Type:
UnknownAlogP:
5.79Polar Surface Area:
32.78HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.50DETAILS
Type:
UnknownAlogP:
1.54Polar Surface Area:
53.01HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.84DETAILS
S 38093Name:
4-(3-((3aR,6aS)-hexahydrocyclopenta[c]pyrrol-2(1H)-yl)propoxy)benzamideMol. Formula:
C17H24N2O2M.W.:
288.39Type:
UnknownAlogP:
2.29Polar Surface Area:
55.56HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.82DETAILS
ALA4557586Name:
2-Methyl-7-(3-morpholinopropoxy)-3,4-dihydroisoquinolin-1(2H)-oneMol. Formula:
C17H24N2O3M.W.:
304.39Type:
UnknownAlogP:
1.42Polar Surface Area:
42.01HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.77DETAILS
Type:
UnknownAlogP:
2.57Polar Surface Area:
32.78HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.78DETAILS- ALA4456092
Name:
2-Methyl-7-(3-(pyrrolidin-1-yl)propoxy)-3,4-dihydroisoquinolin-1(2H)-oneMol. Formula:
C17H24N2O2M.W.:
288.39Type:
UnknownAlogP:
2.18Polar Surface Area:
32.78HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.78DETAILS - ALA4250218
Name:
3-(4-chlorobenzyl)-5-(2-(piperidin-1-yl)ethyl)-1,2,4-oxadiazoleMol. Formula:
C16H20ClN3OM.W.:
305.81Type:
Small moleculeAlogP:
3.34Polar Surface Area:
42.16HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.85DETAILS -
Type:
Small moleculeAlogP:
0.21Polar Surface Area:
89.85HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.62DETAILS -
Type:
Small moleculeAlogP:
0.03Polar Surface Area:
67.07HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.69DETAILS -
Type:
Small moleculeAlogP:
-0.56Polar Surface Area:
75.86HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.55DETAILS -
Type:
Small moleculeAlogP:
2.16Polar Surface Area:
58.28HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.94DETAILS -
Type:
Small moleculeAlogP:
-0.01Polar Surface Area:
81.06HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.66DETAILS -
Type:
Small moleculeAlogP:
1.63Polar Surface Area:
58.28HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.93DETAILS -
Type:
Small moleculeAlogP:
0.74Polar Surface Area:
89.85HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.67DETAILS -
Type:
Small moleculeAlogP:
2.12Polar Surface Area:
93.37HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.89DETAILS -
Type:
Small moleculeAlogP:
1.12Polar Surface Area:
84.58HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.83DETAILS -
Type:
Small moleculeAlogP:
-0.16Polar Surface Area:
81.06HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.67DETAILS -
Type:
Small moleculeAlogP:
0.08Polar Surface Area:
75.86HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.56DETAILS -
Type:
Small moleculeAlogP:
-0.18Polar Surface Area:
89.85HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.54DETAILS -
Type:
Small moleculeAlogP:
2.41Polar Surface Area:
53.93HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.82DETAILS
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