Type:
Small moleculeAlogP:
-0.50Polar Surface Area:
130.61HBA:
7HBD:
6#RO5 Violations:
1#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.36DETAILS
Type:
Small moleculeAlogP:
-1.79Polar Surface Area:
189.53HBA:
11HBD:
8#RO5 Violations:
3#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.20DETAILS
Type:
Small moleculeAlogP:
-2.81Polar Surface Area:
209.76HBA:
12HBD:
9#RO5 Violations:
3#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.17DETAILS
Type:
Small moleculeAlogP:
3.50Polar Surface Area:
214.70HBA:
14HBD:
2#RO5 Violations:
2#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.14DETAILS
Type:
Small moleculeAlogP:
4.07Polar Surface Area:
220.77HBA:
15HBD:
1#RO5 Violations:
2#Rotatable Bonds:
13Passes Ro3:
NQED Weighted:
0.13DETAILS-
Type:
Small moleculeAlogP:
3.25Polar Surface Area:
61.83HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
14Passes Ro3:
NQED Weighted:
0.36DETAILS -
Type:
Small moleculeAlogP:
2.47Polar Surface Area:
61.83HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.40DETAILS -
Type:
Small moleculeAlogP:
1.40Polar Surface Area:
61.83HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.48DETAILS -
Type:
Small moleculeAlogP:
1.69Polar Surface Area:
61.83HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.43DETAILS -
Type:
Small moleculeAlogP:
5.43Polar Surface Area:
52.60HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
16Passes Ro3:
NQED Weighted:
0.28DETAILS -
Type:
Small moleculeAlogP:
3.87Polar Surface Area:
52.60HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.40DETAILS -
Type:
Small moleculeAlogP:
3.09Polar Surface Area:
52.60HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.56DETAILS -
Type:
Small moleculeAlogP:
2.02Polar Surface Area:
52.60HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.65DETAILS -
Type:
Small moleculeAlogP:
2.31Polar Surface Area:
52.60HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.60DETAILS - Propane-1，2-diyl dioctanoate
Name:
Propylene glycol-1,2-dioctanoateMol. Formula:
C19H36O4M.W.:
328.49Type:
Small moleculeAlogP:
5.18Polar Surface Area:
52.60HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
15Passes Ro3:
NQED Weighted:
0.31DETAILS -
Type:
Small moleculeAlogP:
4.11Polar Surface Area:
52.60HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.54DETAILS -
Type:
Small moleculeAlogP:
3.62Polar Surface Area:
52.60HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.43DETAILS -
Type:
Small moleculeAlogP:
2.84Polar Surface Area:
52.60HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.59DETAILS -
Type:
Small moleculeAlogP:
1.77Polar Surface Area:
52.60HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.66DETAILS -
Type:
Small moleculeAlogP:
2.06Polar Surface Area:
52.60HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.61DETAILS
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