Type:
---AlogP:
4.33Polar Surface Area:
122.19HBA:
11HBD:
3#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.37DETAILS
Type:
---AlogP:
3.56Polar Surface Area:
152.40HBA:
12HBD:
3#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.38DETAILS
Type:
Small moleculeAlogP:
4.50Polar Surface Area:
118.72HBA:
7HBD:
3#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.28DETAILS
Type:
UnknownAlogP:
4.65Polar Surface Area:
146.30HBA:
9HBD:
4#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.14DETAILS
Type:
UnknownAlogP:
5.38Polar Surface Area:
137.51HBA:
9HBD:
3#RO5 Violations:
2#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.15DETAILS-
Type:
UnknownAlogP:
5.11Polar Surface Area:
153.64HBA:
11HBD:
3#RO5 Violations:
3#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.12DETAILS -
Type:
UnknownAlogP:
4.23Polar Surface Area:
146.74HBA:
10HBD:
3#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.16DETAILS -
Type:
UnknownAlogP:
5.82Polar Surface Area:
146.30HBA:
9HBD:
4#RO5 Violations:
2#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.11DETAILS -
Type:
UnknownAlogP:
5.24Polar Surface Area:
137.51HBA:
9HBD:
3#RO5 Violations:
2#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.14DETAILS -
Type:
UnknownAlogP:
5.85Polar Surface Area:
140.75HBA:
10HBD:
3#RO5 Violations:
2#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.12DETAILS - ALA4546981
Name:
14-O-(((4-amino-1H-pyrrolo[2,3-d]pyrimidin-6-yl)thio)acetyl)mutilinMol. Formula:
C28H38N4O4SM.W.:
526.70Type:
UnknownAlogP:
4.54Polar Surface Area:
131.19HBA:
8HBD:
3#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.22DETAILS -
Type:
UnknownAlogP:
3.80Polar Surface Area:
149.54HBA:
10HBD:
4#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.14DETAILS -
Type:
UnknownAlogP:
4.60Polar Surface Area:
157.74HBA:
10HBD:
4#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.13DETAILS -
Type:
UnknownAlogP:
4.35Polar Surface Area:
157.74HBA:
10HBD:
4#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.14DETAILS -
Type:
UnknownAlogP:
4.14Polar Surface Area:
140.75HBA:
10HBD:
3#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.16DETAILS -
Type:
UnknownAlogP:
6.77Polar Surface Area:
137.51HBA:
9HBD:
3#RO5 Violations:
2#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.09DETAILS -
Type:
UnknownAlogP:
4.92Polar Surface Area:
140.75HBA:
10HBD:
3#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.14DETAILS -
Type:
UnknownAlogP:
5.72Polar Surface Area:
140.75HBA:
10HBD:
3#RO5 Violations:
2#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.11DETAILS -
Type:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
Small moleculeAlogP:
2.29Polar Surface Area:
216.68HBA:
11HBD:
6#RO5 Violations:
3#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.19DETAILS
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