Type:
---AlogP:
8.94Polar Surface Area:
186.12HBA:
11HBD:
4#RO5 Violations:
3#Rotatable Bonds:
40Passes Ro3:
NQED Weighted:
0.03DETAILS
Type:
---AlogP:
2.97Polar Surface Area:
145.91HBA:
9HBD:
5#RO5 Violations:
1#Rotatable Bonds:
22Passes Ro3:
NQED Weighted:
0.11DETAILS
ALA4879352Name:
N-(2-methoxyphenyl)-1,2,3,4-tetrahydroisoquinoline-1-carboxamideMol. Formula:
C17H18N2O2M.W.:
282.34Type:
UnknownAlogP:
2.52Polar Surface Area:
50.36HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.91DETAILS
ALA4878926Name:
N-(2-(trifluoromethyl)phenyl)-1,2,3,4-tetrahydroisoquinoline-1-carboxamideMol. Formula:
C17H15F3N2OM.W.:
320.31Type:
UnknownAlogP:
3.53Polar Surface Area:
41.13HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.89DETAILS
ALA4877951Name:
N-(2-hydroxyphenyl)-1,2,3,4-tetrahydroisoquinoline-1-carboxamideMol. Formula:
C16H16N2O2M.W.:
268.32Type:
UnknownAlogP:
2.22Polar Surface Area:
61.36HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.73DETAILS-
Type:
UnknownAlogP:
3.19Polar Surface Area:
62.22HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.70DETAILS -
Type:
UnknownAlogP:
6.76Polar Surface Area:
49.41HBA:
2HBD:
1#RO5 Violations:
2#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.38DETAILS -
Type:
UnknownAlogP:
5.74Polar Surface Area:
49.41HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.54DETAILS -
Type:
UnknownAlogP:
4.73Polar Surface Area:
58.64HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.66DETAILS - ALA4875275
Name:
N-(3-(trifluoromethyl)phenyl)isoquinoline-1-carboxamideMol. Formula:
C17H11F3N2OM.W.:
316.28Type:
UnknownAlogP:
4.51Polar Surface Area:
41.99HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.76DETAILS - ALA4872235
Name:
N-(3-methoxyphenyl)-1,2,3,4-tetrahydroisoquinoline-1-carboxamideMol. Formula:
C17H18N2O2M.W.:
282.34Type:
UnknownAlogP:
2.52Polar Surface Area:
50.36HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.91DETAILS - ALA4871912
Name:
N-(4-(trifluoromethyl)phenyl)-1,2,3,4-tetrahydroisoquinoline-1-carboxamideMol. Formula:
C17H15F3N2OM.W.:
320.31Type:
UnknownAlogP:
3.53Polar Surface Area:
41.13HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.89DETAILS -
Type:
UnknownAlogP:
4.42Polar Surface Area:
69.64HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.63DETAILS -
Type:
UnknownAlogP:
3.19Polar Surface Area:
62.22HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.75DETAILS -
Type:
UnknownAlogP:
3.50Polar Surface Area:
51.22HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.80DETAILS - ALA4869065
Name:
N-(4-hydroxyphenyl)-1,2,3,4-tetrahydroisoquinoline-1-carboxamideMol. Formula:
C16H16N2O2M.W.:
268.32Type:
UnknownAlogP:
2.22Polar Surface Area:
61.36HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.73DETAILS -
Type:
UnknownAlogP:
4.42Polar Surface Area:
69.64HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.63DETAILS -
Type:
UnknownAlogP:
4.14Polar Surface Area:
41.99HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.77DETAILS -
Type:
UnknownAlogP:
4.14Polar Surface Area:
41.99HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.77DETAILS -
Type:
UnknownAlogP:
4.73Polar Surface Area:
58.64HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.66DETAILS
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