Type:
---AlogP:
4.50Polar Surface Area:
67.43HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.34DETAILSType:
---AlogP:
5.72Polar Surface Area:
67.43HBA:
5HBD:
2#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.21DETAILSType:
---AlogP:
5.51Polar Surface Area:
87.66HBA:
5HBD:
3#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.23DETAILSType:
---AlogP:
3.60Polar Surface Area:
67.43HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.42DETAILSType:
---AlogP:
4.86Polar Surface Area:
87.66HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.27DETAILSType:
---AlogP:
5.14Polar Surface Area:
87.66HBA:
5HBD:
3#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.24DETAILSType:
---AlogP:
5.35Polar Surface Area:
104.73HBA:
5HBD:
3#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.31DETAILSType:
---AlogP:
4.86Polar Surface Area:
87.66HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.27DETAILSType:
---AlogP:
5.51Polar Surface Area:
87.66HBA:
5HBD:
3#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.23DETAILSType:
---AlogP:
5.40Polar Surface Area:
76.66HBA:
5HBD:
2#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.25DETAILSType:
---AlogP:
4.35Polar Surface Area:
87.66HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.29DETAILSType:
---AlogP:
4.29Polar Surface Area:
93.73HBA:
6HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.22DETAILSType:
---AlogP:
5.51Polar Surface Area:
87.66HBA:
5HBD:
3#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.23DETAILSType:
---AlogP:
6.03Polar Surface Area:
87.15HBA:
5HBD:
1#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.31DETAILSType:
---AlogP:
6.20Polar Surface Area:
70.08HBA:
5HBD:
1#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.23DETAILSType:
---AlogP:
6.73Polar Surface Area:
94.83HBA:
3HBD:
3#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.33DETAILS- {[3-(ethoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothien-2-yl]amino}(oxo)acetic acid
Name:
Show More⌵Mol. Formula:
C13H15NO5SM.W.:
297.33Type:
---AlogP:
1.83Polar Surface Area:
92.70HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.66DETAILS Type:
---AlogP:
6.73Polar Surface Area:
94.83HBA:
3HBD:
3#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.33DETAILS- 5-(2,5-Dichlorophenyl)-1H-pyrazole-3-carboxylic acid
Name:
5-(2,5-dichlorophenyl)-1H-pyrazole-3-carboxylic acidMol. Formula:
C10H6Cl2N2O2M.W.:
257.08Type:
---AlogP:
3.08Polar Surface Area:
65.98HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.87DETAILS Type:
---AlogP:
4.82Polar Surface Area:
87.66HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.27DETAILS