Compounds

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ALA5204185
Name:
Voratin A
Mol. Formula:
C22H29NO5
M.W.:
387.48
4 activity values
2 unique targets
Type:
---
AlogP:
1.51
Polar Surface Area:
82.70
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA5190887
Name:
Voratin C
Mol. Formula:
C20H27NO5
M.W.:
361.44
7 activity values
2 unique targets
Type:
---
AlogP:
0.95
Polar Surface Area:
82.70
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.81
DETAILS
CLOSE
ALA5189138
Name:
Voratin B; 3R-epi-Voratin A
Mol. Formula:
C22H29NO5
M.W.:
387.48
3 activity values
2 unique targets
Type:
---
AlogP:
1.51
Polar Surface Area:
82.70
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA4592517
Name:
trans-9,10-Bis(benzyloxy)-4-(4-methoxyphenyl)-3,4,6,7-tetrahydro-1H-pyrido[Show More⌵
Mol. Formula:
C34H33NO4
M.W.:
519.64
7 activity values
7 unique targets
Type:
Unknown
AlogP:
6.86
Polar Surface Area:
48.00
HBA:
5
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.25
DETAILS
CLOSE
ALA4452564
Name:
trans-2,3-Bis(benzyloxy)-13-ethyl-8-propyl-8,9,11,13a-tetrahydro-5H-azocinoShow More⌵
Mol. Formula:
C34H39NO3
M.W.:
509.69
7 activity values
7 unique targets
Type:
Unknown
AlogP:
7.61
Polar Surface Area:
38.77
HBA:
4
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.28
DETAILS
CLOSE