy-(Show More⌵
Mol. Formula:
C34H44N4O9
M.W.:
652.75
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
2.71
Polar Surface Area:
185.81
HBA:
9
HBD:
5
#RO5 Violations:
1
#Rotatable Bonds:
17
Passes Ro3:
N
QED Weighted:
0.06
DETAILS
CLOSE
ALA418656
Name:
Oct-2-enoic acid hydroxy-[3-(3-hydroxy-3-{[3-(hydroxy-oct-2-enoyl-amino)-prShow More⌵
Mol. Formula:
C28H46N4O8
M.W.:
566.70
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
2.47
Polar Surface Area:
167.79
HBA:
8
HBD:
4
#RO5 Violations:
1
#Rotatable Bonds:
20
Passes Ro3:
N
QED Weighted:
0.06
DETAILS
CLOSE