Type:
Small moleculeAlogP:
2.62Polar Surface Area:
54.70HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.76DETAILS
ALA4289568Name:
4-(benzo[d][1,3]dioxol-5-yl)-5-methyl-1H-pyrazol-3-amineMol. Formula:
C11H11N3O2M.W.:
217.23Type:
Small moleculeAlogP:
1.70Polar Surface Area:
73.16HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.76DETAILS
Type:
Small moleculeAlogP:
3.12Polar Surface Area:
54.70HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.67DETAILS
ALA4287264Name:
N-(5-chloro-9H-pyrido[3,4-b]indol-7-yl)nicotinamideMol. Formula:
C17H11ClN4OM.W.:
322.76Type:
Small moleculeAlogP:
4.02Polar Surface Area:
70.67HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.59DETAILS
Type:
Small moleculeAlogP:
2.73Polar Surface Area:
54.70HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.82DETAILS- ALA4283909
Name:
4-(3,4-dichlorophenyl)-5-methyl-1H-pyrazol-3-amineMol. Formula:
C10H9Cl2N3M.W.:
242.11Type:
Small moleculeAlogP:
3.27Polar Surface Area:
54.70HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.81DETAILS - ALA4282760
Name:
5-methyl-4-(3-(trifluoromethoxy)phenyl)-1H-pyrazol-3-amineMol. Formula:
C11H10F3N3OM.W.:
257.21Type:
Small moleculeAlogP:
2.87Polar Surface Area:
63.93HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.87DETAILS -
Type:
Small moleculeAlogP:
2.28Polar Surface Area:
54.70HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.72DETAILS - ALA4280454
Name:
4-(3,4-dimethylphenyl)-5-methyl-1H-pyrazol-3-amineMol. Formula:
C12H15N3M.W.:
201.27Type:
Small moleculeAlogP:
2.58Polar Surface Area:
54.70HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.74DETAILS -
Type:
Small moleculeAlogP:
1.34Polar Surface Area:
138.64HBA:
9HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.67DETAILS -
Type:
Small moleculeAlogP:
2.37Polar Surface Area:
132.19HBA:
10HBD:
2#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.50DETAILS -
Type:
Small moleculeAlogP:
2.23Polar Surface Area:
142.47HBA:
11HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.43DETAILS -
Type:
Small moleculeAlogP:
1.92Polar Surface Area:
126.12HBA:
10HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
Small moleculeAlogP:
2.37Polar Surface Area:
132.19HBA:
10HBD:
2#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.50DETAILS -
Type:
Small moleculeAlogP:
1.94Polar Surface Area:
132.85HBA:
9HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.67DETAILS -
Type:
Small moleculeAlogP:
1.30Polar Surface Area:
136.01HBA:
10HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.53DETAILS -
Type:
Small moleculeAlogP:
2.46Polar Surface Area:
134.91HBA:
10HBD:
4#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.41DETAILS -
Type:
Small moleculeAlogP:
2.85Polar Surface Area:
97.10HBA:
9HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.62DETAILS -
Type:
Small moleculeAlogP:
2.38Polar Surface Area:
115.78HBA:
9HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.68DETAILS -
Type:
Small moleculeAlogP:
2.38Polar Surface Area:
145.74HBA:
9HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.52DETAILS
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