Compounds

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ALA3358961
Name:
(1S,2R,4S,5R,8S,9S,10R,13S,14E)-2,8-dihydroxy-14-(hydroxyimino)-5,9,13-trimShow More⌵
Mol. Formula:
C20H31NO5
M.W.:
365.47
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
2.65
Polar Surface Area:
110.35
HBA:
5
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA3358960
Name:
(1S,4S,5R,8S,9S,10R,13S)-8-hydroxy-5,9,13-trimethyl-14-oxo-15-oxatetracycloShow More⌵
Mol. Formula:
C20H30O5
M.W.:
350.46
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
3.00
Polar Surface Area:
83.83
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.71
DETAILS
CLOSE
ALA3358959
Name:
(1S,4S,5R,9S,10S,13S)-5,9,13-trimethyl-14-oxo-15-oxatetracyclo[11.3.1.0^{1,Show More⌵
Mol. Formula:
C20H30O4
M.W.:
334.46
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
4.03
Polar Surface Area:
63.60
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.74
DETAILS
CLOSE
ALA3358958
Name:
(1R,4S,5R,9S,10R,13S)-13-(hydroxymethyl)-5,9-dimethyl-15-oxo-14-oxatetracycShow More⌵
Mol. Formula:
C20H30O5
M.W.:
350.46
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
3.14
Polar Surface Area:
83.83
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.75
DETAILS
CLOSE
ALA3358957
Name:
(1R,4S,5R,9S,10R,12R,13R)-12-hydroxy-5,9,13-trimethyl-15-oxo-14-oxatetracycShow More⌵
Mol. Formula:
C20H30O5
M.W.:
350.46
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
3.14
Polar Surface Area:
83.83
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.71
DETAILS
CLOSE
ALA3358956
Name:
(1S,2S,4S,5R,9S,10S,13S)-2-hydroxy-5,9,13-trimethyl-15-oxo-14-oxatetracycloShow More⌵
Mol. Formula:
C20H30O5
M.W.:
350.46
1 activity values
1 unique targets
Type:
Small molecule
AlogP:
3.14
Polar Surface Area:
83.83
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.71
DETAILS
CLOSE