ALA5267462Name:
isopropyl 1-(naphthalen-1-yl)-9H-pyrido[3,4-b]indole-3-carboxylateMol. Formula:
C25H20N2O2M.W.:
380.45Type:
---AlogP:
6.10Polar Surface Area:
54.98HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.38DETAILS
Type:
---AlogP:
4.45Polar Surface Area:
57.36HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.33DETAILS
Type:
---AlogP:
1.33Polar Surface Area:
113.79HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.73DETAILS
Type:
---AlogP:
1.21Polar Surface Area:
259.12HBA:
8HBD:
10#RO5 Violations:
2#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.09DETAILS
Type:
---AlogP:
1.97Polar Surface Area:
259.12HBA:
8HBD:
10#RO5 Violations:
2#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.09DETAILS-
Type:
---AlogP:
2.41Polar Surface Area:
200.64HBA:
4HBD:
10#RO5 Violations:
2#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.14DETAILS -
Type:
---AlogP:
1.93Polar Surface Area:
56.26HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.66DETAILS -
Type:
---AlogP:
4.29Polar Surface Area:
57.36HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.32DETAILS -
Type:
---AlogP:
1.97Polar Surface Area:
259.12HBA:
8HBD:
10#RO5 Violations:
2#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.09DETAILS -
Type:
---AlogP:
3.78Polar Surface Area:
199.18HBA:
6HBD:
8#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.14DETAILS -
Type:
---AlogP:
4.61Polar Surface Area:
57.36HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.45DETAILS -
Type:
---AlogP:
3.18Polar Surface Area:
200.64HBA:
4HBD:
10#RO5 Violations:
2#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.13DETAILS -
Type:
UnknownAlogP:
2.50Polar Surface Area:
129.98HBA:
10HBD:
2#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.29DETAILS -
Type:
UnknownAlogP:
3.18Polar Surface Area:
70.06HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.60DETAILS -
Type:
UnknownAlogP:
4.47Polar Surface Area:
99.61HBA:
8HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.40DETAILS -
Type:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
Small moleculeAlogP:
10.88Polar Surface Area:
80.92HBA:
4HBD:
4#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.29DETAILS -
Type:
Small moleculeAlogP:
9.85Polar Surface Area:
101.15HBA:
5HBD:
5#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.21DETAILS -
Type:
Small moleculeAlogP:
10.90Polar Surface Area:
153.47HBA:
7HBD:
6#RO5 Violations:
3#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.14DETAILS
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