Compounds

Select all

ALA5266579
Name:
(S)-2-amino-N1-(4-aminopyrimidin-2-yl)-N7-hydroxyheptanediamide
Mol. Formula:
C11H18N6O3
M.W.:
282.30

Type:
---
AlogP:
-0.61
Polar Surface Area:
156.25
HBA:
7
HBD:
5
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.25
DETAILS
CLOSE
ALA5281168
Name:
4-[[2-(4-chlorophenyl)acetyl]amino]-5-(isopropylamino)-5-oxo-pentanoic acid
Mol. Formula:
C16H21ClN2O4
M.W.:
340.81

Type:
---
AlogP:
1.76
Polar Surface Area:
95.50
HBA:
3
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE
ALA5281158
Name:
N-(3-chlorophenyl)-2-(2-(cyclopropanesulfonamido)pyrimidin-4-yl)acetamide
Mol. Formula:
C15H15ClN4O3S
M.W.:
366.83

Type:
---
AlogP:
2.22
Polar Surface Area:
101.05
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.82
DETAILS
CLOSE
ALA4281288
Name:
3-((2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-6-(4-Show More⌵
Mol. Formula:
C22H27N3O5
M.W.:
413.47
2 activity values
2 unique targets
Type:
Small molecule
AlogP:
1.74
Polar Surface Area:
120.60
HBA:
7
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE