Compounds

Select all

ALA3337634
Name:
3-(Dimethylamino)-1-(3-methoxyphenyl)propan-1-one hydrochloride
Mol. Formula:
C12H18ClNO2
M.W.:
243.73
16 activity values
12 unique targets
Type:
Small molecule
AlogP:
1.83
Polar Surface Area:
29.54
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.69
DETAILS
CLOSE
ALA3337633
Name:
1-(3-Methoxyphenyl)-3-(piperidin-1-yl)propan-1-one hydrochloride
Mol. Formula:
C15H22ClNO2
M.W.:
283.80
16 activity values
12 unique targets
Type:
Small molecule
AlogP:
2.75
Polar Surface Area:
29.54
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.75
DETAILS
CLOSE
ALA3337632
Name:
5-((Dimethylamino)methyl)-6,7-dihydrobenzo[b]thiophen-4(5H)-one hydrochloriShow More⌵
Mol. Formula:
C11H16ClNOS
M.W.:
245.78
16 activity values
12 unique targets
Type:
Small molecule
AlogP:
2.05
Polar Surface Area:
20.31
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
Y
QED Weighted:
0.74
DETAILS
CLOSE
ALA3337631
Name:
2-((Dimethylamino)methyl)-5,7-dimethyl-3,4-dihydronaphthalen-1(2H)-one hydrShow More⌵
Mol. Formula:
C15H22ClNO
M.W.:
267.80
16 activity values
12 unique targets
Type:
Small molecule
AlogP:
2.61
Polar Surface Area:
20.31
HBA:
2
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
Y
QED Weighted:
0.78
DETAILS
CLOSE
ALA3337630
Name:
2-((Dimethylamino)methyl)-4-methyl-3,4-dihydronaphthalen-1(2H)-one hydrochlShow More⌵
Mol. Formula:
C14H20ClNO
M.W.:
253.77
16 activity values
12 unique targets
Type:
Small molecule
AlogP:
2.55
Polar Surface Area:
20.31
HBA:
2
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
Y
QED Weighted:
0.76
DETAILS
CLOSE
ALA3337629
Name:
2-((Dimethylamino)methyl)-7-methoxy-3,4-dihydronaphthalen-1(2H)-one hydrochShow More⌵
Mol. Formula:
C14H20ClNO2
M.W.:
269.77
16 activity values
12 unique targets
Type:
Small molecule
AlogP:
2.00
Polar Surface Area:
29.54
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
Y
QED Weighted:
0.80
DETAILS
CLOSE
ALA3337628
Name:
7-Methoxy-2-(piperidin-1-ylmethyl)-3,4-dihydronaphthalen-1(2H)-one hydrochlShow More⌵
Mol. Formula:
C17H24ClNO2
M.W.:
309.84
16 activity values
12 unique targets
Type:
Small molecule
AlogP:
2.93
Polar Surface Area:
29.54
HBA:
3
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
Y
QED Weighted:
0.85
DETAILS
CLOSE