Compounds

Select all

ALA2022675
Name:
4-(4-((S)-1-((S)-1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-ylamino)-3-(4-hyShow More⌵
Mol. Formula:
C32H36N4O8
M.W.:
604.66
4 activity values
4 unique targets
Type:
Small molecule
AlogP:
2.46
Polar Surface Area:
197.15
HBA:
8
HBD:
6
#RO5 Violations:
2
#Rotatable Bonds:
15
Passes Ro3:
N
QED Weighted:
0.11
DETAILS
CLOSE
ALA2022674
Name:
4-(4-((S)-1-((S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-ylamino)-3-(4-hydrShow More⌵
Mol. Formula:
C34H37N5O7
M.W.:
627.70
4 activity values
4 unique targets
Type:
Small molecule
AlogP:
3.24
Polar Surface Area:
192.71
HBA:
7
HBD:
6
#RO5 Violations:
2
#Rotatable Bonds:
15
Passes Ro3:
N
QED Weighted:
0.09
DETAILS
CLOSE
ALA2022673
Name:
4-(4-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan-2-ylamino)-3-(4-hydroxyphenylShow More⌵
Mol. Formula:
C32H36N4O7
M.W.:
588.66
4 activity values
4 unique targets
Type:
Small molecule
AlogP:
2.76
Polar Surface Area:
176.92
HBA:
7
HBD:
5
#RO5 Violations:
1
#Rotatable Bonds:
15
Passes Ro3:
N
QED Weighted:
0.13
DETAILS
CLOSE
ALA2022489
Name:
4-(4-((S)-1-((S)-1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-ylamino)-3-(1H-iShow More⌵
Mol. Formula:
C34H37N5O7
M.W.:
627.70
4 activity values
4 unique targets
Type:
Small molecule
AlogP:
3.24
Polar Surface Area:
192.71
HBA:
7
HBD:
6
#RO5 Violations:
2
#Rotatable Bonds:
15
Passes Ro3:
N
QED Weighted:
0.09
DETAILS
CLOSE
ALA2022488
Name:
4-(4-((S)-1-((S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-ylamino)-3-(1H-indShow More⌵
Mol. Formula:
C36H38N6O6
M.W.:
650.74
4 activity values
4 unique targets
Type:
Small molecule
AlogP:
4.01
Polar Surface Area:
188.27
HBA:
6
HBD:
6
#RO5 Violations:
2
#Rotatable Bonds:
15
Passes Ro3:
N
QED Weighted:
0.07
DETAILS
CLOSE
ALA2022487
Name:
4-(4-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan-2-ylamino)-3-(1H-indol-3-yl)-Show More⌵
Mol. Formula:
C34H37N5O6
M.W.:
611.70
4 activity values
4 unique targets
Type:
Small molecule
AlogP:
3.53
Polar Surface Area:
172.48
HBA:
6
HBD:
5
#RO5 Violations:
1
#Rotatable Bonds:
15
Passes Ro3:
N
QED Weighted:
0.10
DETAILS
CLOSE
ALA2022486
Name:
4-(4-((S)-1-((S)-1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-ylamino)-1-oxo-3Show More⌵
Mol. Formula:
C32H36N4O7
M.W.:
588.66
4 activity values
4 unique targets
Type:
Small molecule
AlogP:
2.76
Polar Surface Area:
176.92
HBA:
7
HBD:
5
#RO5 Violations:
1
#Rotatable Bonds:
15
Passes Ro3:
N
QED Weighted:
0.13
DETAILS
CLOSE
ALA2022485
Name:
4-(4-((S)-1-((S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-ylamino)-1-oxo-3-pShow More⌵
Mol. Formula:
C34H37N5O6
M.W.:
611.70
4 activity values
4 unique targets
Type:
Small molecule
AlogP:
3.53
Polar Surface Area:
172.48
HBA:
6
HBD:
5
#RO5 Violations:
1
#Rotatable Bonds:
15
Passes Ro3:
N
QED Weighted:
0.10
DETAILS
CLOSE