Type:
Small moleculeAlogP:
5.31Polar Surface Area:
54.88HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.45DETAILS
Type:
Small moleculeAlogP:
5.17Polar Surface Area:
54.88HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.51DETAILS
Type:
Small moleculeAlogP:
5.48Polar Surface Area:
54.88HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.48DETAILS
Type:
Small moleculeAlogP:
6.19Polar Surface Area:
54.88HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.36DETAILS
Type:
Small moleculeAlogP:
5.46Polar Surface Area:
54.02HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.60DETAILS- ALA3786957
Name:
5[(2-(1H-Indol-3-yl)ethylamino)methyl]-2-methoxyphenolMol. Formula:
C18H20N2O2M.W.:
296.37Type:
Small moleculeAlogP:
3.21Polar Surface Area:
57.28HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.61DETAILS - ALA3787245
Name:
2-(1H-Indol-3-yl)-N-[(10-methylanthracen-9-yl)methyl]-ethanamineMol. Formula:
C26H24N2M.W.:
364.49Type:
Small moleculeAlogP:
6.12Polar Surface Area:
27.82HBA:
1HBD:
2#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.29DETAILS - ALA3787398
Name:
1-[(2-(1H-Indol-3-yl)ethyl)amino]methyl]naphthalen-2-olMol. Formula:
C21H20N2OM.W.:
316.40Type:
Small moleculeAlogP:
4.36Polar Surface Area:
48.05HBA:
2HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.48DETAILS - ALA3786880
Name:
2-(1H-Indol-3-yl)-N-[(2-methoxynaphthalen-1-yl)methyl]-ethanamineMol. Formula:
C22H22N2OM.W.:
330.43Type:
Small moleculeAlogP:
4.66Polar Surface Area:
37.05HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.50DETAILS - ALA3787136
Name:
2-(1H-Indol-3-yl)-N-(naphthalen-1-ylmethyl)ethanamineMol. Formula:
C21H20N2M.W.:
300.41Type:
Small moleculeAlogP:
4.65Polar Surface Area:
27.82HBA:
1HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.52DETAILS - ALA3785577
Name:
N-[(1,2,3,4,Tetrahydronaphthalen-1-yl)methyl]-2-(1H-indol-3-yl)ethanamineMol. Formula:
C21H24N2M.W.:
304.44Type:
Small moleculeAlogP:
4.42Polar Surface Area:
27.82HBA:
1HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.67DETAILS - ALA3786066
Name:
2-(1H-Indol-3-yl)-N-(quinolin-5-ylmethyl)ethanamineMol. Formula:
C20H19N3M.W.:
301.39Type:
Small moleculeAlogP:
4.05Polar Surface Area:
40.71HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.55DETAILS -
Type:
Small moleculeAlogP:
4.98Polar Surface Area:
27.82HBA:
1HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.54DETAILS -
Type:
Small moleculeAlogP:
4.98Polar Surface Area:
27.82HBA:
1HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.54DETAILS -
Type:
Small moleculeAlogP:
6.75Polar Surface Area:
35.42HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.21DETAILS - ALA3785822
Name:
2-([1,1'-Biphenyl]-4-yl)-N-(2-(1-methyl-1H-indol-3-yl)ethyl)-ethanamineMol. Formula:
C25H26N2M.W.:
354.50Type:
Small moleculeAlogP:
5.22Polar Surface Area:
16.96HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.45DETAILS - ALA3785212
Name:
N-(4-Chlorobenzyl)-2-(1-methyl-1H-indol-3-yl)ethanamineMol. Formula:
C18H19ClN2M.W.:
298.82Type:
Small moleculeAlogP:
4.16Polar Surface Area:
16.96HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.70DETAILS - ALA3785756
Name:
N-(4-Methoxybenzyl)-2-(1-methyl-1H-indol-3-yl)ethanamineMol. Formula:
C19H22N2OM.W.:
294.40Type:
Small moleculeAlogP:
3.52Polar Surface Area:
26.19HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.70DETAILS -
Type:
Small moleculeAlogP:
3.26Polar Surface Area:
45.33HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.86DETAILS -
Type:
Small moleculeAlogP:
3.30Polar Surface Area:
52.93HBA:
6HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.72DETAILS
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