Type:
---AlogP:
4.50Polar Surface Area:
78.99HBA:
7HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.35DETAILS
Type:
---AlogP:
3.75Polar Surface Area:
77.72HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.78DETAILS
Type:
---AlogP:
4.48Polar Surface Area:
88.22HBA:
8HBD:
---#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.24DETAILS
Type:
---AlogP:
3.81Polar Surface Area:
67.25HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.69DETAILS
Type:
---AlogP:
8.44Polar Surface Area:
88.72HBA:
6HBD:
2#RO5 Violations:
2#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.12DETAILS-
Type:
---AlogP:
5.13Polar Surface Area:
158.15HBA:
10HBD:
2#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.38DETAILS -
Type:
---AlogP:
3.94Polar Surface Area:
84.65HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.50DETAILS -
Type:
---AlogP:
1.95Polar Surface Area:
153.37HBA:
11HBD:
4#RO5 Violations:
2#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.35DETAILS -
Type:
UnknownAlogP:
5.96Polar Surface Area:
62.91HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.40DETAILS -
Type:
---AlogP:
4.25Polar Surface Area:
39.79HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.46DETAILS -
Type:
---AlogP:
4.74Polar Surface Area:
158.15HBA:
10HBD:
2#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.41DETAILS -
Type:
---AlogP:
2.64Polar Surface Area:
179.67HBA:
13HBD:
4#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.30DETAILS -
Type:
---AlogP:
2.45Polar Surface Area:
63.60HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.85DETAILS -
Type:
Small moleculeAlogP:
-0.20Polar Surface Area:
156.61HBA:
8HBD:
4#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.56DETAILS - ALA1096825
Name:
3-(Biphenyl-2-yl)-5-(2-methoxyphenyl)-1H-pyrazoleMol. Formula:
C22H18N2OM.W.:
326.40Type:
Small moleculeAlogP:
5.42Polar Surface Area:
37.91HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.54DETAILS - ALA1098191
Name:
3-(4-Bromophenyl)-5-(4-methoxyphenyl)-1H-pyrazoleMol. Formula:
C16H13BrN2OM.W.:
329.20Type:
Small moleculeAlogP:
4.51Polar Surface Area:
37.91HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.77DETAILS - ALA1098190
Name:
3-(4-Chlorophenyl)-5-(4-methoxyphenyl)-1H-pyrazoleMol. Formula:
C16H13ClN2OM.W.:
284.75Type:
Small moleculeAlogP:
4.41Polar Surface Area:
37.91HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.77DETAILS -
Type:
Small moleculeAlogP:
4.34Polar Surface Area:
54.70HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.69DETAILS - ALA1095875
Name:
3-(4-Bromophenyl)-5-(4-nitrophenyl)-1H-pyrazoleMol. Formula:
C15H10BrN3O2M.W.:
344.17Type:
Small moleculeAlogP:
4.41Polar Surface Area:
71.82HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.56DETAILS - ALA1097145
Name:
3-(4-Fluorophenyl)-5-(4-nitrophenyl)-1H-pyrazoleMol. Formula:
C15H10FN3O2M.W.:
283.26Type:
Small moleculeAlogP:
3.79Polar Surface Area:
71.82HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.59DETAILS
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