Type:
---AlogP:
4.12Polar Surface Area:
124.93HBA:
6HBD:
3#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.34DETAILS
Type:
---AlogP:
6.80Polar Surface Area:
236.01HBA:
15HBD:
5#RO5 Violations:
3#Rotatable Bonds:
14Passes Ro3:
NQED Weighted:
0.06DETAILS
Type:
---AlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
Type:
---AlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
Type:
Small moleculeAlogP:
2.19Polar Surface Area:
69.72HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.68DETAILS-
Type:
Small moleculeAlogP:
2.02Polar Surface Area:
87.30HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.60DETAILS -
Type:
Small moleculeAlogP:
1.29Polar Surface Area:
104.37HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.35DETAILS -
Type:
Small moleculeAlogP:
2.19Polar Surface Area:
69.72HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.68DETAILS -
Type:
UnknownAlogP:
0.64Polar Surface Area:
126.13HBA:
8HBD:
4#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.53DETAILS -
Type:
UnknownAlogP:
0.01Polar Surface Area:
126.13HBA:
8HBD:
4#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.45DETAILS -
Type:
UnknownAlogP:
0.00Polar Surface Area:
126.13HBA:
8HBD:
4#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.46DETAILS -
Type:
UnknownAlogP:
0.44Polar Surface Area:
126.13HBA:
8HBD:
4#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.54DETAILS -
Type:
UnknownAlogP:
-0.13Polar Surface Area:
126.13HBA:
8HBD:
4#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.47DETAILS -
Type:
UnknownAlogP:
-0.27Polar Surface Area:
139.27HBA:
9HBD:
4#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.51DETAILS -
Type:
UnknownAlogP:
-0.38Polar Surface Area:
126.13HBA:
8HBD:
4#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.56DETAILS -
Type:
UnknownAlogP:
0.19Polar Surface Area:
126.13HBA:
9HBD:
4#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.53DETAILS - ALA4640462
Name:
7-(Cyclopropylethynyl)-4-aza-7,9-dideazaadenosineMol. Formula:
C16H18N4O4M.W.:
330.34Type:
UnknownAlogP:
-0.77Polar Surface Area:
126.13HBA:
8HBD:
4#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.53DETAILS -
Type:
UnknownAlogP:
-0.07Polar Surface Area:
126.13HBA:
9HBD:
4#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.46DETAILS -
Type:
UnknownAlogP:
0.13Polar Surface Area:
126.13HBA:
8HBD:
4#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.53DETAILS - ALA4636054
Name:
7-(2,4-Difluorophenyl)-4-aza-7,9-dideazaadenosineMol. Formula:
C17H16F2N4O4M.W.:
378.34Type:
UnknownAlogP:
0.41Polar Surface Area:
126.13HBA:
8HBD:
4#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.52DETAILS
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