Type:
---AlogP:
3.30Polar Surface Area:
29.10HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.82DETAILS
Type:
---AlogP:
3.30Polar Surface Area:
29.10HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.82DETAILS
Type:
---AlogP:
3.30Polar Surface Area:
29.10HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.82DETAILS
Type:
---AlogP:
3.30Polar Surface Area:
29.10HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.82DETAILS
Type:
UnknownAlogP:
3.98Polar Surface Area:
12.47HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.82DETAILS-
Type:
UnknownAlogP:
4.49Polar Surface Area:
3.24HBA:
1HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.74DETAILS -
Type:
UnknownAlogP:
4.39Polar Surface Area:
3.24HBA:
1HBD:
---#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.69DETAILS -
Type:
UnknownAlogP:
4.31Polar Surface Area:
3.24HBA:
1HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.74DETAILS -
Type:
UnknownAlogP:
5.03Polar Surface Area:
3.24HBA:
1HBD:
---#RO5 Violations:
1#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.64DETAILS -
Type:
UnknownAlogP:
4.27Polar Surface Area:
12.47HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.76DETAILS - ALA4759521
Name:
5-Bromo-4-fluoro-2-({4-[(trifluoromethyl)thio]benzoyl}amino)benzoic acidMol. Formula:
C15H8BrF4NO3SM.W.:
438.20Type:
UnknownAlogP:
5.15Polar Surface Area:
66.40HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.51DETAILS - ALA4295202
Name:
1-(2-methoxyphenyl)-4-(3-(naphthalen-2-yloxy)propyl)piperazineMol. Formula:
C24H28N2O2M.W.:
376.50Type:
Small moleculeAlogP:
4.44Polar Surface Area:
24.94HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.57DETAILS - ALA4294700
Name:
1-(2-methoxyphenyl)-4-(2-(naphthalen-2-yloxy)ethyl)piperazineMol. Formula:
C23H26N2O2M.W.:
362.47Type:
Small moleculeAlogP:
4.05Polar Surface Area:
24.94HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.66DETAILS - ALA4294469
Name:
1-(4-bromophenyl)-4-(2-(naphthalen-2-yloxy)ethyl)piperazineMol. Formula:
C22H23BrN2OM.W.:
411.34Type:
Small moleculeAlogP:
4.80Polar Surface Area:
15.71HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.60DETAILS - ALA4293814
Name:
1-(3-(naphthalen-2-yloxy)propyl)-4-phenylpiperazineMol. Formula:
C23H26N2OM.W.:
346.47Type:
Small moleculeAlogP:
4.43Polar Surface Area:
15.71HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.61DETAILS - ALA4293379
Name:
1-(2,6-dimethylphenyl)-4-(2-(naphthalen-2-yloxy)ethyl)piperazineMol. Formula:
C24H28N2OM.W.:
360.50Type:
Small moleculeAlogP:
4.66Polar Surface Area:
15.71HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.66DETAILS - ALA4292965
Name:
1-(2-(naphthalen-2-yloxy)ethyl)-4-phenylpiperazineMol. Formula:
C22H24N2OM.W.:
332.45Type:
Small moleculeAlogP:
4.04Polar Surface Area:
15.71HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.70DETAILS - ALA4291765
Name:
1-(4-fluorophenyl)-4-(3-(naphthalen-2-yloxy)propyl)piperazineMol. Formula:
C23H25FN2OM.W.:
364.46Type:
Small moleculeAlogP:
4.57Polar Surface Area:
15.71HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.60DETAILS - ALA4288944
Name:
1-(2,4-dichlorophenyl)-4-(2-(naphthalen-2-yloxy)ethyl)piperazineMol. Formula:
C22H22Cl2N2OM.W.:
401.34Type:
Small moleculeAlogP:
5.35Polar Surface Area:
15.71HBA:
3HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.57DETAILS - ALA4288204
Name:
4-benzyl-1-(2-(naphthalen-2-yloxy)ethyl)piperidineMol. Formula:
C24H27NOM.W.:
345.49Type:
Small moleculeAlogP:
5.17Polar Surface Area:
12.47HBA:
2HBD:
---#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.61DETAILS
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