Type:
UnknownAlogP:
3.70Polar Surface Area:
92.51HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.66DETAILS
Type:
UnknownAlogP:
4.87Polar Surface Area:
92.51HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.56DETAILS
Type:
UnknownAlogP:
4.58Polar Surface Area:
92.51HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.57DETAILS
Type:
---AlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
ALA5287632Name:
N-((5-nitro-1H-indol-2-yl)methyl)cyclooctanamineMol. Formula:
C17H23N3O2M.W.:
301.39Type:
---AlogP:
4.28Polar Surface Area:
70.96HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.65DETAILS- ALA5287509
Name:
N-((6-bromo-1H-indol-2-yl)methyl)cyclooctanamineMol. Formula:
C17H23BrN2M.W.:
335.29Type:
---AlogP:
5.13Polar Surface Area:
27.82HBA:
1HBD:
2#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.80DETAILS -
Type:
---AlogP:
4.74Polar Surface Area:
29.10HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.85DETAILS - ALA5285245
Name:
5-(benzyloxy)-N-cyclooctyl-1H-indole-2-carboxamideMol. Formula:
C24H28N2O2M.W.:
376.50Type:
---AlogP:
5.59Polar Surface Area:
54.12HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.61DETAILS -
Type:
---AlogP:
4.15Polar Surface Area:
44.89HBA:
1HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.86DETAILS -
Type:
---AlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
---AlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS - ALA5284045
Name:
N-(benzo[b]selenophen-2-ylmethyl)adamantan-1-amineMol. Formula:
C19H23NSeM.W.:
344.36Type:
---AlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS - ALA5282173
Name:
N-((5-chloro-1H-indol-2-yl)methyl)cyclooctanamineMol. Formula:
C17H23ClN2M.W.:
290.84Type:
---AlogP:
5.02Polar Surface Area:
27.82HBA:
1HBD:
2#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.82DETAILS - ALA5280212
Name:
N-cyclooctyl-5-methoxy-1H-indole-2-carboxamideMol. Formula:
C18H24N2O2M.W.:
300.40Type:
---AlogP:
4.02Polar Surface Area:
54.12HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.90DETAILS - ALA5279496
Name:
N-(benzo[b]selenophen-2-ylmethyl)cyclohexanamineMol. Formula:
C15H19NSeM.W.:
292.28Type:
---AlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
---AlogP:
4.25Polar Surface Area:
44.89HBA:
1HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.86DETAILS -
Type:
---AlogP:
4.15Polar Surface Area:
44.89HBA:
1HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.86DETAILS -
Type:
---AlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS - ALA5278413
Name:
N-cyclooctyl-6-hydroxy-1H-indole-2-carboxamideMol. Formula:
C17H22N2O2M.W.:
286.38Type:
---AlogP:
3.72Polar Surface Area:
65.12HBA:
2HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.79DETAILS - ALA5291342
Name:
N-cycloheptylbenzo[b]selenophene-2-carboxamideMol. Formula:
C16H19NOSeM.W.:
320.29Type:
---AlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
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