4-Amino-1,2,5-oxadiazole-3-carboxylic acidName:
4-amino-1,2,5-oxadiazole-3-carboxylic acidMol. Formula:
C3H3N3O3M.W.:
129.07Type:
UnknownAlogP:
-0.65Polar Surface Area:
102.24HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.52DETAILS
ALA4574617Name:
4-((1H-1,2,4-triazol-1-yl)methylamino)-1,2,5-oxadiazole-3-carboxylic acidMol. Formula:
C6H6N6O3M.W.:
210.15Type:
UnknownAlogP:
-0.57Polar Surface Area:
118.96HBA:
8HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.69DETAILS
ALA4566571Name:
4-((1H-pyrazol-1-yl)methylamino)-1,2,5-oxadiazole-3-carboxylic acidMol. Formula:
C7H7N5O3M.W.:
209.16Type:
UnknownAlogP:
0.03Polar Surface Area:
106.07HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.73DETAILS
Type:
UnknownAlogP:
0.41Polar Surface Area:
131.85HBA:
9HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.66DETAILS
Type:
UnknownAlogP:
0.63Polar Surface Area:
131.85HBA:
9HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.70DETAILS- ALA4483038
Name:
4-((1H-tetrazol-1-yl)methylamino)-1,2,5-oxadiazole-3-carboxylic acidMol. Formula:
C5H5N7O3M.W.:
211.14Type:
UnknownAlogP:
-1.18Polar Surface Area:
131.85HBA:
9HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.64DETAILS -
Type:
UnknownAlogP:
0.58Polar Surface Area:
118.96HBA:
8HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.70DETAILS -
Type:
UnknownAlogP:
0.49Polar Surface Area:
131.85HBA:
9HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.69DETAILS -
Type:
UnknownAlogP:
0.63Polar Surface Area:
131.85HBA:
9HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.70DETAILS - ALA4454339
Name:
4-((1H-1,2,3-triazol-1-yl)methylamino)-1,2,5-oxadiazole-3-carboxylic acidMol. Formula:
C6H6N6O3M.W.:
210.15Type:
UnknownAlogP:
-0.57Polar Surface Area:
118.96HBA:
8HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.69DETAILS -
Type:
UnknownAlogP:
1.51Polar Surface Area:
131.85HBA:
9HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.70DETAILS - ALA4439829
Name:
methyl 4-((1H-tetrazol-1-yl)methylamino)-1,2,5-oxadiazole-3-carboxylateMol. Formula:
C6H7N7O3M.W.:
225.17Type:
UnknownAlogP:
-1.09Polar Surface Area:
120.85HBA:
10HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.65DETAILS -
Type:
UnknownAlogP:
1.48Polar Surface Area:
130.08HBA:
11HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.62DETAILS -
Type:
Small moleculeAlogP:
3.73Polar Surface Area:
200.95HBA:
7HBD:
6#RO5 Violations:
2#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.14DETAILS -
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
Small moleculeAlogP:
4.94Polar Surface Area:
115.22HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.22DETAILS -
Type:
Small moleculeAlogP:
4.34Polar Surface Area:
115.22HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.22DETAILS -
Type:
Small moleculeAlogP:
3.78Polar Surface Area:
115.22HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.25DETAILS -
Type:
Small moleculeAlogP:
3.64Polar Surface Area:
115.22HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.25DETAILS -
Type:
Small moleculeAlogP:
3.95Polar Surface Area:
115.22HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.25DETAILS
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