Compounds

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ALA4550186
Name:
(3R,3aS,5aS,9bS)-5a,9-dimethyl-3-(morpholinomethyl)-3a,4,5,5a-tetrahydronapShow More⌵
Mol. Formula:
C19H25NO4
M.W.:
331.41
2 activity values
2 unique targets
Type:
Unknown
AlogP:
1.73
Polar Surface Area:
55.84
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.72
DETAILS
CLOSE
ALA4543391
Name:
(3R,3aS,5aS,9bS)-3-((4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)methyShow More⌵
Mol. Formula:
C27H32N2O5
M.W.:
464.56
2 activity values
2 unique targets
Type:
Unknown
AlogP:
2.95
Polar Surface Area:
68.31
HBA:
7
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA4451251
Name:
(3R,3aS,5aS,9bS)-3-((dipropylamino)methyl)-5a,9-dimethyl-3a,4,5,5a-tetrahydShow More⌵
Mol. Formula:
C21H32ClNO3
M.W.:
381.94
2 activity values
2 unique targets
Type:
Unknown
AlogP:
3.52
Polar Surface Area:
46.61
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.69
DETAILS
CLOSE
ALA4439808
Name:
(3R,3aS,5aS,9bS)-3-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-5a,9-dimethyShow More⌵
Mol. Formula:
C26H32N2O4
M.W.:
436.55
2 activity values
2 unique targets
Type:
Unknown
AlogP:
3.23
Polar Surface Area:
59.08
HBA:
6
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
CLOSE
ALA4437420
Name:
(3R,3aS,5aS,9bS)-3-((3,3-dimethylpiperidin-1-yl)methyl)-5a,9-dimethyl-3a,4,Show More⌵
Mol. Formula:
C22H31NO3
M.W.:
357.49
2 activity values
2 unique targets
Type:
Unknown
AlogP:
3.52
Polar Surface Area:
46.61
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.71
DETAILS
CLOSE