Type:
---AlogP:
4.80Polar Surface Area:
112.53HBA:
11HBD:
1#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.41DETAILS
Type:
UnknownAlogP:
-0.75Polar Surface Area:
225.06HBA:
14HBD:
8#RO5 Violations:
3#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.12DETAILS
Type:
UnknownAlogP:
-2.56Polar Surface Area:
294.03HBA:
9HBD:
11#RO5 Violations:
2#Rotatable Bonds:
15Passes Ro3:
NQED Weighted:
0.04DETAILS
Type:
UnknownAlogP:
1.43Polar Surface Area:
145.91HBA:
9HBD:
5#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.27DETAILS
Type:
UnknownAlogP:
0.61Polar Surface Area:
162.98HBA:
10HBD:
5#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.19DETAILS-
Type:
UnknownAlogP:
0.97Polar Surface Area:
151.98HBA:
10HBD:
4#RO5 Violations:
1#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.22DETAILS -
Type:
UnknownAlogP:
3.19Polar Surface Area:
150.35HBA:
11HBD:
2#RO5 Violations:
2#Rotatable Bonds:
14Passes Ro3:
NQED Weighted:
0.07DETAILS -
Type:
UnknownAlogP:
2.07Polar Surface Area:
124.05HBA:
9HBD:
2#RO5 Violations:
1#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.30DETAILS -
Type:
UnknownAlogP:
2.07Polar Surface Area:
124.05HBA:
9HBD:
2#RO5 Violations:
1#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.30DETAILS -
Type:
UnknownAlogP:
2.32Polar Surface Area:
124.05HBA:
9HBD:
2#RO5 Violations:
1#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.14DETAILS -
Type:
Small moleculeAlogP:
2.83Polar Surface Area:
55.76HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.94DETAILS - ALA4217359
Name:
3-(3-Hydroxy-4-methoxybenzyl)-5-methoxychroman-4-oneMol. Formula:
C18H18O5M.W.:
314.34Type:
Small moleculeAlogP:
2.84Polar Surface Area:
64.99HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.94DETAILS -
Type:
Small moleculeAlogP:
2.83Polar Surface Area:
55.76HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.94DETAILS -
Type:
Small moleculeAlogP:
3.15Polar Surface Area:
53.99HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.84DETAILS -
Type:
Small moleculeAlogP:
3.44Polar Surface Area:
35.53HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.86DETAILS -
Type:
Small moleculeAlogP:
3.14Polar Surface Area:
44.76HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.87DETAILS -
Type:
Small moleculeAlogP:
3.14Polar Surface Area:
44.76HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.87DETAILS -
Type:
Small moleculeAlogP:
3.44Polar Surface Area:
35.53HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.86DETAILS -
Type:
Small moleculeAlogP:
3.13Polar Surface Area:
46.53HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.91DETAILS -
Type:
Small moleculeAlogP:
3.43Polar Surface Area:
26.30HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.82DETAILS
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