Type:
Small moleculeAlogP:
2.45Polar Surface Area:
124.29HBA:
7HBD:
4#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.35DETAILS
Type:
Small moleculeAlogP:
2.45Polar Surface Area:
124.29HBA:
7HBD:
4#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.35DETAILS
Type:
Small moleculeAlogP:
0.65Polar Surface Area:
156.66HBA:
10HBD:
3#RO5 Violations:
1#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.30DETAILS
Type:
Small moleculeAlogP:
-0.12Polar Surface Area:
158.19HBA:
11HBD:
2#RO5 Violations:
2#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.31DETAILS
Type:
Small moleculeAlogP:
-0.12Polar Surface Area:
158.19HBA:
11HBD:
2#RO5 Violations:
2#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.31DETAILS-
Type:
Small moleculeAlogP:
0.53Polar Surface Area:
145.66HBA:
10HBD:
2#RO5 Violations:
1#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.34DETAILS -
Type:
Small moleculeAlogP:
3.25Polar Surface Area:
102.20HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.58DETAILS -
Type:
Small moleculeAlogP:
3.96Polar Surface Area:
102.20HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.53DETAILS - ALA270799
Name:
9-fluoro-5H-6-thia-4,5-diaza-chrysene 6,6-dioxideMol. Formula:
C15H9FN2O2SM.W.:
300.31Type:
Small moleculeAlogP:
3.16Polar Surface Area:
59.06HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.69DETAILS - ALA270798
Name:
2-methyl-5H-6-thia-4,5-diaza-chrysene 6,6-dioxideMol. Formula:
C16H12N2O2SM.W.:
296.35Type:
Small moleculeAlogP:
3.32Polar Surface Area:
59.06HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.69DETAILS - ALA270584
Name:
2-methoxy-5H-6-thia-4,5-diaza-chrysene 6,6-dioxideMol. Formula:
C16H12N2O3SM.W.:
312.35Type:
Small moleculeAlogP:
3.02Polar Surface Area:
68.29HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.75DETAILS - ALA429599
Name:
9-chloro-5H-6-thia-4,5-diaza-chrysene 6,6-dioxideMol. Formula:
C15H9ClN2O2SM.W.:
316.77Type:
Small moleculeAlogP:
3.67Polar Surface Area:
59.06HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.69DETAILS -
Type:
Small moleculeAlogP:
3.26Polar Surface Area:
111.43HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.54DETAILS -
Type:
Small moleculeAlogP:
4.27Polar Surface Area:
102.20HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.51DETAILS -
Type:
Small moleculeAlogP:
3.64Polar Surface Area:
68.29HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.73DETAILS -
Type:
Small moleculeAlogP:
4.34Polar Surface Area:
59.06HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.65DETAILS -
Type:
Small moleculeAlogP:
3.33Polar Surface Area:
68.29HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.74DETAILS -
Type:
Small moleculeAlogP:
3.03Polar Surface Area:
79.29HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.67DETAILS -
Type:
Small moleculeAlogP:
3.26Polar Surface Area:
111.43HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.54DETAILS -
Type:
Small moleculeAlogP:
3.56Polar Surface Area:
102.20HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.57DETAILS
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