Type:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
Type:
Small moleculeAlogP:
11.17Polar Surface Area:
111.19HBA:
8HBD:
---#RO5 Violations:
2#Rotatable Bonds:
39Passes Ro3:
NQED Weighted:
0.02DETAILS
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
Type:
Small moleculeAlogP:
5.35Polar Surface Area:
37.30HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.76DETAILS- ALA13531
Name:
6-Chloro-3,3-dimethyl-3,4-dihydro-isoquinoline 2-oxideMol. Formula:
C11H12ClNOM.W.:
209.68Type:
Small moleculeAlogP:
2.60Polar Surface Area:
26.07HBA:
1HBD:
---#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
YQED Weighted:
0.48DETAILS - ALA265346
Name:
7-Chloro-3,3-dimethyl-3,4-dihydro-isoquinoline 2-oxideMol. Formula:
C11H12ClNOM.W.:
209.68Type:
Small moleculeAlogP:
2.60Polar Surface Area:
26.07HBA:
1HBD:
---#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
YQED Weighted:
0.48DETAILS - ALA13172
Name:
6-Fluoro-3,3-dimethyl-3,4-dihydro-isoquinoline 2-oxideMol. Formula:
C11H12FNOM.W.:
193.22Type:
Small moleculeAlogP:
2.09Polar Surface Area:
26.07HBA:
1HBD:
---#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
YQED Weighted:
0.46DETAILS - ALA13761
Name:
8-Chloro-3,3-dimethyl-3,4-dihydro-isoquinoline 2-oxideMol. Formula:
C11H12ClNOM.W.:
209.68Type:
Small moleculeAlogP:
2.60Polar Surface Area:
26.07HBA:
1HBD:
---#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
YQED Weighted:
0.48DETAILS - ALA13201
Name:
5-Chloro-3,3-dimethyl-3,4-dihydro-isoquinoline 2-oxideMol. Formula:
C11H12ClNOM.W.:
209.68Type:
Small moleculeAlogP:
2.60Polar Surface Area:
26.07HBA:
1HBD:
---#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
YQED Weighted:
0.48DETAILS - ALA12917
Name:
6,8-Dichloro-3,3-dimethyl-3,4-dihydro-isoquinoline 2-oxideMol. Formula:
C11H11Cl2NOM.W.:
244.12Type:
Small moleculeAlogP:
3.26Polar Surface Area:
26.07HBA:
1HBD:
---#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.51DETAILS - ALA274908
Name:
7'-chloro-4'H-spiro[cyclohexane-1,3'-isoquinoline] 2'-oxideMol. Formula:
C14H16ClNOM.W.:
249.74Type:
Small moleculeAlogP:
3.53Polar Surface Area:
26.07HBA:
1HBD:
---#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.51DETAILS - ALA13204
Name:
6'-methoxy-4'H-spiro[cyclohexane-1,3'-isoquinoline] 2'-oxideMol. Formula:
C15H19NO2M.W.:
245.32Type:
Small moleculeAlogP:
2.88Polar Surface Area:
35.30HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.56DETAILS - ALA13368
Name:
8'-methoxy-4'H-spiro[cyclohexane-1,3'-isoquinoline] 2'-oxideMol. Formula:
C15H19NO2M.W.:
245.32Type:
Small moleculeAlogP:
2.88Polar Surface Area:
35.30HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.56DETAILS - ALA13112
Name:
6,7-Dimethoxy-3,3-dimethyl-3,4-dihydro-isoquinoline 2-oxideMol. Formula:
C13H17NO3M.W.:
235.28Type:
Small moleculeAlogP:
1.97Polar Surface Area:
44.53HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
YQED Weighted:
0.58DETAILS - ALA430100
Name:
8-Fluoro-5-methoxy-3,3-dimethyl-3,4-dihydro-isoquinoline 2-oxideMol. Formula:
C12H14FNO2M.W.:
223.25Type:
Small moleculeAlogP:
2.10Polar Surface Area:
35.30HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.54DETAILS - ALA274597
Name:
6-Methoxy-3,3-dimethyl-3,4-dihydro-isoquinoline 2-oxideMol. Formula:
C12H15NO2M.W.:
205.26Type:
Small moleculeAlogP:
1.96Polar Surface Area:
35.30HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.52DETAILS - ALA13069
Name:
8-Methoxy-3,3-dimethyl-3,4-dihydro-isoquinoline 2-oxideMol. Formula:
C12H15NO2M.W.:
205.26Type:
Small moleculeAlogP:
1.96Polar Surface Area:
35.30HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.52DETAILS - ALA273282
Name:
7-Fluoro-3,3-dimethyl-3,4-dihydro-isoquinoline 2-oxideMol. Formula:
C11H12FNOM.W.:
193.22Type:
Small moleculeAlogP:
2.09Polar Surface Area:
26.07HBA:
1HBD:
---#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
YQED Weighted:
0.46DETAILS - ALA12940
Name:
7-Methoxy-3,3-dimethyl-3,4-dihydro-isoquinoline 2-oxideMol. Formula:
C12H15NO2M.W.:
205.26Type:
Small moleculeAlogP:
1.96Polar Surface Area:
35.30HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.52DETAILS
The page will load shortly, Thanks for your patience!
Select all
