Type:
Small moleculeAlogP:
0.01Polar Surface Area:
211.89HBA:
9HBD:
7#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.28DETAILS
ALA3274193Name:
dl-5,10-Methylene tetrahydropteroyl-D-glutamateMol. Formula:
C20H23N7O6M.W.:
457.45Type:
Small moleculeAlogP:
-0.52Polar Surface Area:
193.98HBA:
9HBD:
6#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.31DETAILS
Type:
Small moleculeAlogP:
-3.24Polar Surface Area:
191.54HBA:
9HBD:
6#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.29DETAILS
Type:
Small moleculeAlogP:
0.03Polar Surface Area:
208.82HBA:
10HBD:
7#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.27DETAILS
Type:
Small moleculeAlogP:
3.22Polar Surface Area:
200.36HBA:
10HBD:
5#RO5 Violations:
1#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.21DETAILS-
Type:
Small moleculeAlogP:
-1.83Polar Surface Area:
174.87HBA:
8HBD:
4#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.46DETAILS -
Type:
Small moleculeAlogP:
-1.11Polar Surface Area:
141.85HBA:
6HBD:
4#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.51DETAILS - ALA3228321
Name:
5-mercapto-2'-deoxyuridine-5'-phosphateCas Number:
28456-57-7Mol. Formula:
C9H13N2O8PSM.W.:
340.25Type:
Small moleculeAlogP:
-1.42Polar Surface Area:
151.08HBA:
8HBD:
5#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.33DETAILS -
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
Small moleculeAlogP:
-1.24Polar Surface Area:
145.63HBA:
6HBD:
4#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.47DETAILS -
Type:
Small moleculeAlogP:
-1.61Polar Surface Area:
185.22HBA:
9HBD:
4#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.32DETAILS -
Type:
Small moleculeAlogP:
-0.25Polar Surface Area:
177.38HBA:
9HBD:
4#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.34DETAILS -
Type:
Small moleculeAlogP:
0.72Polar Surface Area:
151.08HBA:
7HBD:
4#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.47DETAILS -
Type:
Small moleculeAlogP:
-0.94Polar Surface Area:
194.17HBA:
8HBD:
5#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.36DETAILS -
Type:
Small moleculeAlogP:
0.98Polar Surface Area:
151.08HBA:
7HBD:
4#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.49DETAILS -
Type:
Small moleculeAlogP:
-0.17Polar Surface Area:
174.87HBA:
8HBD:
4#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.49DETAILS -
Type:
Small moleculeAlogP:
0.03Polar Surface Area:
154.32HBA:
8HBD:
4#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.47DETAILS -
Type:
Small moleculeAlogP:
-0.33Polar Surface Area:
171.31HBA:
8HBD:
5#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.42DETAILS -
Type:
Small moleculeAlogP:
1.54Polar Surface Area:
160.31HBA:
8HBD:
4#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.34DETAILS -
Type:
Small moleculeAlogP:
-0.46Polar Surface Area:
177.10HBA:
8HBD:
5#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.33DETAILS
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